*HEADER    VIRAL PROTEIN                           10-FEB-07   2EC7              
*TITLE     SOLUTION STRUCTURE OF HUMAN IMMUNODIFICIENCY VIRUS TYPE-2             
*TITLE    2 NUCLEOCAPSID PROTEIN                                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GAG POLYPROTEIN (PR55GAG);                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: CCHC-TYPE 1, CCHC-TYPE 2;                                  
*COMPND   5 SYNONYM: NUCLEOCAPSID PROTEIN (NCP8);                                
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 2;            
*SOURCE   3 ORGANISM_COMMON: HIV-2;                                              
*SOURCE   4 STRAIN: ISOLATE GHANA-1 SUBTYPE A;                                   
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                                
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PTKK19                                    
*KEYWDS    NUCLEOCAPSID PROTEIN, HIV-2, RNA RECOGNITION, ZINC FINGER,            
*KEYWDS   2 VIRAL PROTEIN                                                        
*EXPDTA    NMR, 11 STRUCTURES                                                    
*AUTHOR    T.MATSUI, Y.KODERA, T.TANAKA, H.ENDOH, H.TANAKA, E.MIYAUCHI,          
*AUTHOR   2 H.KOMATSU, T.KOHNO, T.MAEDA                                          
*REVDAT   1   19-FEB-08 2EC7    0

! ANSIG v3.3 XPLOR distance restraints file
! Distance corrections applied.
! Trivial distances output.

! residue 1    Ala , intraresidue NOEs

! residue 1    Ala , NOEs forward in sequence
assi (resi 1    and name HA  ) (resi 2    and name HN  )  2.00  0.20  4.00

! residue 2    Gln , intraresidue NOEs

! residue 2    Gln , NOEs forward in sequence
assi (resi 2    and name HA  ) (resi 3    and name HN  )  2.00  0.20  1.50

! residue 3    Gln , intraresidue NOEs
assi (resi 3    and name HN  ) (resi 3    and name HB# )  2.00  0.20  4.00
assi (resi 3    and name HN  ) (resi 3    and name HG# )  2.00  0.20  5.00
assi (resi 3    and name HA  ) (resi 3    and name HB# )  2.00  0.20  1.50
assi (resi 3    and name HA  ) (resi 3    and name HG# )  2.00  0.20  1.50
assi (resi 3    and name HB# ) (resi 3    and name HB# )  2.00  0.20  2.50
assi (resi 3    and name HB# ) (resi 3    and name HG# )  2.00  0.20  2.50

! residue 3    Gln , NOEs forward in sequence
assi (resi 3    and name HA  ) (resi 4    and name HN  )  2.00  0.20  0.50
assi (resi 3    and name HB# ) (resi 4    and name HN  )  2.00  0.20  5.00
assi (resi 3    and name HG# ) (resi 4    and name HN  )  2.00  0.20  5.00

! residue 4    Arg , intraresidue NOEs
assi (resi 4    and name HN  ) (resi 4    and name HB# )  2.00  0.20  2.50
assi (resi 4    and name HN  ) (resi 4    and name HG# )  2.00  0.20  4.00
assi (resi 4    and name HG# ) (resi 4    and name HD# )  2.00  0.20  2.50

! residue 4    Arg , NOEs forward in sequence
assi (resi 4    and name HA  ) (resi 5    and name HN  )  2.00  0.20  0.50
assi (resi 4    and name HG# ) (resi 5    and name HN  )  2.00  0.20  4.00

! residue 5    Lys , intraresidue NOEs
assi (resi 5    and name HN  ) (resi 5    and name HB# )  2.00  0.20  2.50
assi (resi 5    and name HN  ) (resi 5    and name HD# )  2.00  0.20  5.00
assi (resi 5    and name HA  ) (resi 5    and name HB# )  2.00  0.20  2.50
assi (resi 5    and name HA  ) (resi 5    and name HD# )  2.00  0.20  4.00
assi (resi 5    and name HB# ) (resi 5    and name HD# )  2.00  0.20  2.50
assi (resi 5    and name HD# ) (resi 5    and name HE# )  2.00  0.20  5.00

! residue 5    Lys , NOEs forward in sequence
assi (resi 5    and name HN  ) (resi 6    and name HN  )  2.00  0.20  3.00
assi (resi 5    and name HA  ) (resi 6    and name HN  )  2.00  0.20  0.50
assi (resi 5    and name HA  ) (resi 6    and name HA  )  2.00  0.20  4.00
assi (resi 5    and name HA  ) (resi 6    and name HG# )  2.00  0.20  5.40
assi (resi 5    and name HB# ) (resi 6    and name HN  )  2.00  0.20  2.50
assi (resi 5    and name HG# ) (resi 6    and name HN  )  2.00  0.20  5.00
assi (resi 5    and name HD# ) (resi 6    and name HN  )  2.00  0.20  5.00
assi (resi 5    and name HD# ) (resi 6    and name HG# )  2.00  0.20  7.40
assi (resi 5    and name HB# ) (resi 8    and name HB# )  2.00  0.20  5.00

! residue 6    Val , intraresidue NOEs
assi (resi 6    and name HN  ) (resi 6    and name HA  )  2.00  0.20  1.50
assi (resi 6    and name HN  ) (resi 6    and name HB  )  2.00  0.20  1.50
assi (resi 6    and name HN  ) (resi 6    and name HG# )  2.00  0.20  3.90
assi (resi 6    and name HA  ) (resi 6    and name HB  )  2.00  0.20  3.00
assi (resi 6    and name HA  ) (resi 6    and name HG# )  2.00  0.20  3.90
assi (resi 6    and name HB  ) (resi 6    and name HG# )  2.00  0.20  2.90

! residue 6    Val , NOEs forward in sequence
assi (resi 6    and name HN  ) (resi 7    and name HN  )  2.00  0.20  3.00
assi (resi 6    and name HA  ) (resi 7    and name HN  )  2.00  0.20  0.50
assi (resi 6    and name HA  ) (resi 7    and name HB  )  2.00  0.20  3.00
assi (resi 6    and name HB  ) (resi 7    and name HN  )  2.00  0.20  3.00
assi (resi 6    and name HG# ) (resi 7    and name HN  )  2.00  0.20  3.90
assi (resi 6    and name HG# ) (resi 8    and name HB# )  2.00  0.20  7.40
assi (resi 6    and name HG# ) (resi 16   and name HN  )  2.00  0.20  6.40
assi (resi 6    and name HB  ) (resi 17   and name HN  )  2.00  0.20  4.00

! residue 7    Ile , intraresidue NOEs
assi (resi 7    and name HN  ) (resi 7    and name HA  )  2.00  0.20  0.50
assi (resi 7    and name HN  ) (resi 7    and name HB  )  2.00  0.20  1.50
assi (resi 7    and name HN  ) (resi 7    and name HG2#)  2.00  0.20  3.30
assi (resi 7    and name HN  ) (resi 7    and name HD1#)  2.00  0.20  3.30
assi (resi 7    and name HN  ) (resi 7    and name HG1#)  2.00  0.20  4.00
assi (resi 7    and name HA  ) (resi 7    and name HB  )  2.00  0.20  1.50
assi (resi 7    and name HA  ) (resi 7    and name HG2#)  2.00  0.20  1.80
assi (resi 7    and name HA  ) (resi 7    and name HD1#)  2.00  0.20  1.80
assi (resi 7    and name HA  ) (resi 7    and name HG1#)  2.00  0.20  4.00
assi (resi 7    and name HB  ) (resi 7    and name HG2#)  2.00  0.20  0.80
assi (resi 7    and name HB  ) (resi 7    and name HD1#)  2.00  0.20  1.80
assi (resi 7    and name HB  ) (resi 7    and name HG1#)  2.00  0.20  1.50
assi (resi 7    and name HG2#) (resi 7    and name HD1#)  2.00  0.20  1.10
assi (resi 7    and name HG2#) (resi 7    and name HG1#)  2.00  0.20  1.80
assi (resi 7    and name HD1#) (resi 7    and name HG1#)  2.00  0.20  1.80
assi (resi 7    and name HG1#) (resi 7    and name HG1#)  2.00  0.20  2.50

! residue 7    Ile , NOEs forward in sequence
assi (resi 7    and name HN  ) (resi 8    and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HA  ) (resi 8    and name HN  )  2.00  0.20  0.50
assi (resi 7    and name HA  ) (resi 8    and name HA  )  2.00  0.20  3.00
assi (resi 7    and name HA  ) (resi 8    and name HB# )  2.00  0.20  4.00
assi (resi 7    and name HB  ) (resi 8    and name HN  )  2.00  0.20  3.00
assi (resi 7    and name HG2#) (resi 8    and name HN  )  2.00  0.20  3.30
assi (resi 7    and name HD1#) (resi 8    and name HN  )  2.00  0.20  4.30
assi (resi 7    and name HN  ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HN  ) (resi 16   and name HA# )  2.00  0.20  5.00
assi (resi 7    and name HA  ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HB  ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HG2#) (resi 16   and name HN  )  2.00  0.20  4.30
assi (resi 7    and name HG2#) (resi 16   and name HA# )  2.00  0.20  5.30
assi (resi 7    and name HA  ) (resi 17   and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HB  ) (resi 17   and name HN  )  2.00  0.20  4.00
assi (resi 7    and name HG2#) (resi 17   and name HN  )  2.00  0.20  3.30
assi (resi 7    and name HG2#) (resi 17   and name HA  )  2.00  0.20  4.30
assi (resi 7    and name HD1#) (resi 17   and name HN  )  2.00  0.20  4.30
assi (resi 7    and name HD1#) (resi 17   and name HA  )  2.00  0.20  4.30
assi (resi 7    and name HG2#) (resi 18   and name HN  )  2.00  0.20  4.30
assi (resi 7    and name HG2#) (resi 18   and name HA  )  2.00  0.20  3.30
assi (resi 7    and name HG2#) (resi 18   and name HB2 )  2.00  0.20  4.30
assi (resi 7    and name HD1#) (resi 18   and name HN  )  2.00  0.20  4.30
assi (resi 7    and name HD1#) (resi 18   and name HA  )  2.00  0.20  4.30
assi (resi 7    and name HD1#) (resi 18   and name HB2 )  2.00  0.20  4.30

! residue 8    Arg , intraresidue NOEs
assi (resi 8    and name HN  ) (resi 8    and name HA  )  2.00  0.20  1.50
assi (resi 8    and name HN  ) (resi 8    and name HB# )  2.00  0.20  2.50
assi (resi 8    and name HN  ) (resi 8    and name HG# )  2.00  0.20  4.00
assi (resi 8    and name HN  ) (resi 8    and name HD# )  2.00  0.20  5.00
assi (resi 8    and name HA  ) (resi 8    and name HB# )  2.00  0.20  2.50
assi (resi 8    and name HA  ) (resi 8    and name HG# )  2.00  0.20  4.00
assi (resi 8    and name HE  ) (resi 8    and name HB# )  2.00  0.20  4.00
assi (resi 8    and name HE  ) (resi 8    and name HG# )  2.00  0.20  4.00
assi (resi 8    and name HE  ) (resi 8    and name HD# )  2.00  0.20  4.00
assi (resi 8    and name HB# ) (resi 8    and name HG# )  2.00  0.20  2.50
assi (resi 8    and name HB# ) (resi 8    and name HD# )  2.00  0.20  3.50
assi (resi 8    and name HG# ) (resi 8    and name HD# )  2.00  0.20  3.50

! residue 8    Arg , NOEs forward in sequence
assi (resi 8    and name HA  ) (resi 9    and name HN  )  2.00  0.20  1.50
assi (resi 8    and name HA  ) (resi 9    and name HB1 )  2.00  0.20  4.00
assi (resi 8    and name HA  ) (resi 9    and name HB2 )  2.00  0.20  4.00
assi (resi 8    and name HB# ) (resi 9    and name HN  )  2.00  0.20  4.00
assi (resi 8    and name HG# ) (resi 9    and name HN  )  2.00  0.20  4.00
assi (resi 8    and name HD# ) (resi 9    and name HN  )  2.00  0.20  5.00
assi (resi 8    and name HA  ) (resi 14   and name HN  )  2.00  0.20  3.00
assi (resi 8    and name HA  ) (resi 14   and name HD# )  2.00  0.20  4.00
assi (resi 8    and name HN  ) (resi 15   and name HA  )  2.00  0.20  4.00
assi (resi 8    and name HA  ) (resi 15   and name HN  )  2.00  0.20  1.50
assi (resi 8    and name HB# ) (resi 15   and name HA  )  2.00  0.20  4.00
assi (resi 8    and name HG# ) (resi 15   and name HN  )  2.00  0.20  5.00
assi (resi 8    and name HG# ) (resi 15   and name HA  )  2.00  0.20  4.00
assi (resi 8    and name HB# ) (resi 16   and name HN  )  2.00  0.20  5.00
assi (resi 8    and name HG# ) (resi 16   and name HN  )  2.00  0.20  5.00

! residue 9    Cys , intraresidue NOEs
assi (resi 9    and name HN  ) (resi 9    and name HA  )  2.00  0.20  3.00
assi (resi 9    and name HN  ) (resi 9    and name HB1 )  2.00  0.20  1.50
assi (resi 9    and name HN  ) (resi 9    and name HB2 )  2.00  0.20  1.50
assi (resi 9    and name HA  ) (resi 9    and name HB1 )  2.00  0.20  1.50
assi (resi 9    and name HA  ) (resi 9    and name HB2 )  2.00  0.20  1.50
assi (resi 9    and name HB1 ) (resi 9    and name HB2 )  2.00  0.20  0.50

! residue 9    Cys , NOEs forward in sequence
assi (resi 9    and name HN  ) (resi 10   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HA  ) (resi 10   and name HN  )  2.00  0.20  0.50
assi (resi 9    and name HB1 ) (resi 10   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HB2 ) (resi 10   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HA  ) (resi 11   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HB1 ) (resi 12   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HB2 ) (resi 12   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HN  ) (resi 13   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HN  ) (resi 13   and name HA# )  2.00  0.20  5.00
assi (resi 9    and name HB1 ) (resi 13   and name HN  )  2.00  0.20  3.00
assi (resi 9    and name HB2 ) (resi 13   and name HN  )  2.00  0.20  3.00
assi (resi 9    and name HN  ) (resi 14   and name HN  )  2.00  0.20  3.00
assi (resi 9    and name HN  ) (resi 14   and name HA  )  2.00  0.20  3.00
assi (resi 9    and name HB1 ) (resi 14   and name HN  )  2.00  0.20  3.00
assi (resi 9    and name HN  ) (resi 15   and name HA  )  2.00  0.20  4.00
assi (resi 9    and name HN  ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HN  ) (resi 17   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HN  ) (resi 17   and name HD2 )  2.00  0.20  4.00
assi (resi 9    and name HB1 ) (resi 17   and name HN  )  2.00  0.20  4.00
assi (resi 9    and name HB1 ) (resi 17   and name HD2 )  2.00  0.20  3.00
assi (resi 9    and name HB2 ) (resi 17   and name HN  )  2.00  0.20  3.00
assi (resi 9    and name HB2 ) (resi 17   and name HD2 )  2.00  0.20  1.50
assi (resi 9    and name HN  ) (resi 18   and name HA  )  2.00  0.20  4.00
assi (resi 9    and name HB2 ) (resi 18   and name HA  )  2.00  0.20  3.00
assi (resi 9    and name HA  ) (resi 19   and name HN  )  2.00  0.20  3.00

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

! residue 10   Trp , NOEs forward in sequence
assi (resi 10   and name HN  ) (resi 11   and name HN  )  2.00  0.20  4.00
assi (resi 10   and name HN  ) (resi 11   and name HB# )  2.00  0.20  5.00
assi (resi 10   and name HE3 ) (resi 11   and name HA  )  2.00  0.20  4.00
assi (resi 10   and name HB# ) (resi 11   and name HN  )  2.00  0.20  5.00
assi (resi 10   and name HN  ) (resi 12   and name HN  )  2.00  0.20  4.00
assi (resi 10   and name HA  ) (resi 13   and name HN  )  2.00  0.20  4.00
assi (resi 10   and name HN  ) (resi 18   and name HA  )  2.00  0.20  4.00
assi (resi 10   and name HN  ) (resi 19   and name HN  )  2.00  0.20  4.00
assi (resi 10   and name HN  ) (resi 19   and name HA  )  2.00  0.20  4.00
assi (resi 10   and name HN  ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 10   and name HA  ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 10   and name HD1 ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 10   and name HE1 ) (resi 19   and name HB# )  2.00  0.20  4.30
assi (resi 10   and name HE3 ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 10   and name HH2 ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 10   and name HB# ) (resi 19   and name HN  )  2.00  0.20  5.00
assi (resi 10   and name HB# ) (resi 19   and name HB# )  2.00  0.20  2.80
assi (resi 10   and name HB# ) (resi 20   and name HN  )  2.00  0.20  5.00
assi (resi 10   and name HE1 ) (resi 31   and name HA  )  2.00  0.20  4.00
assi (resi 10   and name HB# ) (resi 31   and name HE3 )  2.00  0.20  4.00
assi (resi 10   and name HB# ) (resi 31   and name HZ2 )  2.00  0.20  2.50

! residue 11   Asn , intraresidue NOEs
assi (resi 11   and name HN  ) (resi 11   and name HA  )  2.00  0.20  3.00
assi (resi 11   and name HN  ) (resi 11   and name HB# )  2.00  0.20  4.00
assi (resi 11   and name HN  ) (resi 11   and name HD2#)  2.00  0.20  5.00
assi (resi 11   and name HA  ) (resi 11   and name HB# )  2.00  0.20  4.00
assi (resi 11   and name HB# ) (resi 11   and name HB# )  2.00  0.20  2.50
assi (resi 11   and name HB# ) (resi 11   and name HD2#)  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 11   and name HD2#)  2.00  0.20  3.50

! residue 11   Asn , NOEs forward in sequence
assi (resi 11   and name HN  ) (resi 12   and name HN  )  2.00  0.20  3.00
assi (resi 11   and name HA  ) (resi 12   and name HN  )  2.00  0.20  4.00
assi (resi 11   and name HB# ) (resi 12   and name HN  )  2.00  0.20  4.00
assi (resi 11   and name HD2#) (resi 12   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 12   and name HB1 )  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 12   and name HB2 )  2.00  0.20  5.00
assi (resi 11   and name HN  ) (resi 13   and name HN  )  2.00  0.20  4.00
assi (resi 11   and name HB# ) (resi 13   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HN  ) (resi 19   and name HA  )  2.00  0.20  4.00
assi (resi 11   and name HN  ) (resi 19   and name HB# )  2.00  0.20  3.30
assi (resi 11   and name HB# ) (resi 19   and name HB# )  2.00  0.20  4.30
assi (resi 11   and name HD2#) (resi 22   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 22   and name HB# )  2.00  0.20  6.00
assi (resi 11   and name HD2#) (resi 23   and name HD# )  2.00  0.20  6.00
assi (resi 11   and name HB# ) (resi 24   and name HB# )  2.00  0.20  5.30
assi (resi 11   and name HD2#) (resi 24   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 24   and name HB# )  2.00  0.20  4.30
assi (resi 11   and name HD2#) (resi 26   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HA  ) (resi 27   and name HE  )  2.00  0.20  4.00
assi (resi 11   and name HD2#) (resi 27   and name HN  )  2.00  0.20  5.00
assi (resi 11   and name HD2#) (resi 27   and name HA  )  2.00  0.20  4.00
assi (resi 11   and name HD2#) (resi 27   and name HG# )  2.00  0.20  6.00

! residue 12   Cys , intraresidue NOEs
assi (resi 12   and name HN  ) (resi 12   and name HA  )  2.00  0.20  4.00
assi (resi 12   and name HN  ) (resi 12   and name HB1 )  2.00  0.20  4.00
assi (resi 12   and name HN  ) (resi 12   and name HB2 )  2.00  0.20  3.00
assi (resi 12   and name HN  ) (resi 12   and name HB# )  2.00  0.20  5.00
assi (resi 12   and name HA  ) (resi 12   and name HB1 )  2.00  0.20  0.50
assi (resi 12   and name HA  ) (resi 12   and name HB2 )  2.00  0.20  1.50
assi (resi 12   and name HB1 ) (resi 12   and name HB2 )  2.00  0.20  0.50

! residue 12   Cys , NOEs forward in sequence
assi (resi 12   and name HN  ) (resi 13   and name HN  )  2.00  0.20  1.50
assi (resi 12   and name HN  ) (resi 13   and name HA# )  2.00  0.20  5.00
assi (resi 12   and name HA  ) (resi 13   and name HN  )  2.00  0.20  4.00
assi (resi 12   and name HB# ) (resi 13   and name HN  )  2.00  0.20  5.00
assi (resi 12   and name HN  ) (resi 14   and name HN  )  2.00  0.20  4.00
assi (resi 12   and name HB1 ) (resi 14   and name HN  )  2.00  0.20  4.00
assi (resi 12   and name HB2 ) (resi 14   and name HN  )  2.00  0.20  4.00
assi (resi 12   and name HN  ) (resi 19   and name HB# )  2.00  0.20  4.30
assi (resi 12   and name HN  ) (resi 24   and name HB# )  2.00  0.20  4.30
assi (resi 12   and name HA  ) (resi 24   and name HB# )  2.00  0.20  4.30
assi (resi 12   and name HB1 ) (resi 24   and name HB# )  2.00  0.20  1.80
assi (resi 12   and name HB2 ) (resi 24   and name HB# )  2.00  0.20  1.80

! residue 13   Gly , intraresidue NOEs
assi (resi 13   and name HN  ) (resi 13   and name HA# )  2.00  0.20  2.50

! residue 13   Gly , NOEs forward in sequence
assi (resi 13   and name HN  ) (resi 14   and name HN  )  2.00  0.20  3.00
assi (resi 13   and name HN  ) (resi 14   and name HA  )  2.00  0.20  4.00
assi (resi 13   and name HN  ) (resi 14   and name HG# )  2.00  0.20  5.00
assi (resi 13   and name HA# ) (resi 14   and name HN  )  2.00  0.20  5.00

! residue 14   Lys , intraresidue NOEs
assi (resi 14   and name HN  ) (resi 14   and name HA  )  2.00  0.20  1.50
assi (resi 14   and name HN  ) (resi 14   and name HB# )  2.00  0.20  2.50
assi (resi 14   and name HN  ) (resi 14   and name HG# )  2.00  0.20  4.00
assi (resi 14   and name HN  ) (resi 14   and name HD# )  2.00  0.20  3.00
assi (resi 14   and name HN  ) (resi 14   and name HE# )  2.00  0.20  5.00
assi (resi 14   and name HA  ) (resi 14   and name HZ# )  2.00  0.20  3.30
assi (resi 14   and name HA  ) (resi 14   and name HB# )  2.00  0.20  1.50
assi (resi 14   and name HA  ) (resi 14   and name HG# )  2.00  0.20  2.50
assi (resi 14   and name HZ# ) (resi 14   and name HB# )  2.00  0.20  4.30
assi (resi 14   and name HZ# ) (resi 14   and name HG# )  2.00  0.20  4.30
assi (resi 14   and name HZ# ) (resi 14   and name HD# )  2.00  0.20  2.80
assi (resi 14   and name HB# ) (resi 14   and name HB# )  2.00  0.20  2.50
assi (resi 14   and name HB# ) (resi 14   and name HG# )  2.00  0.20  2.50
assi (resi 14   and name HB# ) (resi 14   and name HD# )  2.00  0.20  2.50
assi (resi 14   and name HG# ) (resi 14   and name HG# )  2.00  0.20  2.50
assi (resi 14   and name HG# ) (resi 14   and name HD# )  2.00  0.20  2.50
assi (resi 14   and name HG# ) (resi 14   and name HE# )  2.00  0.20  2.50
assi (resi 14   and name HD# ) (resi 14   and name HE# )  2.00  0.20  2.50

! residue 14   Lys , NOEs forward in sequence
assi (resi 14   and name HN  ) (resi 15   and name HN  )  2.00  0.20  4.00
assi (resi 14   and name HA  ) (resi 15   and name HN  )  2.00  0.20  0.50
assi (resi 14   and name HA  ) (resi 15   and name HG# )  2.00  0.20  4.00
assi (resi 14   and name HZ# ) (resi 15   and name HB# )  2.00  0.20  1.80
assi (resi 14   and name HB# ) (resi 15   and name HN  )  2.00  0.20  2.50
assi (resi 14   and name HG# ) (resi 15   and name HN  )  2.00  0.20  5.00
assi (resi 14   and name HD# ) (resi 15   and name HN  )  2.00  0.20  2.50

! residue 15   Glu , intraresidue NOEs
assi (resi 15   and name HN  ) (resi 15   and name HA  )  2.00  0.20  3.00
assi (resi 15   and name HN  ) (resi 15   and name HB# )  2.00  0.20  1.50
assi (resi 15   and name HN  ) (resi 15   and name HG# )  2.00  0.20  4.00
assi (resi 15   and name HA  ) (resi 15   and name HB# )  2.00  0.20  2.50
assi (resi 15   and name HA  ) (resi 15   and name HG# )  2.00  0.20  4.00
assi (resi 15   and name HB# ) (resi 15   and name HG# )  2.00  0.20  2.50
assi (resi 15   and name HG# ) (resi 15   and name HG# )  2.00  0.20  2.50

! residue 15   Glu , NOEs forward in sequence
assi (resi 15   and name HN  ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 15   and name HA  ) (resi 16   and name HN  )  2.00  0.20  1.50
assi (resi 15   and name HB# ) (resi 16   and name HN  )  2.00  0.20  4.00
assi (resi 15   and name HG# ) (resi 16   and name HN  )  2.00  0.20  5.00

! residue 16   Gly , intraresidue NOEs
assi (resi 16   and name HN  ) (resi 16   and name HA# )  2.00  0.20  2.50
assi (resi 16   and name HA# ) (resi 16   and name HA# )  2.00  0.20  2.50

! residue 16   Gly , NOEs forward in sequence
assi (resi 16   and name HN  ) (resi 17   and name HN  )  2.00  0.20  1.50
assi (resi 16   and name HN  ) (resi 17   and name HA  )  2.00  0.20  3.00
assi (resi 16   and name HA# ) (resi 17   and name HN  )  2.00  0.20  4.00

! residue 17   His , intraresidue NOEs
assi (resi 17   and name HN  ) (resi 17   and name HA  )  2.00  0.20  3.00
assi (resi 17   and name HN  ) (resi 17   and name HB# )  2.00  0.20  4.00
assi (resi 17   and name HA  ) (resi 17   and name HD2 )  2.00  0.20  3.00
assi (resi 17   and name HA  ) (resi 17   and name HB# )  2.00  0.20  1.50
assi (resi 17   and name HD2 ) (resi 17   and name HB# )  2.00  0.20  2.50

! residue 17   His , NOEs forward in sequence
assi (resi 17   and name HN  ) (resi 18   and name HN  )  2.00  0.20  4.00
assi (resi 17   and name HA  ) (resi 18   and name HN  )  2.00  0.20  1.50
assi (resi 17   and name HD2 ) (resi 18   and name HN  )  2.00  0.20  4.00
assi (resi 17   and name HD2 ) (resi 18   and name HA  )  2.00  0.20  3.00
assi (resi 17   and name HB# ) (resi 18   and name HN  )  2.00  0.20  2.50
assi (resi 17   and name HD2 ) (resi 19   and name HA  )  2.00  0.20  4.00
assi (resi 17   and name HD2 ) (resi 20   and name HN  )  2.00  0.20  4.00
! assi (resi 17   and name HA  ) (resi 21   and name HB# )  2.00  0.20  4.00
assi (resi 17   and name HD2 ) (resi 21   and name HN  )  2.00  0.20  4.00
assi (resi 17   and name HD2 ) (resi 21   and name HB# )  2.00  0.20  5.00
assi (resi 17   and name HD2 ) (resi 21   and name HG# )  2.00  0.20  2.50
assi (resi 17   and name HB# ) (resi 21   and name HN  )  2.00  0.20  5.00
assi (resi 17   and name HB# ) (resi 21   and name HB# )  2.00  0.20  3.50
assi (resi 17   and name HB# ) (resi 21   and name HG# )  2.00  0.20  5.00
assi (resi 17   and name HD2 ) (resi 22   and name HN  )  2.00  0.20  4.00
assi (resi 17   and name HD2 ) (resi 22   and name HA  )  2.00  0.20  3.00
assi (resi 17   and name HD2 ) (resi 22   and name HB# )  2.00  0.20  2.50
assi (resi 17   and name HB# ) (resi 22   and name HN  )  2.00  0.20  5.00
assi (resi 17   and name HD2 ) (resi 23   and name HN  )  2.00  0.20  4.00

! residue 18   Ser , intraresidue NOEs
assi (resi 18   and name HN  ) (resi 18   and name HA  )  2.00  0.20  1.50
assi (resi 18   and name HN  ) (resi 18   and name HB1 )  2.00  0.20  3.00
assi (resi 18   and name HN  ) (resi 18   and name HB2 )  2.00  0.20  3.00
assi (resi 18   and name HA  ) (resi 18   and name HB1 )  2.00  0.20  1.50
assi (resi 18   and name HA  ) (resi 18   and name HB2 )  2.00  0.20  1.50
assi (resi 18   and name HB1 ) (resi 18   and name HB2 )  2.00  0.20  0.50

! residue 18   Ser , NOEs forward in sequence
assi (resi 18   and name HN  ) (resi 19   and name HN  )  2.00  0.20  4.00
assi (resi 18   and name HA  ) (resi 19   and name HN  )  2.00  0.20  1.50
assi (resi 18   and name HB1 ) (resi 19   and name HN  )  2.00  0.20  1.50
assi (resi 18   and name HB1 ) (resi 19   and name HB# )  2.00  0.20  4.30
assi (resi 18   and name HB2 ) (resi 19   and name HN  )  2.00  0.20  3.00
assi (resi 18   and name HB2 ) (resi 19   and name HB# )  2.00  0.20  4.30
assi (resi 18   and name HN  ) (resi 20   and name HN  )  2.00  0.20  4.00
assi (resi 18   and name HA  ) (resi 20   and name HN  )  2.00  0.20  4.00
assi (resi 18   and name HB2 ) (resi 20   and name HN  )  2.00  0.20  4.00
assi (resi 18   and name HN  ) (resi 21   and name HN  )  2.00  0.20  4.00
assi (resi 18   and name HN  ) (resi 21   and name HA  )  2.00  0.20  4.00
assi (resi 18   and name HN  ) (resi 21   and name HB# )  2.00  0.20  4.00
assi (resi 18   and name HN  ) (resi 21   and name HG# )  2.00  0.20  4.00

! residue 19   Ala , intraresidue NOEs
assi (resi 19   and name HN  ) (resi 19   and name HA  )  2.00  0.20  3.00
assi (resi 19   and name HN  ) (resi 19   and name HB# )  2.00  0.20  1.80
assi (resi 19   and name HA  ) (resi 19   and name HB# )  2.00  0.20  1.80

! residue 19   Ala , NOEs forward in sequence
assi (resi 19   and name HN  ) (resi 20   and name HN  )  2.00  0.20  4.00
assi (resi 19   and name HN  ) (resi 20   and name HB# )  2.00  0.20  5.00
assi (resi 19   and name HA  ) (resi 20   and name HN  )  2.00  0.20  4.00
assi (resi 19   and name HA  ) (resi 20   and name HA  )  2.00  0.20  4.00
assi (resi 19   and name HB# ) (resi 20   and name HN  )  2.00  0.20  3.30
assi (resi 19   and name HB# ) (resi 20   and name HA  )  2.00  0.20  3.30
assi (resi 19   and name HB# ) (resi 20   and name HB# )  2.00  0.20  5.30
assi (resi 19   and name HA  ) (resi 21   and name HN  )  2.00  0.20  4.00
assi (resi 19   and name HB# ) (resi 21   and name HN  )  2.00  0.20  4.30
assi (resi 19   and name HA  ) (resi 22   and name HN  )  2.00  0.20  4.00
assi (resi 19   and name HB# ) (resi 22   and name HN  )  2.00  0.20  4.30
assi (resi 19   and name HB# ) (resi 22   and name HB# )  2.00  0.20  4.30

! residue 20   Arg , intraresidue NOEs
assi (resi 20   and name HN  ) (resi 20   and name HA  )  2.00  0.20  1.50
assi (resi 20   and name HN  ) (resi 20   and name HB# )  2.00  0.20  2.50
assi (resi 20   and name HN  ) (resi 20   and name HG# )  2.00  0.20  4.00
assi (resi 20   and name HN  ) (resi 20   and name HD# )  2.00  0.20  5.00
assi (resi 20   and name HA  ) (resi 20   and name HB# )  2.00  0.20  1.50
assi (resi 20   and name HA  ) (resi 20   and name HG# )  2.00  0.20  2.50
assi (resi 20   and name HA  ) (resi 20   and name HD# )  2.00  0.20  4.00
assi (resi 20   and name HE  ) (resi 20   and name HG# )  2.00  0.20  5.00
assi (resi 20   and name HE  ) (resi 20   and name HD# )  2.00  0.20  4.00
assi (resi 20   and name HG# ) (resi 20   and name HD# )  2.00  0.20  2.50

! residue 20   Arg , NOEs forward in sequence
assi (resi 20   and name HN  ) (resi 21   and name HN  )  2.00  0.20  3.00
assi (resi 20   and name HN  ) (resi 21   and name HA  )  2.00  0.20  4.00
assi (resi 20   and name HN  ) (resi 21   and name HG# )  2.00  0.20  5.00
assi (resi 20   and name HA  ) (resi 21   and name HN  )  2.00  0.20  4.00
assi (resi 20   and name HB# ) (resi 21   and name HN  )  2.00  0.20  5.00
assi (resi 20   and name HG# ) (resi 21   and name HN  )  2.00  0.20  5.00
assi (resi 20   and name HG# ) (resi 21   and name HG# )  2.00  0.20  5.00
assi (resi 20   and name HN  ) (resi 22   and name HN  )  2.00  0.20  4.00
assi (resi 20   and name HA  ) (resi 22   and name HN  )  2.00  0.20  4.00
assi (resi 20   and name HB# ) (resi 22   and name HN  )  2.00  0.20  5.00
assi (resi 20   and name HG# ) (resi 22   and name HN  )  2.00  0.20  5.00

! residue 21   Gln , intraresidue NOEs
assi (resi 21   and name HN  ) (resi 21   and name HA  )  2.00  0.20  3.00
assi (resi 21   and name HN  ) (resi 21   and name HB# )  2.00  0.20  2.50
assi (resi 21   and name HN  ) (resi 21   and name HG# )  2.00  0.20  4.00
assi (resi 21   and name HA  ) (resi 21   and name HB# )  2.00  0.20  1.50
assi (resi 21   and name HA  ) (resi 21   and name HG# )  2.00  0.20  2.50
assi (resi 21   and name HE21) (resi 21   and name HE22)  2.00  0.20  1.50
assi (resi 21   and name HB# ) (resi 21   and name HG# )  2.00  0.20  2.50
assi (resi 21   and name HB# ) (resi 21   and name HE2#)  2.00  0.20  6.00
assi (resi 21   and name HG# ) (resi 21   and name HG# )  2.00  0.20  2.50
assi (resi 21   and name HG# ) (resi 21   and name HE2#)  2.00  0.20  5.00

! residue 21   Gln , NOEs forward in sequence
assi (resi 21   and name HN  ) (resi 22   and name HN  )  2.00  0.20  1.50
assi (resi 21   and name HN  ) (resi 22   and name HA  )  2.00  0.20  4.00
assi (resi 21   and name HN  ) (resi 22   and name HB# )  2.00  0.20  5.00
assi (resi 21   and name HA  ) (resi 22   and name HN  )  2.00  0.20  3.00
assi (resi 21   and name HB# ) (resi 22   and name HN  )  2.00  0.20  5.00
assi (resi 21   and name HG# ) (resi 22   and name HN  )  2.00  0.20  5.00

! residue 22   Cys , intraresidue NOEs
assi (resi 22   and name HN  ) (resi 22   and name HA  )  2.00  0.20  3.00
assi (resi 22   and name HN  ) (resi 22   and name HB# )  2.00  0.20  2.50
assi (resi 22   and name HA  ) (resi 22   and name HB# )  2.00  0.20  2.50
assi (resi 22   and name HB# ) (resi 22   and name HB# )  2.00  0.20  2.50

! residue 22   Cys , NOEs forward in sequence
assi (resi 22   and name HN  ) (resi 23   and name HN  )  2.00  0.20  4.00
assi (resi 22   and name HA  ) (resi 23   and name HN  )  2.00  0.20  1.50
assi (resi 22   and name HA  ) (resi 23   and name HG# )  2.00  0.20  4.00
assi (resi 22   and name HB# ) (resi 23   and name HN  )  2.00  0.20  5.00
assi (resi 22   and name HA  ) (resi 24   and name HN  )  2.00  0.20  1.50
assi (resi 22   and name HB# ) (resi 24   and name HN  )  2.00  0.20  5.00

! residue 23   Arg , intraresidue NOEs
assi (resi 23   and name HN  ) (resi 23   and name HA  )  2.00  0.20  3.00
assi (resi 23   and name HN  ) (resi 23   and name HB# )  2.00  0.20  4.00
assi (resi 23   and name HN  ) (resi 23   and name HG# )  2.00  0.20  2.50
assi (resi 23   and name HN  ) (resi 23   and name HD# )  2.00  0.20  5.00
assi (resi 23   and name HA  ) (resi 23   and name HB# )  2.00  0.20  2.50
assi (resi 23   and name HA  ) (resi 23   and name HG# )  2.00  0.20  4.00
assi (resi 23   and name HA  ) (resi 23   and name HD# )  2.00  0.20  4.00
assi (resi 23   and name HE  ) (resi 23   and name HD# )  2.00  0.20  4.00
assi (resi 23   and name HB# ) (resi 23   and name HB# )  2.00  0.20  2.50
assi (resi 23   and name HB# ) (resi 23   and name HG# )  2.00  0.20  3.50
assi (resi 23   and name HB# ) (resi 23   and name HD# )  2.00  0.20  5.00
assi (resi 23   and name HG# ) (resi 23   and name HD# )  2.00  0.20  2.50

! residue 23   Arg , NOEs forward in sequence
assi (resi 23   and name HN  ) (resi 24   and name HN  )  2.00  0.20  0.50
assi (resi 23   and name HN  ) (resi 24   and name HB# )  2.00  0.20  3.30
assi (resi 23   and name HB# ) (resi 24   and name HN  )  2.00  0.20  5.00
assi (resi 23   and name HG# ) (resi 24   and name HN  )  2.00  0.20  4.00
assi (resi 23   and name HD# ) (resi 24   and name HN  )  2.00  0.20  5.00
assi (resi 23   and name HN  ) (resi 27   and name HG# )  2.00  0.20  4.00
assi (resi 23   and name HD# ) (resi 27   and name HN  )  2.00  0.20  5.00
assi (resi 23   and name HD# ) (resi 28   and name HN  )  2.00  0.20  5.00

! residue 24   Ala , intraresidue NOEs
assi (resi 24   and name HN  ) (resi 24   and name HA  )  2.00  0.20  3.00
assi (resi 24   and name HN  ) (resi 24   and name HB# )  2.00  0.20  1.80
assi (resi 24   and name HA  ) (resi 24   and name HB# )  2.00  0.20  0.80

! residue 24   Ala , NOEs forward in sequence
assi (resi 24   and name HN  ) (resi 25   and name HD# )  2.00  0.20  5.00
assi (resi 24   and name HA  ) (resi 25   and name HA  )  2.00  0.20  4.00
assi (resi 24   and name HA  ) (resi 25   and name HG# )  2.00  0.20  4.00
assi (resi 24   and name HA  ) (resi 25   and name HD# )  2.00  0.20  2.50
assi (resi 24   and name HB# ) (resi 25   and name HA  )  2.00  0.20  4.30
assi (resi 24   and name HB# ) (resi 25   and name HG# )  2.00  0.20  4.30
assi (resi 24   and name HB# ) (resi 25   and name HD# )  2.00  0.20  1.80
assi (resi 24   and name HB# ) (resi 26   and name HN  )  2.00  0.20  3.30
assi (resi 24   and name HN  ) (resi 27   and name HN  )  2.00  0.20  4.00

! residue 25   Pro , intraresidue NOEs
assi (resi 25   and name HA  ) (resi 25   and name HB# )  2.00  0.20  2.50
assi (resi 25   and name HA  ) (resi 25   and name HG# )  2.00  0.20  2.50
assi (resi 25   and name HA  ) (resi 25   and name HD# )  2.00  0.20  5.00
assi (resi 25   and name HB# ) (resi 25   and name HB# )  2.00  0.20  2.50
assi (resi 25   and name HB# ) (resi 25   and name HG# )  2.00  0.20  2.50
assi (resi 25   and name HB# ) (resi 25   and name HD# )  2.00  0.20  5.00
assi (resi 25   and name HG# ) (resi 25   and name HD# )  2.00  0.20  3.50
assi (resi 25   and name HD# ) (resi 25   and name HD# )  2.00  0.20  2.50

! residue 25   Pro , NOEs forward in sequence
assi (resi 25   and name HA  ) (resi 26   and name HN  )  2.00  0.20  1.50
assi (resi 25   and name HB# ) (resi 26   and name HN  )  2.00  0.20  4.00
assi (resi 25   and name HG# ) (resi 26   and name HN  )  2.00  0.20  5.00

! residue 26   Arg , intraresidue NOEs
assi (resi 26   and name HN  ) (resi 26   and name HA  )  2.00  0.20  0.50
assi (resi 26   and name HN  ) (resi 26   and name HB# )  2.00  0.20  1.50
assi (resi 26   and name HN  ) (resi 26   and name HG# )  2.00  0.20  1.50
assi (resi 26   and name HN  ) (resi 26   and name HD# )  2.00  0.20  5.00
assi (resi 26   and name HA  ) (resi 26   and name HE  )  2.00  0.20  3.00
assi (resi 26   and name HA  ) (resi 26   and name HD# )  2.00  0.20  2.50
assi (resi 26   and name HE  ) (resi 26   and name HB# )  2.00  0.20  4.00
assi (resi 26   and name HE  ) (resi 26   and name HG# )  2.00  0.20  4.00
assi (resi 26   and name HE  ) (resi 26   and name HD# )  2.00  0.20  2.50

! residue 26   Arg , NOEs forward in sequence
assi (resi 26   and name HN  ) (resi 27   and name HN  )  2.00  0.20  4.00
assi (resi 26   and name HB# ) (resi 27   and name HN  )  2.00  0.20  2.50
assi (resi 26   and name HD# ) (resi 27   and name HN  )  2.00  0.20  5.00
assi (resi 26   and name HD# ) (resi 27   and name HG# )  2.00  0.20  2.50

! residue 27   Arg , intraresidue NOEs
assi (resi 27   and name HN  ) (resi 27   and name HA  )  2.00  0.20  0.50
assi (resi 27   and name HN  ) (resi 27   and name HB# )  2.00  0.20  2.50
assi (resi 27   and name HN  ) (resi 27   and name HG# )  2.00  0.20  2.50
assi (resi 27   and name HN  ) (resi 27   and name HD# )  2.00  0.20  5.00
assi (resi 27   and name HA  ) (resi 27   and name HE  )  2.00  0.20  4.00
assi (resi 27   and name HA  ) (resi 27   and name HB# )  2.00  0.20  1.50
assi (resi 27   and name HA  ) (resi 27   and name HG# )  2.00  0.20  1.50
assi (resi 27   and name HA  ) (resi 27   and name HD# )  2.00  0.20  4.00
assi (resi 27   and name HE  ) (resi 27   and name HB# )  2.00  0.20  4.00
assi (resi 27   and name HE  ) (resi 27   and name HG# )  2.00  0.20  4.00
assi (resi 27   and name HE  ) (resi 27   and name HD# )  2.00  0.20  4.00
assi (resi 27   and name HB# ) (resi 27   and name HD# )  2.00  0.20  3.50
assi (resi 27   and name HG# ) (resi 27   and name HD# )  2.00  0.20  3.50
assi (resi 27   and name HD# ) (resi 27   and name HD# )  2.00  0.20  2.50

! residue 27   Arg , NOEs forward in sequence
assi (resi 27   and name HN  ) (resi 28   and name HN  )  2.00  0.20  4.00
assi (resi 27   and name HA  ) (resi 28   and name HN  )  2.00  0.20  0.50
assi (resi 27   and name HB# ) (resi 28   and name HN  )  2.00  0.20  2.50
assi (resi 27   and name HG# ) (resi 28   and name HN  )  2.00  0.20  2.50
assi (resi 27   and name HG# ) (resi 28   and name HE2#)  2.00  0.20  6.00
assi (resi 27   and name HD# ) (resi 28   and name HE2#)  2.00  0.20  5.00
assi (resi 27   and name HG# ) (resi 29   and name HN  )  2.00  0.20  5.00
assi (resi 27   and name HA  ) (resi 31   and name HE1 )  2.00  0.20  4.00
assi (resi 27   and name HB# ) (resi 31   and name HE1 )  2.00  0.20  5.00
assi (resi 27   and name HG# ) (resi 31   and name HE1 )  2.00  0.20  5.00

! residue 28   Gln , intraresidue NOEs
assi (resi 28   and name HN  ) (resi 28   and name HB# )  2.00  0.20  2.50
assi (resi 28   and name HN  ) (resi 28   and name HG# )  2.00  0.20  2.50
assi (resi 28   and name HE21) (resi 28   and name HE22)  2.00  0.20  1.50
assi (resi 28   and name HG# ) (resi 28   and name HE2#)  2.00  0.20  6.00

! residue 28   Gln , NOEs forward in sequence
assi (resi 28   and name HN  ) (resi 29   and name HN  )  2.00  0.20  4.00
assi (resi 28   and name HA  ) (resi 29   and name HN  )  2.00  0.20  0.50
assi (resi 28   and name HA  ) (resi 29   and name HA# )  2.00  0.20  4.00
assi (resi 28   and name HB# ) (resi 29   and name HN  )  2.00  0.20  4.00
assi (resi 28   and name HG# ) (resi 29   and name HN  )  2.00  0.20  5.00
assi (resi 28   and name HG# ) (resi 29   and name HA# )  2.00  0.20  5.00
assi (resi 28   and name HB# ) (resi 33   and name HN  )  2.00  0.20  5.00

! residue 29   Gly , intraresidue NOEs
assi (resi 29   and name HN  ) (resi 29   and name HA# )  2.00  0.20  1.50

! residue 29   Gly , NOEs forward in sequence
assi (resi 29   and name HA# ) (resi 30   and name HN  )  2.00  0.20  2.50
assi (resi 29   and name HA# ) (resi 30   and name HA  )  2.00  0.20  4.00
assi (resi 29   and name HA# ) (resi 30   and name HB# )  2.00  0.20  5.00
assi (resi 29   and name HN  ) (resi 36   and name HG2#)  2.00  0.20  4.30
assi (resi 29   and name HA# ) (resi 36   and name HA  )  2.00  0.20  4.00
assi (resi 29   and name HA# ) (resi 36   and name HB  )  2.00  0.20  5.00
assi (resi 29   and name HA# ) (resi 36   and name HG2#)  2.00  0.20  4.30
assi (resi 29   and name HN  ) (resi 39   and name HG# )  2.00  0.20  6.40

! residue 30   Cys , intraresidue NOEs
assi (resi 30   and name HN  ) (resi 30   and name HA  )  2.00  0.20  3.00
assi (resi 30   and name HN  ) (resi 30   and name HB# )  2.00  0.20  2.50
assi (resi 30   and name HA  ) (resi 30   and name HB# )  2.00  0.20  2.50
assi (resi 30   and name HB# ) (resi 30   and name HB# )  2.00  0.20  2.50

! residue 30   Cys , NOEs forward in sequence
assi (resi 30   and name HA  ) (resi 31   and name HN  )  2.00  0.20  0.50
assi (resi 30   and name HA  ) (resi 31   and name HB# )  2.00  0.20  4.00
assi (resi 30   and name HB# ) (resi 31   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HB# ) (resi 31   and name HD1 )  2.00  0.20  4.00
assi (resi 30   and name HA  ) (resi 32   and name HN  )  2.00  0.20  3.00
assi (resi 30   and name HN  ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HA  ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HB# ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HN  ) (resi 34   and name HN  )  2.00  0.20  3.00
assi (resi 30   and name HN  ) (resi 34   and name HA# )  2.00  0.20  5.00
assi (resi 30   and name HB# ) (resi 34   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HA  ) (resi 35   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HB# ) (resi 35   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HN  ) (resi 36   and name HG2#)  2.00  0.20  4.30
assi (resi 30   and name HN  ) (resi 38   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HN  ) (resi 38   and name HD2 )  2.00  0.20  4.00
assi (resi 30   and name HB# ) (resi 38   and name HN  )  2.00  0.20  5.00
assi (resi 30   and name HB# ) (resi 38   and name HD2 )  2.00  0.20  4.00
assi (resi 30   and name HN  ) (resi 40   and name HN  )  2.00  0.20  4.00
assi (resi 30   and name HA  ) (resi 40   and name HN  )  2.00  0.20  3.00
assi (resi 30   and name HA  ) (resi 40   and name HA  )  2.00  0.20  3.00
assi (resi 30   and name HA  ) (resi 40   and name HB# )  2.00  0.20  5.00

! residue 31   Trp , intraresidue NOEs
assi (resi 31   and name HN  ) (resi 31   and name HA  )  2.00  0.20  3.00
assi (resi 31   and name HN  ) (resi 31   and name HD1 )  2.00  0.20  3.00
assi (resi 31   and name HN  ) (resi 31   and name HE3 )  2.00  0.20  4.00
assi (resi 31   and name HN  ) (resi 31   and name HB# )  2.00  0.20  2.50
assi (resi 31   and name HA  ) (resi 31   and name HD1 )  2.00  0.20  3.00
assi (resi 31   and name HA  ) (resi 31   and name HE1 )  2.00  0.20  4.00
assi (resi 31   and name HA  ) (resi 31   and name HE3 )  2.00  0.20  3.00
assi (resi 31   and name HA  ) (resi 31   and name HB# )  2.00  0.20  1.50
assi (resi 31   and name HD1 ) (resi 31   and name HE1 )  2.00  0.20  1.50
assi (resi 31   and name HD1 ) (resi 31   and name HE3 )  2.00  0.20  3.00
assi (resi 31   and name HD1 ) (resi 31   and name HB# )  2.00  0.20  2.50
assi (resi 31   and name HE1 ) (resi 31   and name HZ2 )  2.00  0.20  3.00
assi (resi 31   and name HE3 ) (resi 31   and name HZ3 )  2.00  0.20  0.50
assi (resi 31   and name HE3 ) (resi 31   and name HH2 )  2.00  0.20  3.00
assi (resi 31   and name HE3 ) (resi 31   and name HB# )  2.00  0.20  2.50
assi (resi 31   and name HZ2 ) (resi 31   and name HH2 )  2.00  0.20  0.50
assi (resi 31   and name HZ3 ) (resi 31   and name HH2 )  2.00  0.20  0.50

! residue 31   Trp , NOEs forward in sequence
assi (resi 31   and name HN  ) (resi 32   and name HN  )  2.00  0.20  3.00
assi (resi 31   and name HA  ) (resi 32   and name HN  )  2.00  0.20  4.00
assi (resi 31   and name HE3 ) (resi 32   and name HA  )  2.00  0.20  3.00
assi (resi 31   and name HB# ) (resi 32   and name HN  )  2.00  0.20  5.00
assi (resi 31   and name HA  ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 31   and name HA  ) (resi 34   and name HN  )  2.00  0.20  4.00
assi (resi 31   and name HN  ) (resi 39   and name HA  )  2.00  0.20  4.00
assi (resi 31   and name HB# ) (resi 39   and name HG# )  2.00  0.20  7.40
assi (resi 31   and name HN  ) (resi 40   and name HN  )  2.00  0.20  4.00
assi (resi 31   and name HN  ) (resi 40   and name HA  )  2.00  0.20  4.00
assi (resi 31   and name HN  ) (resi 40   and name HB# )  2.00  0.20  4.00
assi (resi 31   and name HN  ) (resi 40   and name HG# )  2.00  0.20  5.00
assi (resi 31   and name HB# ) (resi 40   and name HN  )  2.00  0.20  5.00
assi (resi 31   and name HB# ) (resi 40   and name HB# )  2.00  0.20  5.00

! residue 32   Lys , intraresidue NOEs
assi (resi 32   and name HN  ) (resi 32   and name HA  )  2.00  0.20  3.00
assi (resi 32   and name HN  ) (resi 32   and name HB# )  2.00  0.20  4.00
assi (resi 32   and name HN  ) (resi 32   and name HG# )  2.00  0.20  5.00
assi (resi 32   and name HN  ) (resi 32   and name HD# )  2.00  0.20  4.00
assi (resi 32   and name HA  ) (resi 32   and name HB# )  2.00  0.20  2.50
assi (resi 32   and name HA  ) (resi 32   and name HG# )  2.00  0.20  2.50
assi (resi 32   and name HA  ) (resi 32   and name HD# )  2.00  0.20  2.50
assi (resi 32   and name HB# ) (resi 32   and name HG# )  2.00  0.20  3.50
assi (resi 32   and name HB# ) (resi 32   and name HD# )  2.00  0.20  2.50
assi (resi 32   and name HG# ) (resi 32   and name HD# )  2.00  0.20  2.50
assi (resi 32   and name HG# ) (resi 32   and name HE# )  2.00  0.20  5.00
assi (resi 32   and name HD# ) (resi 32   and name HE# )  2.00  0.20  2.50

! residue 32   Lys , NOEs forward in sequence
assi (resi 32   and name HN  ) (resi 33   and name HN  )  2.00  0.20  3.00
assi (resi 32   and name HA  ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 32   and name HB# ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 32   and name HG# ) (resi 33   and name HN  )  2.00  0.20  5.00
assi (resi 32   and name HG# ) (resi 33   and name HB# )  2.00  0.20  5.00
assi (resi 32   and name HD# ) (resi 33   and name HN  )  2.00  0.20  4.00
assi (resi 32   and name HD# ) (resi 33   and name HB# )  2.00  0.20  5.00
assi (resi 32   and name HE# ) (resi 33   and name HN  )  2.00  0.20  5.00
assi (resi 32   and name HN  ) (resi 34   and name HN  )  2.00  0.20  4.00
assi (resi 32   and name HA  ) (resi 34   and name HN  )  2.00  0.20  4.00
assi (resi 32   and name HB# ) (resi 34   and name HN  )  2.00  0.20  5.00
assi (resi 32   and name HN  ) (resi 40   and name HB# )  2.00  0.20  4.00
assi (resi 32   and name HN  ) (resi 40   and name HG# )  2.00  0.20  5.00
assi (resi 32   and name HD# ) (resi 40   and name HG# )  2.00  0.20  5.00

! residue 33   Cys , intraresidue NOEs
assi (resi 33   and name HN  ) (resi 33   and name HA  )  2.00  0.20  3.00
assi (resi 33   and name HN  ) (resi 33   and name HB# )  2.00  0.20  4.00
assi (resi 33   and name HA  ) (resi 33   and name HB# )  2.00  0.20  4.00
assi (resi 33   and name HB# ) (resi 33   and name HB# )  2.00  0.20  2.50

! residue 33   Cys , NOEs forward in sequence
assi (resi 33   and name HN  ) (resi 34   and name HN  )  2.00  0.20  1.50
assi (resi 33   and name HN  ) (resi 34   and name HA# )  2.00  0.20  5.00
assi (resi 33   and name HA  ) (resi 34   and name HN  )  2.00  0.20  4.00
assi (resi 33   and name HB# ) (resi 34   and name HN  )  2.00  0.20  5.00
assi (resi 33   and name HN  ) (resi 35   and name HN  )  2.00  0.20  4.00
assi (resi 33   and name HB# ) (resi 35   and name HN  )  2.00  0.20  5.00
assi (resi 33   and name HB# ) (resi 45   and name HG# )  2.00  0.20  5.00

! residue 34   Gly , intraresidue NOEs
assi (resi 34   and name HN  ) (resi 34   and name HA# )  2.00  0.20  2.50
assi (resi 34   and name HA# ) (resi 34   and name HA# )  2.00  0.20  2.50

! residue 34   Gly , NOEs forward in sequence
assi (resi 34   and name HN  ) (resi 35   and name HN  )  2.00  0.20  3.00
assi (resi 34   and name HA# ) (resi 35   and name HN  )  2.00  0.20  4.00
assi (resi 34   and name HN  ) (resi 06   and name HN  )  2.00  0.20  1.50

! residue 35   Lys , intraresidue NOEs
assi (resi 35   and name HN  ) (resi 35   and name HA  )  2.00  0.20  3.00
assi (resi 35   and name HN  ) (resi 35   and name HB# )  2.00  0.20  4.00
assi (resi 35   and name HN  ) (resi 35   and name HG# )  2.00  0.20  4.00
assi (resi 35   and name HN  ) (resi 35   and name HD# )  2.00  0.20  4.00
assi (resi 35   and name HN  ) (resi 35   and name HE# )  2.00  0.20  5.00
assi (resi 35   and name HA  ) (resi 35   and name HZ# )  2.00  0.20  3.30
assi (resi 35   and name HA  ) (resi 35   and name HB# )  2.00  0.20  2.50
assi (resi 35   and name HA  ) (resi 35   and name HG# )  2.00  0.20  4.00
assi (resi 35   and name HZ# ) (resi 35   and name HB# )  2.00  0.20  2.80
assi (resi 35   and name HZ# ) (resi 35   and name HG# )  2.00  0.20  4.30
assi (resi 35   and name HZ# ) (resi 35   and name HE# )  2.00  0.20  2.80
assi (resi 35   and name HB# ) (resi 35   and name HB# )  2.00  0.20  2.50
assi (resi 35   and name HB# ) (resi 35   and name HG# )  2.00  0.20  2.50
assi (resi 35   and name HB# ) (resi 35   and name HD# )  2.00  0.20  2.50
assi (resi 35   and name HB# ) (resi 35   and name HE# )  2.00  0.20  5.00
assi (resi 35   and name HG# ) (resi 35   and name HD# )  2.00  0.20  2.50
assi (resi 35   and name HG# ) (resi 35   and name HE# )  2.00  0.20  3.50

! residue 35   Lys , NOEs forward in sequence
assi (resi 35   and name HA  ) (resi 36   and name HN  )  2.00  0.20  1.50
assi (resi 35   and name HA  ) (resi 36   and name HA  )  2.00  0.20  3.00
assi (resi 35   and name HA  ) (resi 36   and name HG2#)  2.00  0.20  3.30
assi (resi 35   and name HB# ) (resi 36   and name HN  )  2.00  0.20  2.50
assi (resi 35   and name HB# ) (resi 36   and name HG2#)  2.00  0.20  4.30
assi (resi 35   and name HG# ) (resi 36   and name HN  )  2.00  0.20  5.00
assi (resi 35   and name HG# ) (resi 36   and name HG2#)  2.00  0.20  5.30
assi (resi 35   and name HD# ) (resi 36   and name HN  )  2.00  0.20  5.00
assi (resi 35   and name HB# ) (resi 37   and name HN  )  2.00  0.20  5.00

! residue 36   Thr , intraresidue NOEs
assi (resi 36   and name HN  ) (resi 36   and name HA  )  2.00  0.20  1.50
assi (resi 36   and name HN  ) (resi 36   and name HB  )  2.00  0.20  3.00
assi (resi 36   and name HN  ) (resi 36   and name HG2#)  2.00  0.20  1.80
assi (resi 36   and name HA  ) (resi 36   and name HG2#)  2.00  0.20  1.80
assi (resi 36   and name HB  ) (resi 36   and name HG2#)  2.00  0.20  0.80

! residue 36   Thr , NOEs forward in sequence
assi (resi 36   and name HN  ) (resi 37   and name HN  )  2.00  0.20  4.00
assi (resi 36   and name HA  ) (resi 37   and name HN  )  2.00  0.20  1.50
assi (resi 36   and name HB  ) (resi 37   and name HN  )  2.00  0.20  3.00
assi (resi 36   and name HG2#) (resi 37   and name HN  )  2.00  0.20  4.30
assi (resi 36   and name HA  ) (resi 38   and name HN  )  2.00  0.20  4.00
assi (resi 36   and name HG2#) (resi 38   and name HN  )  2.00  0.20  4.30

! residue 37   Gly , intraresidue NOEs
assi (resi 37   and name HN  ) (resi 37   and name HA# )  2.00  0.20  2.50
assi (resi 37   and name HA# ) (resi 37   and name HA# )  2.00  0.20  2.50

! residue 37   Gly , NOEs forward in sequence
assi (resi 37   and name HN  ) (resi 38   and name HN  )  2.00  0.20  3.00
assi (resi 37   and name HN  ) (resi 38   and name HA  )  2.00  0.20  4.00
assi (resi 37   and name HA# ) (resi 38   and name HN  )  2.00  0.20  4.00

! residue 38   His , intraresidue NOEs
assi (resi 38   and name HN  ) (resi 38   and name HB# )  2.00  0.20  4.00
assi (resi 38   and name HA  ) (resi 38   and name HD2 )  2.00  0.20  1.50
assi (resi 38   and name HA  ) (resi 38   and name HB# )  2.00  0.20  2.50
assi (resi 38   and name HD2 ) (resi 38   and name HB# )  2.00  0.20  4.00

! residue 38   His , NOEs forward in sequence
assi (resi 38   and name HN  ) (resi 39   and name HN  )  2.00  0.20  4.00
assi (resi 38   and name HN  ) (resi 39   and name HG# )  2.00  0.20  6.40
assi (resi 38   and name HA  ) (resi 39   and name HN  )  2.00  0.20  3.00
assi (resi 38   and name HA  ) (resi 39   and name HG# )  2.00  0.20  6.40
assi (resi 38   and name HD2 ) (resi 39   and name HN  )  2.00  0.20  4.00
assi (resi 38   and name HD2 ) (resi 39   and name HA  )  2.00  0.20  3.00
assi (resi 38   and name HD2 ) (resi 39   and name HG# )  2.00  0.20  5.40
assi (resi 38   and name HB# ) (resi 39   and name HN  )  2.00  0.20  2.50
assi (resi 38   and name HB# ) (resi 39   and name HG# )  2.00  0.20  7.40
assi (resi 38   and name HD2 ) (resi 40   and name HN  )  2.00  0.20  4.00
assi (resi 38   and name HD2 ) (resi 40   and name HA  )  2.00  0.20  3.00
assi (resi 38   and name HD2 ) (resi 42   and name HN  )  2.00  0.20  4.00
assi (resi 38   and name HD2 ) (resi 42   and name HB1 )  2.00  0.20  3.00
assi (resi 38   and name HD2 ) (resi 42   and name HB2 )  2.00  0.20  3.00
assi (resi 38   and name HB# ) (resi 42   and name HB1 )  2.00  0.20  4.00
assi (resi 38   and name HD2 ) (resi 43   and name HN  )  2.00  0.20  4.00
assi (resi 38   and name HD2 ) (resi 43   and name HA  )  2.00  0.20  1.50
assi (resi 38   and name HD2 ) (resi 43   and name HB# )  2.00  0.20  2.50
assi (resi 38   and name HB# ) (resi 43   and name HN  )  2.00  0.20  5.00
assi (resi 38   and name HD2 ) (resi 44   and name HD# )  2.00  0.20  4.00

! residue 39   Val , intraresidue NOEs
assi (resi 39   and name HN  ) (resi 39   and name HA  )  2.00  0.20  4.00
assi (resi 39   and name HN  ) (resi 39   and name HB  )  2.00  0.20  4.00
assi (resi 39   and name HN  ) (resi 39   and name HG# )  2.00  0.20  3.90
assi (resi 39   and name HA  ) (resi 39   and name HB  )  2.00  0.20  1.50
assi (resi 39   and name HA  ) (resi 39   and name HG# )  2.00  0.20  3.90
assi (resi 39   and name HB  ) (resi 39   and name HG# )  2.00  0.20  2.90

! residue 39   Val , NOEs forward in sequence
assi (resi 39   and name HN  ) (resi 40   and name HN  )  2.00  0.20  4.00
assi (resi 39   and name HA  ) (resi 40   and name HN  )  2.00  0.20  1.50
assi (resi 39   and name HB  ) (resi 40   and name HN  )  2.00  0.20  1.50
assi (resi 39   and name HG# ) (resi 40   and name HN  )  2.00  0.20  5.40
assi (resi 39   and name HG# ) (resi 40   and name HA  )  2.00  0.20  6.40
assi (resi 39   and name HG# ) (resi 40   and name HB# )  2.00  0.20  6.40
assi (resi 39   and name HG# ) (resi 40   and name HG# )  2.00  0.20  4.90
assi (resi 39   and name HA  ) (resi 41   and name HN  )  2.00  0.20  4.00
assi (resi 39   and name HB  ) (resi 41   and name HN  )  2.00  0.20  3.00
assi (resi 39   and name HB  ) (resi 41   and name HB# )  2.00  0.20  3.30
assi (resi 39   and name HG# ) (resi 41   and name HN  )  2.00  0.20  3.90
assi (resi 39   and name HG# ) (resi 41   and name HA  )  2.00  0.20  6.40
assi (resi 39   and name HG# ) (resi 41   and name HB# )  2.00  0.20  3.20
assi (resi 39   and name HN  ) (resi 42   and name HB1 )  2.00  0.20  4.00
assi (resi 39   and name HN  ) (resi 42   and name HB2 )  2.00  0.20  4.00
assi (resi 39   and name HN  ) (resi 42   and name HG# )  2.00  0.20  5.00
assi (resi 39   and name HG# ) (resi 42   and name HN  )  2.00  0.20  5.40
assi (resi 39   and name HG# ) (resi 42   and name HA  )  2.00  0.20  5.40
assi (resi 39   and name HG# ) (resi 42   and name HB1 )  2.00  0.20  5.40
assi (resi 39   and name HG# ) (resi 42   and name HB2 )  2.00  0.20  5.40
assi (resi 39   and name HG# ) (resi 42   and name HG# )  2.00  0.20  4.90
assi (resi 39   and name HG# ) (resi 43   and name HN  )  2.00  0.20  6.40

! residue 40   Met , intraresidue NOEs
assi (resi 40   and name HN  ) (resi 40   and name HA  )  2.00  0.20  3.00
assi (resi 40   and name HN  ) (resi 40   and name HB# )  2.00  0.20  2.50
assi (resi 40   and name HN  ) (resi 40   and name HG# )  2.00  0.20  4.00
assi (resi 40   and name HA  ) (resi 40   and name HB# )  2.00  0.20  2.50
assi (resi 40   and name HA  ) (resi 40   and name HG# )  2.00  0.20  4.00
assi (resi 40   and name HB# ) (resi 40   and name HG# )  2.00  0.20  2.50

! residue 40   Met , NOEs forward in sequence
assi (resi 40   and name HN  ) (resi 41   and name HN  )  2.00  0.20  3.00
assi (resi 40   and name HN  ) (resi 41   and name HB# )  2.00  0.20  4.30
assi (resi 40   and name HA  ) (resi 41   and name HN  )  2.00  0.20  4.00
assi (resi 40   and name HB# ) (resi 41   and name HN  )  2.00  0.20  4.00
assi (resi 40   and name HB# ) (resi 41   and name HA  )  2.00  0.20  5.00
assi (resi 40   and name HG# ) (resi 41   and name HN  )  2.00  0.20  4.00
assi (resi 40   and name HG# ) (resi 41   and name HA  )  2.00  0.20  5.00
assi (resi 40   and name HA  ) (resi 42   and name HN  )  2.00  0.20  4.00
assi (resi 40   and name HB# ) (resi 42   and name HN  )  2.00  0.20  4.00
assi (resi 40   and name HA  ) (resi 43   and name HA  )  2.00  0.20  4.00
assi (resi 40   and name HA  ) (resi 43   and name HB# )  2.00  0.20  4.00
assi (resi 40   and name HG# ) (resi 43   and name HN  )  2.00  0.20  5.00

! residue 41   Ala , intraresidue NOEs
assi (resi 41   and name HN  ) (resi 41   and name HA  )  2.00  0.20  1.50
assi (resi 41   and name HN  ) (resi 41   and name HB# )  2.00  0.20  0.80
assi (resi 41   and name HA  ) (resi 41   and name HB# )  2.00  0.20  0.80

! residue 41   Ala , NOEs forward in sequence
assi (resi 41   and name HN  ) (resi 42   and name HN  )  2.00  0.20  3.00
assi (resi 41   and name HN  ) (resi 42   and name HB1 )  2.00  0.20  4.00
assi (resi 41   and name HN  ) (resi 42   and name HG# )  2.00  0.20  5.00
assi (resi 41   and name HA  ) (resi 42   and name HN  )  2.00  0.20  3.00
assi (resi 41   and name HB# ) (resi 42   and name HN  )  2.00  0.20  3.30
assi (resi 41   and name HB# ) (resi 42   and name HB2 )  2.00  0.20  1.80
assi (resi 41   and name HB# ) (resi 42   and name HG# )  2.00  0.20  2.80
assi (resi 41   and name HN  ) (resi 43   and name HN  )  2.00  0.20  4.00
assi (resi 41   and name HA  ) (resi 43   and name HN  )  2.00  0.20  3.00
assi (resi 41   and name HB# ) (resi 43   and name HN  )  2.00  0.20  4.30

! residue 42   Lys , intraresidue NOEs
assi (resi 42   and name HN  ) (resi 42   and name HA  )  2.00  0.20  3.00
assi (resi 42   and name HN  ) (resi 42   and name HB1 )  2.00  0.20  3.00
assi (resi 42   and name HN  ) (resi 42   and name HB2 )  2.00  0.20  3.00
assi (resi 42   and name HN  ) (resi 42   and name HG# )  2.00  0.20  4.00
assi (resi 42   and name HA  ) (resi 42   and name HB1 )  2.00  0.20  1.50
assi (resi 42   and name HA  ) (resi 42   and name HB2 )  2.00  0.20  1.50
assi (resi 42   and name HA  ) (resi 42   and name HG# )  2.00  0.20  4.00
assi (resi 42   and name HB1 ) (resi 42   and name HB2 )  2.00  0.20  0.50
assi (resi 42   and name HB1 ) (resi 42   and name HG# )  2.00  0.20  1.50
assi (resi 42   and name HB1 ) (resi 42   and name HD# )  2.00  0.20  2.50
assi (resi 42   and name HB2 ) (resi 42   and name HG# )  2.00  0.20  2.50
assi (resi 42   and name HG# ) (resi 42   and name HG# )  2.00  0.20  2.50

! residue 42   Lys , NOEs forward in sequence
assi (resi 42   and name HN  ) (resi 43   and name HN  )  2.00  0.20  1.50
assi (resi 42   and name HN  ) (resi 43   and name HB# )  2.00  0.20  5.00
assi (resi 42   and name HA  ) (resi 43   and name HN  )  2.00  0.20  3.00
assi (resi 42   and name HB1 ) (resi 43   and name HN  )  2.00  0.20  3.00
assi (resi 42   and name HB1 ) (resi 43   and name HB# )  2.00  0.20  4.00
assi (resi 42   and name HB2 ) (resi 43   and name HN  )  2.00  0.20  4.00
assi (resi 42   and name HG# ) (resi 43   and name HN  )  2.00  0.20  5.00

! residue 43   Cys , intraresidue NOEs
assi (resi 43   and name HN  ) (resi 43   and name HA  )  2.00  0.20  3.00
assi (resi 43   and name HN  ) (resi 43   and name HB# )  2.00  0.20  2.50
assi (resi 43   and name HA  ) (resi 43   and name HB# )  2.00  0.20  2.50
assi (resi 43   and name HB# ) (resi 43   and name HB# )  2.00  0.20  2.50

! residue 43   Cys , NOEs forward in sequence
assi (resi 43   and name HN  ) (resi 44   and name HG# )  2.00  0.20  5.00
assi (resi 43   and name HN  ) (resi 44   and name HD# )  2.00  0.20  5.00
assi (resi 43   and name HA  ) (resi 44   and name HG# )  2.00  0.20  4.00
assi (resi 43   and name HA  ) (resi 44   and name HD# )  2.00  0.20  2.50
assi (resi 43   and name HB# ) (resi 44   and name HD# )  2.00  0.20  6.00
assi (resi 43   and name HN  ) (resi 45   and name HN  )  2.00  0.20  4.00
assi (resi 43   and name HN  ) (resi 45   and name HG# )  2.00  0.20  5.00
assi (resi 43   and name HA  ) (resi 45   and name HN  )  2.00  0.20  4.00
assi (resi 43   and name HB# ) (resi 45   and name HN  )  2.00  0.20  5.00

! residue 44   Pro , intraresidue NOEs
assi (resi 44   and name HA  ) (resi 44   and name HB# )  2.00  0.20  2.50
assi (resi 44   and name HA  ) (resi 44   and name HG# )  2.00  0.20  2.50
assi (resi 44   and name HA  ) (resi 44   and name HD# )  2.00  0.20  5.00
assi (resi 44   and name HB# ) (resi 44   and name HB# )  2.00  0.20  2.50
assi (resi 44   and name HB# ) (resi 44   and name HG# )  2.00  0.20  2.50
assi (resi 44   and name HB# ) (resi 44   and name HD# )  2.00  0.20  5.00
assi (resi 44   and name HG# ) (resi 44   and name HD# )  2.00  0.20  3.50
assi (resi 44   and name HD# ) (resi 44   and name HD# )  2.00  0.20  2.50

! residue 44   Pro , NOEs forward in sequence
assi (resi 44   and name HA  ) (resi 45   and name HN  )  2.00  0.20  3.00
assi (resi 44   and name HB# ) (resi 45   and name HN  )  2.00  0.20  4.00
assi (resi 44   and name HG# ) (resi 45   and name HN  )  2.00  0.20  4.00
assi (resi 44   and name HD# ) (resi 45   and name HN  )  2.00  0.20  5.00

! residue 45   Glu , intraresidue NOEs
assi (resi 45   and name HN  ) (resi 45   and name HA  )  2.00  0.20  1.50
assi (resi 45   and name HN  ) (resi 45   and name HB# )  2.00  0.20  2.50
assi (resi 45   and name HN  ) (resi 45   and name HG# )  2.00  0.20  4.00
assi (resi 45   and name HA  ) (resi 45   and name HB# )  2.00  0.20  1.50
assi (resi 45   and name HA  ) (resi 45   and name HG# )  2.00  0.20  4.00
assi (resi 45   and name HB# ) (resi 45   and name HG# )  2.00  0.20  2.50
assi (resi 45   and name HG# ) (resi 45   and name HG# )  2.00  0.20  2.50

! residue 45   Glu , NOEs forward in sequence
assi (resi 45   and name HN  ) (resi 46   and name HN  )  2.00  0.20  3.00
assi (resi 45   and name HN  ) (resi 46   and name HG# )  2.00  0.20  5.00
assi (resi 45   and name HA  ) (resi 46   and name HD# )  2.00  0.20  4.00
assi (resi 45   and name HB# ) (resi 46   and name HN  )  2.00  0.20  4.00
assi (resi 45   and name HG# ) (resi 46   and name HN  )  2.00  0.20  5.00
assi (resi 45   and name HN  ) (resi 47   and name HN  )  2.00  0.20  4.00

! residue 46   Arg , intraresidue NOEs
assi (resi 46   and name HN  ) (resi 46   and name HA  )  2.00  0.20  0.50
assi (resi 46   and name HN  ) (resi 46   and name HB# )  2.00  0.20  2.50
assi (resi 46   and name HN  ) (resi 46   and name HG# )  2.00  0.20  2.50
assi (resi 46   and name HN  ) (resi 46   and name HD# )  2.00  0.20  5.00
assi (resi 46   and name HA  ) (resi 46   and name HB# )  2.00  0.20  1.50
assi (resi 46   and name HA  ) (resi 46   and name HG# )  2.00  0.20  2.50
assi (resi 46   and name HA  ) (resi 46   and name HD# )  2.00  0.20  4.00
assi (resi 46   and name HA  ) (resi 46   and name HH1#)  2.00  0.20  2.50
assi (resi 46   and name HE  ) (resi 46   and name HB# )  2.00  0.20  4.00
assi (resi 46   and name HE  ) (resi 46   and name HG# )  2.00  0.20  5.00
assi (resi 46   and name HE  ) (resi 46   and name HD# )  2.00  0.20  4.00
assi (resi 46   and name HB# ) (resi 46   and name HG# )  2.00  0.20  2.50
assi (resi 46   and name HG# ) (resi 46   and name HD# )  2.00  0.20  2.50

! residue 46   Arg , NOEs forward in sequence
assi (resi 46   and name HN  ) (resi 47   and name HN  )  2.00  0.20  3.00
assi (resi 46   and name HA  ) (resi 47   and name HN  )  2.00  0.20  0.50
assi (resi 46   and name HB# ) (resi 47   and name HN  )  2.00  0.20  4.00
assi (resi 46   and name HG# ) (resi 47   and name HN  )  2.00  0.20  4.00

! residue 47   Gln , intraresidue NOEs
assi (resi 47   and name HN  ) (resi 47   and name HA  )  2.00  0.20  1.50
assi (resi 47   and name HN  ) (resi 47   and name HB# )  2.00  0.20  4.00
assi (resi 47   and name HN  ) (resi 47   and name HG# )  2.00  0.20  5.00

! residue 47   Gln , NOEs forward in sequence
assi (resi 47   and name HA  ) (resi 48   and name HN  )  2.00  0.20  1.50
assi (resi 47   and name HB# ) (resi 48   and name HN  )  2.00  0.20  5.00
assi (resi 47   and name HG# ) (resi 48   and name HN  )  2.00  0.20  5.00

! residue 48   Ala , intraresidue NOEs
assi (resi 48   and name HN  ) (resi 48   and name HA  )  2.00  0.20  3.00
assi (resi 48   and name HN  ) (resi 48   and name HB# )  2.00  0.20  3.30
assi (resi 48   and name HA  ) (resi 48   and name HB# )  2.00  0.20  3.30

! residue 48   Ala , NOEs forward in sequence
assi (resi 48   and name HN  ) (resi 49   and name HN  )  2.00  0.20  4.00
assi (resi 48   and name HA  ) (resi 49   and name HN  )  2.00  0.20  3.00
assi (resi 48   and name HB# ) (resi 49   and name HN  )  2.00  0.20  4.30

! residue 49   Gly , intraresidue NOEs
assi (resi 49   and name HN  ) (resi 49   and name HA# )  2.00  0.20  4.00

{dihedral}
{this dihedral restraints were determined by k_hncohbacwpr}
{this dihedral restraints were determined by k_hnhbgp3d}
{this dihedral restraints were determined by k_hnhagp3d}
restraints
  dihedral

  reset

assign (resid   7 and name c   )  (resid   8 and name n   )
       (resid   8 and name ca  )  (resid   8 and name c   )  1  -120.0 40.0 2
assign (resid   9 and name c   )  (resid  10 and name n   )
       (resid  10 and name ca  )  (resid  10 and name c   )  1  -65.0 25.0 2
assign (resid  11 and name c   )  (resid  12 and name n   )
       (resid  12 and name ca  )  (resid  12 and name c   )  1  -120.0 40.0 2
assign (resid  16 and name c   )  (resid  17 and name n   )
       (resid  17 and name ca  )  (resid  17 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  18 and name c   )  (resid  19 and name n   )
       (resid  19 and name ca  )  (resid  19 and name c   )  1  -65.0 25.0 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  20 and name c   )  (resid  21 and name n   )
       (resid  21 and name ca  )  (resid  21 and name c   )  1  -120.0 40.0 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  22 and name c   )  (resid  23 and name n   )
       (resid  23 and name ca  )  (resid  23 and name c   )  1  -120.0 40.0 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  29 and name c   )  (resid  30 and name n   )
       (resid  30 and name ca  )  (resid  30 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  -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  -65.0 25.0 2
assign (resid  38 and name c   )  (resid  39 and name n   )
       (resid  39 and name ca  )  (resid  39 and name c   )  1  -120.0 40.0 2
assign (resid  40 and name c   )  (resid  41 and name n   )
       (resid  41 and name ca  )  (resid  41 and name c   )  1  -65.0 25.0 2
assign (resid  41 and name c   )  (resid  42 and name n   )
       (resid  42 and name ca  )  (resid  42 and name c   )  1  -120.0 40.0 2
assign (resid  42 and name c   )  (resid  43 and name n   )
       (resid  43 and name ca  )  (resid  43 and name c   )  1  -65.0 25.0 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   9 and name n   )  (resid   9 and name ca  )
       (resid   9 and name cb  )  (resid   9 and name cg  )  1   60.0 40.0 2
assign (resid  12 and name n   )  (resid  12 and name ca  )
       (resid  12 and name cb  )  (resid  12 and name cg  )  1   60.0 40.0 2
assign (resid  18 and name n   )  (resid  18 and name ca  )
       (resid  18 and name cb  )  (resid  18 and name og  )  1   60.0 40.0 2
assign (resid  33 and name n   )  (resid  33 and name ca  )
       (resid  33 and name cb  )  (resid  33 and name og  )  1  -60.0 40.0 2
assign (resid  42 and name n   )  (resid  42 and name ca  )
       (resid  42 and name cb  )  (resid  42 and name og  )  1  -60.0 40.0 2
end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           1HT      ALA   1  14.154  -2.091 -17.879
    2    H2   ALA   1           2HT      ALA   1  13.226  -2.628 -19.196
    3    H3   ALA   1           3HT      ALA   1  12.469  -2.218 -17.732
    4    HA   ALA   1           HA       ALA   1  13.958  -0.285 -19.437
    5    HB1  ALA   1           3HB      ALA   1  12.107  -0.901 -20.724
    6    HB2  ALA   1           1HB      ALA   1  11.429   0.411 -19.761
    7    HB3  ALA   1           2HB      ALA   1  11.122  -1.265 -19.309
    8    H    GLN   2           H        GLN   2  10.944   0.179 -17.711
    9    HA   GLN   2           HA       GLN   2  12.034   2.415 -16.201
   10    HB2  GLN   2           2HB      GLN   2   9.405   0.901 -16.203
   11    HB3  GLN   2           1HB      GLN   2   9.681   2.364 -15.257
   12    HG2  GLN   2           2HG      GLN   2  10.350   3.514 -17.413
   13    HG3  GLN   2           1HG      GLN   2   9.782   2.083 -18.272
   14   HE21  GLN   2          1HE2      GLN   2   7.450   1.422 -16.897
   15   HE22  GLN   2          2HE2      GLN   2   6.333   2.696 -16.995
   16    H    GLN   3           H        GLN   3  13.764   1.094 -15.063
   17    HA   GLN   3           HA       GLN   3  12.696  -0.620 -12.861
   18    HB2  GLN   3           2HB      GLN   3  14.893  -0.725 -14.656
   19    HB3  GLN   3           1HB      GLN   3  15.568  -0.486 -13.043
   20    HG2  GLN   3           2HG      GLN   3  13.476  -2.583 -13.677
   21    HG3  GLN   3           1HG      GLN   3  15.210  -2.910 -13.680
   22   HE21  GLN   3          1HE2      GLN   3  16.277  -3.120 -11.643
   23   HE22  GLN   3          2HE2      GLN   3  15.463  -3.029 -10.158
   24    H    ARG   4           H        ARG   4  11.967   1.278 -11.604
   25    HA   ARG   4           HA       ARG   4  13.980   2.207  -9.739
   26    HB2  ARG   4           2HB      ARG   4  14.354   4.358 -10.526
   27    HB3  ARG   4           1HB      ARG   4  14.120   3.520 -12.056
   28    HG2  ARG   4           2HG      ARG   4  11.900   4.932 -10.547
   29    HG3  ARG   4           1HG      ARG   4  12.823   5.666 -11.854
   30    HD2  ARG   4           2HD      ARG   4  11.804   4.375 -13.481
   31    HD3  ARG   4           1HD      ARG   4  11.582   2.995 -12.391
   32    HE   ARG   4           HE       ARG   4   9.614   4.038 -11.507
   33   HH11  ARG   4          1HH2      ARG   4  11.464   6.576 -12.693
   34   HH12  ARG   4          2HH2      ARG   4  10.136   7.476 -13.338
   35   HH21  ARG   4          1HH1      ARG   4   7.818   4.957 -12.801
   36   HH22  ARG   4          2HH1      ARG   4   8.073   6.563 -13.398
   37    H    LYS   5           H        LYS   5  12.965   2.959  -7.859
   38    HA   LYS   5           HA       LYS   5  10.114   3.770  -7.956
   39    HB2  LYS   5           2HB      LYS   5  11.028   1.113  -7.447
   40    HB3  LYS   5           1HB      LYS   5  10.404   1.764  -5.932
   41    HG2  LYS   5           2HG      LYS   5   8.417   1.027  -6.815
   42    HG3  LYS   5           1HG      LYS   5   8.460   2.617  -7.580
   43    HD2  LYS   5           2HD      LYS   5   9.997   1.005  -9.265
   44    HD3  LYS   5           1HD      LYS   5   8.638  -0.021  -8.803
   45    HE2  LYS   5           2HE      LYS   5   8.138   2.831  -9.644
   46    HE3  LYS   5           1HE      LYS   5   8.340   1.560 -10.866
   47    HZ1  LYS   5           3HZ      LYS   5   6.738   0.239  -9.387
   48    HZ2  LYS   5           1HZ      LYS   5   6.085   1.459 -10.368
   49    HZ3  LYS   5           2HZ      LYS   5   6.328   1.742  -8.710
   50    H    VAL   6           H        VAL   6   9.547   5.028  -6.140
   51    HA   VAL   6           HA       VAL   6  11.797   5.798  -4.349
   52    HB   VAL   6           HB       VAL   6   9.027   7.002  -4.495
   53   HG11  VAL   6          1HG1      VAL   6  11.595   7.643  -3.267
   54   HG12  VAL   6          2HG1      VAL   6  10.002   8.330  -2.951
   55   HG13  VAL   6          3HG1      VAL   6  10.993   8.969  -4.263
   56   HG21  VAL   6          3HG2      VAL   6  10.988   6.825  -6.619
   57   HG22  VAL   6          1HG2      VAL   6  10.783   8.504  -6.122
   58   HG23  VAL   6          2HG2      VAL   6   9.387   7.564  -6.652
   59    H    ILE   7           H        ILE   7  11.005   6.275  -2.003
   60    HA   ILE   7           HA       ILE   7  10.484   4.089  -0.522
   61    HB   ILE   7           HB       ILE   7  10.268   6.936  -0.274
   62   HG12  ILE   7          2HG1      ILE   7  11.784   5.220   0.873
   63   HG13  ILE   7          1HG1      ILE   7  11.156   6.516   1.891
   64   HG21  ILE   7          1HG2      ILE   7   8.070   5.370   1.097
   65   HG22  ILE   7          2HG2      ILE   7   7.911   6.820   0.103
   66   HG23  ILE   7          3HG2      ILE   7   8.647   6.923   1.703
   67   HD11  ILE   7          3HD1      ILE   7   9.345   4.223   1.768
   68   HD12  ILE   7          1HD1      ILE   7   9.987   5.070   3.176
   69   HD13  ILE   7          2HD1      ILE   7  10.931   3.794   2.408
   70    H    ARG   8           H        ARG   8   8.976   2.497  -0.978
   71    HA   ARG   8           HA       ARG   8   6.371   3.136  -2.137
   72    HB2  ARG   8           2HB      ARG   8   6.109   0.718  -2.117
   73    HB3  ARG   8           1HB      ARG   8   7.759   1.094  -2.610
   74    HG2  ARG   8           2HG      ARG   8   8.332   0.885  -0.087
   75    HG3  ARG   8           1HG      ARG   8   6.783   0.050   0.041
   76    HD2  ARG   8           2HD      ARG   8   7.687  -1.842  -0.815
   77    HD3  ARG   8           1HD      ARG   8   8.285  -0.956  -2.232
   78    HE   ARG   8           HE       ARG   8   9.988  -0.155  -0.202
   79   HH11  ARG   8          1HH2      ARG   8   9.470  -2.815   1.061
   80   HH12  ARG   8          2HH2      ARG   8  10.686  -3.811   0.335
   81   HH21  ARG   8          1HH1      ARG   8  11.332  -1.590  -2.250
   82   HH22  ARG   8          2HH1      ARG   8  11.741  -3.117  -1.541
   83    H    CYS   9           H        CYS   9   4.620   3.689  -0.979
   84    HA   CYS   9           HA       CYS   9   4.582   3.818   1.891
   85    HB2  CYS   9           2HB      CYS   9   3.250   5.413   0.889
   86    HB3  CYS   9           1HB      CYS   9   2.811   4.348  -0.444
   87    H    TRP  10           H        TRP  10   4.598   1.999   3.077
   88    HA   TRP  10           HA       TRP  10   3.452  -0.503   2.264
   89    HB2  TRP  10           2HB      TRP  10   5.264  -0.282   3.886
   90    HB3  TRP  10           1HB      TRP  10   4.250   0.685   4.939
   91    HD1  TRP  10           HD       TRP  10   5.276  -2.774   4.216
   92    HE1  TRP  10           1HE      TRP  10   3.934  -4.456   5.631
   93    HE3  TRP  10           3HE      TRP  10   1.630   0.298   6.008
   94    HZ2  TRP  10           2HZ      TRP  10   1.619  -4.486   7.309
   95    HZ3  TRP  10           3HZ      TRP  10  -0.126  -0.570   7.515
   96    HH2  TRP  10           HH       TRP  10  -0.132  -2.953   8.171
   97    H    ASN  11           H        ASN  11   1.533  -1.451   3.258
   98    HA   ASN  11           HA       ASN  11  -0.642  -1.422   4.282
   99    HB2  ASN  11           2HB      ASN  11  -1.238   0.401   5.517
  100    HB3  ASN  11           1HB      ASN  11   0.372   0.983   5.167
  101   HD21  ASN  11          1HD2      ASN  11  -2.730   2.033   5.183
  102   HD22  ASN  11          2HD2      ASN  11  -2.674   3.177   3.931
  103    H    CYS  12           H        CYS  12   0.153   0.970   1.780
  104    HA   CYS  12           HA       CYS  12  -2.245   0.024   0.240
  105    HB2  CYS  12           2HB      CYS  12  -2.451   2.339  -0.530
  106    HB3  CYS  12           1HB      CYS  12  -2.400   2.318   1.234
  107    H    GLY  13           H        GLY  13   1.152   0.921   0.210
  108    HA2  GLY  13           2HA      GLY  13   2.800   0.240  -1.350
  109    HA3  GLY  13           1HA      GLY  13   1.525  -0.478  -2.334
  110    H    LYS  14           H        LYS  14   2.833   2.706  -1.368
  111    HA   LYS  14           HA       LYS  14   2.354   3.642  -4.160
  112    HB2  LYS  14           2HB      LYS  14   0.389   4.307  -2.914
  113    HB3  LYS  14           1HB      LYS  14   1.380   4.923  -1.590
  114    HG2  LYS  14           2HG      LYS  14   0.465   6.672  -3.226
  115    HG3  LYS  14           1HG      LYS  14   2.200   6.733  -2.911
  116    HD2  LYS  14           2HD      LYS  14   2.563   5.343  -4.970
  117    HD3  LYS  14           1HD      LYS  14   0.837   5.469  -5.308
  118    HE2  LYS  14           2HE      LYS  14   1.075   7.561  -6.151
  119    HE3  LYS  14           1HE      LYS  14   2.048   8.081  -4.761
  120    HZ1  LYS  14           3HZ      LYS  14   3.889   6.705  -5.717
  121    HZ2  LYS  14           1HZ      LYS  14   3.488   8.078  -6.629
  122    HZ3  LYS  14           2HZ      LYS  14   2.959   6.545  -7.130
  123    H    GLU  15           H        GLU  15   4.387   4.259  -4.788
  124    HA   GLU  15           HA       GLU  15   6.582   4.864  -3.107
  125    HB2  GLU  15           2HB      GLU  15   6.041   6.007  -5.861
  126    HB3  GLU  15           1HB      GLU  15   7.607   5.622  -5.153
  127    HG2  GLU  15           2HG      GLU  15   5.484   3.735  -6.166
  128    HG3  GLU  15           1HG      GLU  15   7.194   3.798  -6.584
  129    H    GLY  16           H        GLY  16   6.219   6.446  -1.491
  130    HA2  GLY  16           2HA      GLY  16   6.506   9.170  -2.127
  131    HA3  GLY  16           1HA      GLY  16   4.773   8.887  -1.975
  132    H    HIS  17           H        HIS  17   5.157   6.793   0.106
  133    HA   HIS  17           HA       HIS  17   6.445   8.225   2.344
  134    HB2  HIS  17           2HB      HIS  17   4.190   8.214   3.568
  135    HB3  HIS  17           1HB      HIS  17   4.356   9.386   2.262
  136    HD1  HIS  17           1HD      HIS  17   3.558   8.222  -0.212
  137    HD2  HIS  17           2HD      HIS  17   1.845   6.811   3.318
  138    HE1  HIS  17           1HE      HIS  17   1.412   7.053  -0.873
  139    H    SER  18           H        SER  18   5.060   6.804   4.415
  140    HA   SER  18           HA       SER  18   5.803   3.973   3.736
  141    HB2  SER  18           2HB      SER  18   6.736   3.835   5.969
  142    HB3  SER  18           1HB      SER  18   7.385   5.281   5.192
  143    HG   SER  18           HG       SER  18   6.650   6.161   6.980
  144    H    ALA  19           H        ALA  19   4.998   3.091   6.409
  145    HA   ALA  19           HA       ALA  19   2.089   2.842   5.922
  146    HB1  ALA  19           3HB      ALA  19   2.393   1.156   7.825
  147    HB2  ALA  19           1HB      ALA  19   4.112   1.538   7.762
  148    HB3  ALA  19           2HB      ALA  19   3.316   0.829   6.367
  149    H    ARG  20           H        ARG  20   4.156   4.775   7.837
  150    HA   ARG  20           HA       ARG  20   2.474   5.036  10.192
  151    HB2  ARG  20           2HB      ARG  20   4.780   5.488  10.423
  152    HB3  ARG  20           1HB      ARG  20   4.819   6.483   8.968
  153    HG2  ARG  20           2HG      ARG  20   3.990   8.336  10.044
  154    HG3  ARG  20           1HG      ARG  20   3.016   7.381  11.163
  155    HD2  ARG  20           2HD      ARG  20   4.650   7.935  12.675
  156    HD3  ARG  20           1HD      ARG  20   5.570   6.641  11.881
  157    HE   ARG  20           HE       ARG  20   5.919   8.917  10.273
  158   HH11  ARG  20          1HH1      ARG  20   5.798   9.797  13.336
  159   HH12  ARG  20          2HH1      ARG  20   7.495   9.999  13.615
  160   HH21  ARG  20          1HH2      ARG  20   8.438   8.381  10.697
  161   HH22  ARG  20          2HH2      ARG  20   8.991   9.197  12.120
  162    H    GLN  21           H        GLN  21   2.706   6.753   7.103
  163    HA   GLN  21           HA       GLN  21   0.645   8.701   8.050
  164    HB2  GLN  21           2HB      GLN  21   2.542   9.800   7.173
  165    HB3  GLN  21           1HB      GLN  21   2.733   8.623   5.875
  166    HG2  GLN  21           2HG      GLN  21   0.873   9.486   4.672
  167    HG3  GLN  21           1HG      GLN  21   0.300  10.404   6.066
  168   HE21  GLN  21          1HE2      GLN  21   0.494  12.545   5.256
  169   HE22  GLN  21          2HE2      GLN  21   1.971  13.219   4.733
  170    H    CYS  22           H        CYS  22   1.078   5.933   6.059
  171    HA   CYS  22           HA       CYS  22  -1.209   6.547   4.283
  172    HB2  CYS  22           2HB      CYS  22   1.149   5.221   4.012
  173    HB3  CYS  22           1HB      CYS  22   0.053   3.875   4.320
  174    H    ARG  23           H        ARG  23  -3.235   5.842   4.651
  175    HA   ARG  23           HA       ARG  23  -3.747   3.413   6.247
  176    HB2  ARG  23           2HB      ARG  23  -3.791   6.040   7.335
  177    HB3  ARG  23           1HB      ARG  23  -5.471   5.514   7.192
  178    HG2  ARG  23           2HG      ARG  23  -3.239   3.950   8.515
  179    HG3  ARG  23           1HG      ARG  23  -4.527   4.816   9.355
  180    HD2  ARG  23           2HD      ARG  23  -5.217   2.723   7.289
  181    HD3  ARG  23           1HD      ARG  23  -4.845   2.251   8.959
  182    HE   ARG  23           HE       ARG  23  -7.007   4.195   8.228
  183   HH11  ARG  23          1HH1      ARG  23  -6.496   1.166   9.499
  184   HH12  ARG  23          2HH1      ARG  23  -7.389   1.418  10.961
  185   HH21  ARG  23          1HH2      ARG  23  -7.760   4.829  10.463
  186   HH22  ARG  23          2HH2      ARG  23  -8.100   3.491  11.508
  187    H    ALA  24           H        ALA  24  -4.145   4.696   3.473
  188    HA   ALA  24           HA       ALA  24  -6.690   5.389   2.724
  189    HB1  ALA  24           3HB      ALA  24  -6.208   3.809   0.726
  190    HB2  ALA  24           1HB      ALA  24  -4.724   3.398   1.587
  191    HB3  ALA  24           2HB      ALA  24  -5.014   5.061   1.075
  192    HA   PRO  25           HA       PRO  25  -9.499   2.167   3.758
  193    HB2  PRO  25           2HB      PRO  25 -11.137   2.094   1.568
  194    HB3  PRO  25           1HB      PRO  25 -11.172   3.415   2.755
  195    HG2  PRO  25           2HG      PRO  25  -9.897   3.318   0.069
  196    HG3  PRO  25           1HG      PRO  25 -10.737   4.653   0.873
  197    HD2  PRO  25           2HD      PRO  25  -8.016   4.455   0.708
  198    HD3  PRO  25           1HD      PRO  25  -8.867   5.315   2.012
  199    H    ARG  26           H        ARG  26  -8.325   1.937   0.406
  200    HA   ARG  26           HA       ARG  26  -8.814  -0.737  -0.137
  201    HB2  ARG  26           2HB      ARG  26  -6.827  -0.460  -1.669
  202    HB3  ARG  26           1HB      ARG  26  -8.011   0.842  -1.781
  203    HG2  ARG  26           2HG      ARG  26  -6.109   2.121  -1.553
  204    HG3  ARG  26           1HG      ARG  26  -6.473   1.878   0.154
  205    HD2  ARG  26           2HD      ARG  26  -4.110   1.365  -0.218
  206    HD3  ARG  26           1HD      ARG  26  -4.960  -0.158   0.101
  207    HE   ARG  26           HE       ARG  26  -4.331  -0.782  -2.082
  208   HH11  ARG  26          1HH2      ARG  26  -2.671   1.807  -2.290
  209   HH12  ARG  26          2HH2      ARG  26  -3.293   2.466  -3.764
  210   HH21  ARG  26          1HH1      ARG  26  -6.081   0.407  -3.817
  211   HH22  ARG  26          2HH1      ARG  26  -5.223   1.672  -4.630
  212    H    ARG  27           H        ARG  27  -6.645   0.600   2.159
  213    HA   ARG  27           HA       ARG  27  -4.434  -0.828   2.480
  214    HB2  ARG  27           2HB      ARG  27  -6.296   0.473   4.132
  215    HB3  ARG  27           1HB      ARG  27  -5.912  -1.044   4.940
  216    HG2  ARG  27           2HG      ARG  27  -3.593   0.370   3.779
  217    HG3  ARG  27           1HG      ARG  27  -4.379   1.200   5.125
  218    HD2  ARG  27           2HD      ARG  27  -4.119  -1.657   5.657
  219    HD3  ARG  27           1HD      ARG  27  -2.544  -0.897   5.362
  220    HE   ARG  27           HE       ARG  27  -3.079   0.736   7.135
  221   HH11  ARG  27          1HH1      ARG  27  -6.096  -0.275   6.691
  222   HH12  ARG  27          2HH1      ARG  27  -6.393  -0.878   8.286
  223   HH21  ARG  27          1HH2      ARG  27  -3.060  -0.767   9.236
  224   HH22  ARG  27          2HH2      ARG  27  -4.675  -1.155   9.729
  225    H    GLN  28           H        GLN  28  -3.821  -2.793   3.595
  226    HA   GLN  28           HA       GLN  28  -5.871  -4.973   3.588
  227    HB2  GLN  28           2HB      GLN  28  -3.955  -6.391   2.610
  228    HB3  GLN  28           1HB      GLN  28  -4.684  -5.213   1.520
  229    HG2  GLN  28           2HG      GLN  28  -2.851  -3.592   2.243
  230    HG3  GLN  28           1HG      GLN  28  -2.065  -4.968   3.017
  231   HE21  GLN  28          1HE2      GLN  28  -0.567  -3.878   1.044
  232   HE22  GLN  28          2HE2      GLN  28  -0.628  -4.806  -0.386
  233    H    GLY  29           H        GLY  29  -5.923  -5.662   5.691
  234    HA2  GLY  29           2HA      GLY  29  -4.277  -5.070   7.793
  235    HA3  GLY  29           1HA      GLY  29  -5.072  -6.635   7.682
  236    H    CYS  30           H        CYS  30  -3.884  -8.289   6.292
  237    HA   CYS  30           HA       CYS  30  -1.125  -8.475   7.185
  238    HB2  CYS  30           2HB      CYS  30  -1.224 -10.605   6.005
  239    HB3  CYS  30           1HB      CYS  30  -2.743 -10.363   6.866
  240    H    TRP  31           H        TRP  31   0.646  -8.940   5.532
  241    HA   TRP  31           HA       TRP  31   0.278  -7.297   3.060
  242    HB2  TRP  31           2HB      TRP  31   1.767  -6.684   5.371
  243    HB3  TRP  31           1HB      TRP  31   2.954  -7.153   4.149
  244    HD1  TRP  31           HD       TRP  31  -0.353  -5.166   3.980
  245    HE1  TRP  31           1HE      TRP  31   0.070  -3.019   2.605
  246    HE3  TRP  31           3HE      TRP  31   4.598  -5.741   3.007
  247    HZ2  TRP  31           2HZ      TRP  31   2.248  -1.732   1.260
  248    HZ3  TRP  31           3HZ      TRP  31   5.839  -4.055   1.678
  249    HH2  TRP  31           HH       TRP  31   4.669  -2.049   0.804
  250    H    LYS  32           H        LYS  32   1.905  -9.983   4.667
  251    HA   LYS  32           HA       LYS  32   3.702 -10.730   2.596
  252    HB2  LYS  32           2HB      LYS  32   3.739 -11.656   4.859
  253    HB3  LYS  32           1HB      LYS  32   2.133 -12.350   4.633
  254    HG2  LYS  32           2HG      LYS  32   4.038 -13.989   4.330
  255    HG3  LYS  32           1HG      LYS  32   2.943 -13.872   2.951
  256    HD2  LYS  32           2HD      LYS  32   4.478 -12.397   1.785
  257    HD3  LYS  32           1HD      LYS  32   5.538 -12.327   3.194
  258    HE2  LYS  32           2HE      LYS  32   6.649 -14.045   2.166
  259    HE3  LYS  32           1HE      LYS  32   5.317 -15.051   2.770
  260    HZ1  LYS  32           3HZ      LYS  32   5.660 -15.163   0.309
  261    HZ2  LYS  32           1HZ      LYS  32   5.201 -13.534   0.222
  262    HZ3  LYS  32           2HZ      LYS  32   4.095 -14.695   0.781
  263    H    CYS  33           H        CYS  33   0.240 -10.958   2.831
  264    HA   CYS  33           HA       CYS  33   0.177 -12.448   0.229
  265    HB2  CYS  33           2HB      CYS  33  -1.928 -13.512   1.206
  266    HB3  CYS  33           1HB      CYS  33  -0.417 -13.995   1.978
  267    H    GLY  34           H        GLY  34  -1.443 -10.187   2.442
  268    HA2  GLY  34           2HA      GLY  34  -2.613  -8.207   1.825
  269    HA3  GLY  34           1HA      GLY  34  -2.525  -8.713   0.136
  270    H    LYS  35           H        LYS  35  -4.536  -8.532   2.870
  271    HA   LYS  35           HA       LYS  35  -6.718  -9.879   1.382
  272    HB2  LYS  35           2HB      LYS  35  -5.318 -10.873   3.805
  273    HB3  LYS  35           1HB      LYS  35  -7.078 -11.005   3.818
  274    HG2  LYS  35           2HG      LYS  35  -6.617 -11.909   1.331
  275    HG3  LYS  35           1HG      LYS  35  -5.088 -12.374   2.077
  276    HD2  LYS  35           2HD      LYS  35  -6.589 -14.227   2.369
  277    HD3  LYS  35           1HD      LYS  35  -6.443 -13.439   3.940
  278    HE2  LYS  35           2HE      LYS  35  -8.803 -13.865   3.559
  279    HE3  LYS  35           1HE      LYS  35  -8.549 -12.121   3.345
  280    HZ1  LYS  35           3HZ      LYS  35  -9.260 -14.109   1.392
  281    HZ2  LYS  35           1HZ      LYS  35  -7.936 -13.166   0.910
  282    HZ3  LYS  35           2HZ      LYS  35  -9.406 -12.418   1.317
  283    H    THR  36           H        THR  36  -6.411  -9.092   4.823
  284    HA   THR  36           HA       THR  36  -7.739  -6.530   4.687
  285    HB   THR  36           HB       THR  36  -9.514  -8.165   3.922
  286    HG1  THR  36           1HG      THR  36 -10.017  -6.190   5.001
  287   HG21  THR  36          3HG2      THR  36  -8.533  -9.842   5.738
  288   HG22  THR  36          1HG2      THR  36 -10.234  -9.894   5.272
  289   HG23  THR  36          2HG2      THR  36  -9.750  -9.074   6.758
  290    H    GLY  37           H        GLY  37  -9.137  -6.641   7.121
  291    HA2  GLY  37           2HA      GLY  37  -7.514  -6.015   9.148
  292    HA3  GLY  37           1HA      GLY  37  -8.898  -7.055   9.469
  293    H    HIS  38           H        HIS  38  -8.095  -9.441   8.295
  294    HA   HIS  38           HA       HIS  38  -6.561 -10.719  10.236
  295    HB2  HIS  38           2HB      HIS  38  -7.154 -12.424   8.869
  296    HB3  HIS  38           1HB      HIS  38  -7.704 -11.242   7.688
  297    HD1  HIS  38           1HD      HIS  38  -6.744 -11.852   5.476
  298    HD2  HIS  38           2HD      HIS  38  -3.982 -12.425   8.546
  299    HE1  HIS  38           1HE      HIS  38  -4.600 -12.625   4.373
  300    H    VAL  39           H        VAL  39  -4.314 -11.155  10.476
  301    HA   VAL  39           HA       VAL  39  -2.471  -9.632   8.671
  302    HB   VAL  39           HB       VAL  39  -1.329  -8.793  10.656
  303   HG11  VAL  39          1HG1      VAL  39  -3.603  -7.808   9.784
  304   HG12  VAL  39          2HG1      VAL  39  -2.936  -7.230  11.311
  305   HG13  VAL  39          3HG1      VAL  39  -4.239  -8.419  11.313
  306   HG21  VAL  39          3HG2      VAL  39  -3.301  -9.733  12.613
  307   HG22  VAL  39          1HG2      VAL  39  -1.540  -9.736  12.707
  308   HG23  VAL  39          2HG2      VAL  39  -2.381 -11.050  11.887
  309    H    MET  40           H        MET  40  -0.122 -10.376   9.103
  310    HA   MET  40           HA       MET  40   0.258 -13.082   8.566
  311    HB2  MET  40           2HB      MET  40   1.877 -10.900   9.835
  312    HB3  MET  40           1HB      MET  40   2.557 -12.526   9.760
  313    HG2  MET  40           2HG      MET  40   1.546 -12.211   7.219
  314    HG3  MET  40           1HG      MET  40   2.101 -10.580   7.596
  315    HE1  MET  40           3HE      MET  40   3.570 -13.938   9.102
  316    HE2  MET  40           1HE      MET  40   4.621 -14.424   7.765
  317    HE3  MET  40           2HE      MET  40   2.879 -14.302   7.524
  318    H    ALA  41           H        ALA  41  -0.006 -11.511  11.738
  319    HA   ALA  41           HA       ALA  41   0.747 -13.608  13.463
  320    HB1  ALA  41           3HB      ALA  41  -1.712 -11.970  13.984
  321    HB2  ALA  41           1HB      ALA  41  -0.174 -11.130  13.772
  322    HB3  ALA  41           2HB      ALA  41  -0.361 -12.320  15.064
  323    H    LYS  42           H        LYS  42  -2.107 -13.207  11.494
  324    HA   LYS  42           HA       LYS  42  -3.055 -15.908  12.340
  325    HB2  LYS  42           2HB      LYS  42  -4.140 -13.251  12.881
  326    HB3  LYS  42           1HB      LYS  42  -5.325 -14.302  12.086
  327    HG2  LYS  42           2HG      LYS  42  -4.163 -15.981  13.956
  328    HG3  LYS  42           1HG      LYS  42  -4.225 -14.435  14.804
  329    HD2  LYS  42           2HD      LYS  42  -6.646 -15.329  13.280
  330    HD3  LYS  42           1HD      LYS  42  -6.311 -16.068  14.846
  331    HE2  LYS  42           2HE      LYS  42  -6.698 -14.105  16.008
  332    HE3  LYS  42           1HE      LYS  42  -6.144 -13.083  14.666
  333    HZ1  LYS  42           3HZ      LYS  42  -8.129 -13.217  13.608
  334    HZ2  LYS  42           1HZ      LYS  42  -8.706 -13.433  15.188
  335    HZ3  LYS  42           2HZ      LYS  42  -8.467 -14.782  14.181
  336    H    CYS  43           H        CYS  43  -1.762 -14.832   9.864
  337    HA   CYS  43           HA       CYS  43  -3.870 -14.621   7.842
  338    HB2  CYS  43           2HB      CYS  43  -1.578 -13.515   7.852
  339    HB3  CYS  43           1HB      CYS  43  -0.897 -15.105   7.511
  340    HA   PRO  44           HA       PRO  44  -4.161 -19.036   7.413
  341    HB2  PRO  44           2HB      PRO  44  -5.917 -19.033   5.318
  342    HB3  PRO  44           1HB      PRO  44  -6.409 -18.702   6.989
  343    HG2  PRO  44           2HG      PRO  44  -5.963 -16.821   4.741
  344    HG3  PRO  44           1HG      PRO  44  -7.138 -16.748   6.061
  345    HD2  PRO  44           2HD      PRO  44  -4.803 -15.282   5.950
  346    HD3  PRO  44           1HD      PRO  44  -5.701 -15.650   7.438
  347    H    GLU  45           H        GLU  45  -3.251 -16.787   4.886
  348    HA   GLU  45           HA       GLU  45  -1.913 -17.065   2.957
  349    HB2  GLU  45           2HB      GLU  45  -0.997 -19.117   4.964
  350    HB3  GLU  45           1HB      GLU  45  -0.211 -19.007   3.388
  351    HG2  GLU  45           2HG      GLU  45  -0.219 -16.395   4.030
  352    HG3  GLU  45           1HG      GLU  45  -0.186 -17.078   5.656
  353    H    ARG  46           H        ARG  46  -3.804 -17.706   1.653
  354    HA   ARG  46           HA       ARG  46  -4.879 -19.150   0.129
  355    HB2  ARG  46           2HB      ARG  46  -2.375 -20.772   0.697
  356    HB3  ARG  46           1HB      ARG  46  -3.422 -20.951  -0.710
  357    HG2  ARG  46           2HG      ARG  46  -2.858 -18.234  -0.683
  358    HG3  ARG  46           1HG      ARG  46  -1.331 -18.970  -0.194
  359    HD2  ARG  46           2HD      ARG  46  -2.910 -19.491  -2.729
  360    HD3  ARG  46           1HD      ARG  46  -1.234 -18.931  -2.578
  361    HE   ARG  46           HE       ARG  46  -0.705 -21.175  -1.574
  362   HH11  ARG  46          1HH1      ARG  46  -3.968 -20.988  -2.488
  363   HH12  ARG  46          2HH1      ARG  46  -4.005 -22.541  -3.252
  364   HH21  ARG  46          1HH2      ARG  46  -0.598 -23.082  -2.934
  365   HH22  ARG  46          2HH2      ARG  46  -2.102 -23.724  -3.506
  366    H    GLN  47           H        GLN  47  -6.706 -19.957   1.133
  367    HA   GLN  47           HA       GLN  47  -6.380 -22.468   2.743
  368    HB2  GLN  47           2HB      GLN  47  -6.918 -20.163   3.901
  369    HB3  GLN  47           1HB      GLN  47  -8.539 -20.436   3.261
  370    HG2  GLN  47           2HG      GLN  47  -8.760 -21.525   5.282
  371    HG3  GLN  47           1HG      GLN  47  -8.135 -22.861   4.313
  372   HE21  GLN  47          1HE2      GLN  47  -6.562 -23.955   5.493
  373   HE22  GLN  47          2HE2      GLN  47  -5.384 -23.217   6.467
  374    H    ALA  48           H        ALA  48  -9.459 -22.237   2.979
  375    HA   ALA  48           HA       ALA  48 -10.020 -23.566   0.372
  376    HB1  ALA  48           3HB      ALA  48 -12.024 -24.374   1.614
  377    HB2  ALA  48           1HB      ALA  48 -11.533 -23.399   3.000
  378    HB3  ALA  48           2HB      ALA  48 -10.526 -24.744   2.469
  379    H    GLY  49           H        GLY  49  -9.796 -20.643   0.473
  380    HA2  GLY  49           2HA      GLY  49 -12.643 -19.926  -0.117
  381    HA3  GLY  49           1HA      GLY  49 -11.499 -18.778   0.581
  Start of MODEL    2
    1    H1   ALA   1           1HT      ALA   1  20.207  14.211   3.328
    2    H2   ALA   1           2HT      ALA   1  18.641  13.557   3.254
    3    H3   ALA   1           3HT      ALA   1  18.857  15.239   3.362
    4    HA   ALA   1           HA       ALA   1  18.277  14.402   1.079
    5    HB1  ALA   1           3HB      ALA   1  20.232  16.267   2.100
    6    HB2  ALA   1           1HB      ALA   1  19.170  16.444   0.702
    7    HB3  ALA   1           2HB      ALA   1  20.748  15.678   0.520
    8    H    GLN   2           H        GLN   2  18.885  13.026  -0.606
    9    HA   GLN   2           HA       GLN   2  20.040  11.263  -1.678
   10    HB2  GLN   2           2HB      GLN   2  21.877  13.290  -0.822
   11    HB3  GLN   2           1HB      GLN   2  22.655  11.719  -0.621
   12    HG2  GLN   2           2HG      GLN   2  22.056  11.138  -2.956
   13    HG3  GLN   2           1HG      GLN   2  21.330  12.734  -3.154
   14   HE21  GLN   2          1HE2      GLN   2  23.831  11.433  -4.421
   15   HE22  GLN   2          2HE2      GLN   2  25.057  12.578  -4.165
   16    H    GLN   3           H        GLN   3  21.158   9.192  -1.186
   17    HA   GLN   3           HA       GLN   3  21.459   7.284   0.181
   18    HB2  GLN   3           2HB      GLN   3  22.568   9.652   1.500
   19    HB3  GLN   3           1HB      GLN   3  22.133   8.384   2.646
   20    HG2  GLN   3           2HG      GLN   3  23.921   7.163   2.038
   21    HG3  GLN   3           1HG      GLN   3  23.414   7.204   0.349
   22   HE21  GLN   3          1HE2      GLN   3  25.001   8.113  -0.957
   23   HE22  GLN   3          2HE2      GLN   3  26.043   9.371  -0.498
   24    H    ARG   4           H        ARG   4  20.757   6.440   2.499
   25    HA   ARG   4           HA       ARG   4  18.961   5.934   3.954
   26    HB2  ARG   4           2HB      ARG   4  17.910   8.701   3.380
   27    HB3  ARG   4           1HB      ARG   4  17.911   7.816   4.904
   28    HG2  ARG   4           2HG      ARG   4  20.255   9.151   3.535
   29    HG3  ARG   4           1HG      ARG   4  19.589   9.499   5.128
   30    HD2  ARG   4           2HD      ARG   4  20.229   7.108   5.780
   31    HD3  ARG   4           1HD      ARG   4  21.168   7.059   4.274
   32    HE   ARG   4           HE       ARG   4  21.641   8.998   6.501
   33   HH11  ARG   4          1HH2      ARG   4  23.572   6.772   5.729
   34   HH12  ARG   4          2HH2      ARG   4  24.736   7.647   4.792
   35   HH21  ARG   4          1HH1      ARG   4  22.701  10.420   4.360
   36   HH22  ARG   4          2HH1      ARG   4  24.244   9.711   4.017
   37    H    LYS   5           H        LYS   5  16.530   5.657   3.902
   38    HA   LYS   5           HA       LYS   5  15.557   5.526   1.068
   39    HB2  LYS   5           2HB      LYS   5  15.593   3.733   3.371
   40    HB3  LYS   5           1HB      LYS   5  13.966   3.909   2.709
   41    HG2  LYS   5           2HG      LYS   5  15.187   3.592   0.398
   42    HG3  LYS   5           1HG      LYS   5  16.443   2.846   1.387
   43    HD2  LYS   5           2HD      LYS   5  13.607   2.018   1.854
   44    HD3  LYS   5           1HD      LYS   5  14.429   1.402   0.421
   45    HE2  LYS   5           2HE      LYS   5  16.271   0.544   1.836
   46    HE3  LYS   5           1HE      LYS   5  15.434   1.151   3.280
   47    HZ1  LYS   5           3HZ      LYS   5  14.532  -0.932   1.379
   48    HZ2  LYS   5           1HZ      LYS   5  13.444  -0.133   2.405
   49    HZ3  LYS   5           2HZ      LYS   5  14.711  -1.052   3.064
   50    H    VAL   6           H        VAL   6  13.039   5.657   1.001
   51    HA   VAL   6           HA       VAL   6  12.219   7.973   2.701
   52    HB   VAL   6           HB       VAL   6  10.959   6.950   0.146
   53   HG11  VAL   6          1HG1      VAL   6  11.040   9.701   1.425
   54   HG12  VAL   6          2HG1      VAL   6   9.681   8.582   1.532
   55   HG13  VAL   6          3HG1      VAL   6  10.150   9.253  -0.030
   56   HG21  VAL   6          3HG2      VAL   6  13.031   7.409  -0.735
   57   HG22  VAL   6          1HG2      VAL   6  13.484   8.456   0.609
   58   HG23  VAL   6          2HG2      VAL   6  12.432   9.066  -0.668
   59    H    ILE   7           H        ILE   7  11.964   5.912   4.237
   60    HA   ILE   7           HA       ILE   7  10.517   4.311   5.271
   61    HB   ILE   7           HB       ILE   7   8.722   6.690   4.758
   62   HG12  ILE   7          2HG1      ILE   7  11.289   6.486   6.072
   63   HG13  ILE   7          1HG1      ILE   7  10.284   7.911   5.841
   64   HG21  ILE   7          1HG2      ILE   7   7.753   4.582   5.809
   65   HG22  ILE   7          2HG2      ILE   7   7.612   6.045   6.785
   66   HG23  ILE   7          3HG2      ILE   7   8.853   4.850   7.161
   67   HD11  ILE   7          3HD1      ILE   7   9.026   7.402   7.868
   68   HD12  ILE   7          1HD1      ILE   7  10.748   7.440   8.245
   69   HD13  ILE   7          2HD1      ILE   7   9.916   5.894   8.074
   70    H    ARG   8           H        ARG   8   9.943   2.524   3.981
   71    HA   ARG   8           HA       ARG   8   8.101   2.777   1.715
   72    HB2  ARG   8           2HB      ARG   8  10.057   1.106   2.187
   73    HB3  ARG   8           1HB      ARG   8   8.866   0.236   3.156
   74    HG2  ARG   8           2HG      ARG   8   7.432   0.697   0.883
   75    HG3  ARG   8           1HG      ARG   8   9.057   0.527   0.220
   76    HD2  ARG   8           2HD      ARG   8   8.158  -1.477   2.263
   77    HD3  ARG   8           1HD      ARG   8   7.551  -1.627   0.602
   78    HE   ARG   8           HE       ARG   8  10.366  -1.898   1.438
   79   HH11  ARG   8          1HH1      ARG   8   8.246  -3.113  -0.710
   80   HH12  ARG   8          2HH1      ARG   8   9.216  -2.903  -2.129
   81   HH21  ARG   8          1HH2      ARG   8  11.555  -0.885  -0.555
   82   HH22  ARG   8          2HH2      ARG   8  11.089  -1.642  -2.042
   83    H    CYS   9           H        CYS   9   6.045   3.419   2.378
   84    HA   CYS   9           HA       CYS   9   4.782   2.722   4.839
   85    HB2  CYS   9           2HB      CYS   9   4.155   4.628   3.458
   86    HB3  CYS   9           1HB      CYS   9   3.688   3.553   2.137
   87    H    TRP  10           H        TRP  10   3.189   1.188   5.306
   88    HA   TRP  10           HA       TRP  10   3.202  -1.302   3.694
   89    HB2  TRP  10           2HB      TRP  10   2.077  -0.491   6.398
   90    HB3  TRP  10           1HB      TRP  10   1.918  -2.101   5.722
   91    HD1  TRP  10           HD       TRP  10   3.747  -3.731   6.219
   92    HE1  TRP  10           1HE      TRP  10   6.093  -3.619   7.264
   93    HE3  TRP  10           3HE      TRP  10   4.297   1.323   6.567
   94    HZ2  TRP  10           2HZ      TRP  10   7.958  -1.625   8.145
   95    HZ3  TRP  10           3HZ      TRP  10   6.351   2.304   7.518
   96    HH2  TRP  10           HH       TRP  10   8.172   0.842   8.308
   97    H    ASN  11           H        ASN  11   0.913   0.741   5.414
   98    HA   ASN  11           HA       ASN  11  -1.533  -0.018   4.750
   99    HB2  ASN  11           2HB      ASN  11  -1.106   2.015   5.946
  100    HB3  ASN  11           1HB      ASN  11  -0.348   2.750   4.533
  101   HD21  ASN  11          1HD2      ASN  11  -3.382   0.848   4.607
  102   HD22  ASN  11          2HD2      ASN  11  -4.372   2.109   4.057
  103    H    CYS  12           H        CYS  12  -0.155   2.425   2.560
  104    HA   CYS  12           HA       CYS  12  -1.778   1.303   0.348
  105    HB2  CYS  12           2HB      CYS  12  -1.424   3.434  -0.650
  106    HB3  CYS  12           1HB      CYS  12  -1.600   3.753   1.074
  107    H    GLY  13           H        GLY  13   1.441   1.171   1.519
  108    HA2  GLY  13           2HA      GLY  13   3.293  -0.009   0.669
  109    HA3  GLY  13           1HA      GLY  13   2.280  -0.526  -0.678
  110    H    LYS  14           H        LYS  14   4.201   2.202   0.531
  111    HA   LYS  14           HA       LYS  14   5.353   2.753  -2.038
  112    HB2  LYS  14           2HB      LYS  14   2.704   3.505  -1.830
  113    HB3  LYS  14           1HB      LYS  14   3.553   5.002  -1.442
  114    HG2  LYS  14           2HG      LYS  14   3.933   3.296  -3.919
  115    HG3  LYS  14           1HG      LYS  14   3.209   4.901  -3.848
  116    HD2  LYS  14           2HD      LYS  14   5.923   4.683  -2.681
  117    HD3  LYS  14           1HD      LYS  14   5.829   4.468  -4.428
  118    HE2  LYS  14           2HE      LYS  14   4.836   6.622  -4.743
  119    HE3  LYS  14           1HE      LYS  14   4.509   6.800  -3.008
  120    HZ1  LYS  14           3HZ      LYS  14   7.160   6.687  -4.340
  121    HZ2  LYS  14           1HZ      LYS  14   6.957   6.556  -2.661
  122    HZ3  LYS  14           2HZ      LYS  14   6.503   7.984  -3.462
  123    H    GLU  15           H        GLU  15   7.229   3.797  -1.531
  124    HA   GLU  15           HA       GLU  15   7.861   4.753   1.075
  125    HB2  GLU  15           2HB      GLU  15   9.038   4.512  -1.567
  126    HB3  GLU  15           1HB      GLU  15   9.544   6.013  -0.793
  127    HG2  GLU  15           2HG      GLU  15  10.812   4.928   0.735
  128    HG3  GLU  15           1HG      GLU  15   9.567   3.715   1.029
  129    H    GLY  16           H        GLY  16   7.933   6.887   1.918
  130    HA2  GLY  16           2HA      GLY  16   7.884   9.356   1.030
  131    HA3  GLY  16           1HA      GLY  16   6.309   8.872   0.402
  132    H    HIS  17           H        HIS  17   6.139   7.085   2.961
  133    HA   HIS  17           HA       HIS  17   5.869   9.080   5.100
  134    HB2  HIS  17           2HB      HIS  17   3.330   8.469   5.200
  135    HB3  HIS  17           1HB      HIS  17   3.864   9.654   4.010
  136    HD1  HIS  17           1HD      HIS  17   4.259   8.687   1.520
  137    HD2  HIS  17           2HD      HIS  17   2.139   6.204   4.110
  138    HE1  HIS  17           1HE      HIS  17   3.091   6.970   0.070
  139    H    SER  18           H        SER  18   4.202   7.775   6.813
  140    HA   SER  18           HA       SER  18   5.618   5.178   7.239
  141    HB2  SER  18           2HB      SER  18   4.357   5.760   9.576
  142    HB3  SER  18           1HB      SER  18   5.960   6.371   9.165
  143    HG   SER  18           HG       SER  18   4.685   8.105   9.734
  144    H    ALA  19           H        ALA  19   4.172   3.523   8.441
  145    HA   ALA  19           HA       ALA  19   1.725   3.130   6.855
  146    HB1  ALA  19           3HB      ALA  19   2.609   1.065   7.131
  147    HB2  ALA  19           1HB      ALA  19   1.954   1.115   8.763
  148    HB3  ALA  19           2HB      ALA  19   3.623   1.597   8.469
  149    H    ARG  20           H        ARG  20   2.506   4.616   9.807
  150    HA   ARG  20           HA       ARG  20  -0.029   3.971  11.173
  151    HB2  ARG  20           2HB      ARG  20   2.074   4.225  12.409
  152    HB3  ARG  20           1HB      ARG  20   2.273   5.858  11.772
  153    HG2  ARG  20           2HG      ARG  20   0.153   6.527  12.879
  154    HG3  ARG  20           1HG      ARG  20   0.015   4.906  13.560
  155    HD2  ARG  20           2HD      ARG  20   1.079   6.709  15.076
  156    HD3  ARG  20           1HD      ARG  20   1.996   5.200  14.890
  157    HE   ARG  20           HE       ARG  20   3.472   6.335  13.325
  158   HH11  ARG  20          1HH1      ARG  20   0.756   8.274  13.448
  159   HH12  ARG  20          2HH1      ARG  20   1.608   9.776  13.580
  160   HH21  ARG  20          1HH2      ARG  20   4.700   8.283  14.060
  161   HH22  ARG  20          2HH2      ARG  20   3.842   9.781  13.926
  162    H    GLN  21           H        GLN  21   1.395   6.617   9.302
  163    HA   GLN  21           HA       GLN  21  -0.869   8.423   9.872
  164    HB2  GLN  21           2HB      GLN  21   0.447   9.989   8.559
  165    HB3  GLN  21           1HB      GLN  21   1.544   9.121   9.633
  166    HG2  GLN  21           2HG      GLN  21   2.321   7.717   7.870
  167    HG3  GLN  21           1HG      GLN  21   1.007   8.209   6.801
  168   HE21  GLN  21          1HE2      GLN  21   4.109   9.218   8.174
  169   HE22  GLN  21          2HE2      GLN  21   4.321  10.569   7.153
  170    H    CYS  22           H        CYS  22   0.223   6.251   7.319
  171    HA   CYS  22           HA       CYS  22  -1.780   7.245   5.389
  172    HB2  CYS  22           2HB      CYS  22   0.687   5.918   5.317
  173    HB3  CYS  22           1HB      CYS  22  -0.482   4.698   4.811
  174    H    ARG  23           H        ARG  23  -3.768   6.405   5.153
  175    HA   ARG  23           HA       ARG  23  -4.410   3.855   6.581
  176    HB2  ARG  23           2HB      ARG  23  -5.653   5.362   7.785
  177    HB3  ARG  23           1HB      ARG  23  -5.581   6.576   6.511
  178    HG2  ARG  23           2HG      ARG  23  -7.887   5.819   6.817
  179    HG3  ARG  23           1HG      ARG  23  -7.293   5.311   5.236
  180    HD2  ARG  23           2HD      ARG  23  -8.068   3.249   5.884
  181    HD3  ARG  23           1HD      ARG  23  -6.552   3.175   6.804
  182    HE   ARG  23           HE       ARG  23  -9.090   3.294   8.022
  183   HH11  ARG  23          1HH2      ARG  23  -6.071   3.418   9.076
  184   HH12  ARG  23          2HH2      ARG  23  -6.256   4.699  10.228
  185   HH21  ARG  23          1HH1      ARG  23  -9.367   5.668   9.048
  186   HH22  ARG  23          2HH1      ARG  23  -8.121   5.972  10.212
  187    H    ALA  24           H        ALA  24  -4.371   5.583   3.601
  188    HA   ALA  24           HA       ALA  24  -5.355   5.124   1.480
  189    HB1  ALA  24           3HB      ALA  24  -5.079   2.234   2.156
  190    HB2  ALA  24           1HB      ALA  24  -3.637   3.231   2.348
  191    HB3  ALA  24           2HB      ALA  24  -4.436   3.127   0.779
  192    HA   PRO  25           HA       PRO  25  -9.481   3.566   1.729
  193    HB2  PRO  25           2HB      PRO  25  -9.805   1.720  -0.255
  194    HB3  PRO  25           1HB      PRO  25  -9.583   3.450  -0.576
  195    HG2  PRO  25           2HG      PRO  25  -7.685   1.218  -0.892
  196    HG3  PRO  25           1HG      PRO  25  -7.779   2.754  -1.760
  197    HD2  PRO  25           2HD      PRO  25  -5.988   2.103   0.302
  198    HD3  PRO  25           1HD      PRO  25  -6.284   3.719  -0.372
  199    H    ARG  26           H        ARG  26  -8.622   0.391   0.532
  200    HA   ARG  26           HA       ARG  26  -9.867  -0.920   2.720
  201    HB2  ARG  26           2HB      ARG  26  -9.828  -2.699   1.275
  202    HB3  ARG  26           1HB      ARG  26  -9.543  -1.396   0.127
  203    HG2  ARG  26           2HG      ARG  26  -7.493  -3.235   1.375
  204    HG3  ARG  26           1HG      ARG  26  -7.904  -3.082  -0.329
  205    HD2  ARG  26           2HD      ARG  26  -7.069  -0.525   0.806
  206    HD3  ARG  26           1HD      ARG  26  -5.812  -1.757   0.951
  207    HE   ARG  26           HE       ARG  26  -7.228  -1.230  -1.631
  208   HH11  ARG  26          1HH1      ARG  26  -4.367  -0.864   0.149
  209   HH12  ARG  26          2HH1      ARG  26  -3.312  -1.358  -1.134
  210   HH21  ARG  26          1HH2      ARG  26  -5.894  -2.279  -3.258
  211   HH22  ARG  26          2HH2      ARG  26  -4.178  -2.162  -3.061
  212    H    ARG  27           H        ARG  27  -6.634   0.180   2.356
  213    HA   ARG  27           HA       ARG  27  -4.671  -0.291   3.609
  214    HB2  ARG  27           2HB      ARG  27  -6.785  -1.533   5.393
  215    HB3  ARG  27           1HB      ARG  27  -5.143  -1.120   5.888
  216    HG2  ARG  27           2HG      ARG  27  -5.611   1.234   5.151
  217    HG3  ARG  27           1HG      ARG  27  -7.301   0.768   4.949
  218    HD2  ARG  27           2HD      ARG  27  -7.425   1.456   7.162
  219    HD3  ARG  27           1HD      ARG  27  -6.845  -0.193   7.456
  220    HE   ARG  27           HE       ARG  27  -4.707   1.737   6.910
  221   HH11  ARG  27          1HH2      ARG  27  -5.963  -0.590   9.011
  222   HH12  ARG  27          2HH2      ARG  27  -5.202   0.040  10.430
  223   HH21  ARG  27          1HH1      ARG  27  -4.019   2.896   8.863
  224   HH22  ARG  27          2HH1      ARG  27  -4.100   2.008  10.348
  225    H    GLN  28           H        GLN  28  -3.241  -2.088   4.176
  226    HA   GLN  28           HA       GLN  28  -3.883  -4.526   2.642
  227    HB2  GLN  28           2HB      GLN  28  -1.644  -4.407   2.306
  228    HB3  GLN  28           1HB      GLN  28  -1.579  -2.998   3.351
  229    HG2  GLN  28           2HG      GLN  28  -1.643  -5.671   4.680
  230    HG3  GLN  28           1HG      GLN  28  -0.165  -5.210   3.850
  231   HE21  GLN  28          1HE2      GLN  28  -2.473  -3.079   5.598
  232   HE22  GLN  28          2HE2      GLN  28  -1.322  -2.509   6.719
  233    H    GLY  29           H        GLY  29  -5.284  -5.830   3.753
  234    HA2  GLY  29           2HA      GLY  29  -5.930  -6.065   6.380
  235    HA3  GLY  29           1HA      GLY  29  -5.793  -7.503   5.368
  236    H    CYS  30           H        CYS  30  -3.873  -8.764   5.492
  237    HA   CYS  30           HA       CYS  30  -2.581  -8.860   8.043
  238    HB2  CYS  30           2HB      CYS  30  -2.889 -10.484   5.906
  239    HB3  CYS  30           1HB      CYS  30  -1.234  -9.945   5.636
  240    H    TRP  31           H        TRP  31  -0.767  -7.800   8.774
  241    HA   TRP  31           HA       TRP  31   0.377  -5.667   7.123
  242    HB2  TRP  31           2HB      TRP  31   0.118  -6.444   9.894
  243    HB3  TRP  31           1HB      TRP  31   1.773  -5.940   9.538
  244    HD1  TRP  31           HD       TRP  31  -1.689  -4.674   8.378
  245    HE1  TRP  31           1HE      TRP  31  -1.710  -2.092   8.616
  246    HE3  TRP  31           3HE      TRP  31   2.978  -3.974  10.243
  247    HZ2  TRP  31           2HZ      TRP  31   0.068  -0.010   9.512
  248    HZ3  TRP  31           3HZ      TRP  31   3.812  -1.697  10.786
  249    HH2  TRP  31           HH       TRP  31   2.363   0.282  10.419
  250    H    LYS  32           H        LYS  32   2.031  -8.174   9.081
  251    HA   LYS  32           HA       LYS  32   4.379  -7.948   7.355
  252    HB2  LYS  32           2HB      LYS  32   5.225  -9.706   8.962
  253    HB3  LYS  32           1HB      LYS  32   4.650  -8.228   9.735
  254    HG2  LYS  32           2HG      LYS  32   2.427 -10.008   9.399
  255    HG3  LYS  32           1HG      LYS  32   3.744 -10.887  10.177
  256    HD2  LYS  32           2HD      LYS  32   2.918  -8.133  11.093
  257    HD3  LYS  32           1HD      LYS  32   2.147  -9.590  11.722
  258    HE2  LYS  32           2HE      LYS  32   4.165 -10.377  12.698
  259    HE3  LYS  32           1HE      LYS  32   5.159  -9.270  11.732
  260    HZ1  LYS  32           3HZ      LYS  32   3.122  -7.908  13.215
  261    HZ2  LYS  32           1HZ      LYS  32   4.789  -7.604  13.148
  262    HZ3  LYS  32           2HZ      LYS  32   4.180  -8.762  14.233
  263    H    CYS  33           H        CYS  33   1.969  -8.962   5.979
  264    HA   CYS  33           HA       CYS  33   3.084 -11.585   5.090
  265    HB2  CYS  33           2HB      CYS  33   0.167 -11.111   5.741
  266    HB3  CYS  33           1HB      CYS  33   0.922 -12.643   5.324
  267    H    GLY  34           H        GLY  34   0.143  -9.629   4.489
  268    HA2  GLY  34           2HA      GLY  34  -0.132  -8.272   2.463
  269    HA3  GLY  34           1HA      GLY  34   1.006  -9.346   1.650
  270    H    LYS  35           H        LYS  35  -2.073  -9.755   3.466
  271    HA   LYS  35           HA       LYS  35  -3.159 -11.237   1.110
  272    HB2  LYS  35           2HB      LYS  35  -2.378 -12.259   3.762
  273    HB3  LYS  35           1HB      LYS  35  -3.998 -12.739   3.258
  274    HG2  LYS  35           2HG      LYS  35  -1.819 -12.945   1.230
  275    HG3  LYS  35           1HG      LYS  35  -1.829 -14.135   2.532
  276    HD2  LYS  35           2HD      LYS  35  -3.747 -15.128   1.793
  277    HD3  LYS  35           1HD      LYS  35  -4.455 -13.599   1.270
  278    HE2  LYS  35           2HE      LYS  35  -2.106 -14.765  -0.225
  279    HE3  LYS  35           1HE      LYS  35  -3.759 -15.303  -0.580
  280    HZ1  LYS  35           3HZ      LYS  35  -2.523 -12.713  -1.032
  281    HZ2  LYS  35           1HZ      LYS  35  -4.096 -12.659  -0.400
  282    HZ3  LYS  35           2HZ      LYS  35  -3.796 -13.468  -1.864
  283    H    THR  36           H        THR  36  -5.539 -12.075   2.270
  284    HA   THR  36           HA       THR  36  -6.791  -9.543   3.287
  285    HB   THR  36           HB       THR  36  -8.713 -10.141   1.808
  286    HG1  THR  36           1HG      THR  36  -8.733 -12.003   0.861
  287   HG21  THR  36          3HG2      THR  36  -6.339  -8.960   1.114
  288   HG22  THR  36          1HG2      THR  36  -7.766  -9.019   0.080
  289   HG23  THR  36          2HG2      THR  36  -6.486 -10.216  -0.115
  290    H    GLY  37           H        GLY  37  -8.740  -9.927   4.596
  291    HA2  GLY  37           2HA      GLY  37 -10.119 -11.172   6.059
  292    HA3  GLY  37           1HA      GLY  37  -9.474 -12.652   5.344
  293    H    HIS  38           H        HIS  38  -6.829 -12.576   5.812
  294    HA   HIS  38           HA       HIS  38  -6.676 -12.818   8.750
  295    HB2  HIS  38           2HB      HIS  38  -5.731 -14.640   7.633
  296    HB3  HIS  38           1HB      HIS  38  -5.099 -13.639   6.329
  297    HD1  HIS  38           1HD      HIS  38  -2.765 -14.857   6.788
  298    HD2  HIS  38           2HD      HIS  38  -4.117 -12.402   9.873
  299    HE1  HIS  38           1HE      HIS  38  -0.776 -14.445   8.299
  300    H    VAL  39           H        VAL  39  -6.626 -10.603   9.436
  301    HA   VAL  39           HA       VAL  39  -4.403  -8.909   8.388
  302    HB   VAL  39           HB       VAL  39  -5.679  -7.092   9.366
  303   HG11  VAL  39          1HG1      VAL  39  -6.511  -7.994   7.220
  304   HG12  VAL  39          2HG1      VAL  39  -7.835  -7.380   8.209
  305   HG13  VAL  39          3HG1      VAL  39  -7.548  -9.117   8.098
  306   HG21  VAL  39          3HG2      VAL  39  -6.589  -9.190  11.109
  307   HG22  VAL  39          1HG2      VAL  39  -7.990  -8.414  10.370
  308   HG23  VAL  39          2HG2      VAL  39  -6.823  -7.450  11.272
  309    H    MET  40           H        MET  40  -3.231  -7.604  10.117
  310    HA   MET  40           HA       MET  40  -1.851  -9.180  11.969
  311    HB2  MET  40           2HB      MET  40  -1.113  -7.063  12.865
  312    HB3  MET  40           1HB      MET  40  -1.401  -6.816  11.143
  313    HG2  MET  40           2HG      MET  40  -2.671  -5.057  11.824
  314    HG3  MET  40           1HG      MET  40  -3.879  -6.287  12.189
  315    HE1  MET  40           3HE      MET  40  -3.071  -3.364  13.163
  316    HE2  MET  40           1HE      MET  40  -1.417  -3.594  13.747
  317    HE3  MET  40           2HE      MET  40  -2.713  -3.229  14.883
  318    H    ALA  41           H        ALA  41  -5.029  -7.749  12.249
  319    HA   ALA  41           HA       ALA  41  -5.486  -7.643  15.017
  320    HB1  ALA  41           3HB      ALA  41  -7.340  -8.769  12.894
  321    HB2  ALA  41           1HB      ALA  41  -7.017  -7.045  13.087
  322    HB3  ALA  41           2HB      ALA  41  -7.813  -7.944  14.380
  323    H    LYS  42           H        LYS  42  -5.618 -10.414  12.828
  324    HA   LYS  42           HA       LYS  42  -5.905 -12.222  15.196
  325    HB2  LYS  42           2HB      LYS  42  -7.251 -11.817  12.659
  326    HB3  LYS  42           1HB      LYS  42  -6.706 -13.497  12.825
  327    HG2  LYS  42           2HG      LYS  42  -8.265 -11.984  14.943
  328    HG3  LYS  42           1HG      LYS  42  -8.997 -13.086  13.774
  329    HD2  LYS  42           2HD      LYS  42  -6.707 -13.968  15.531
  330    HD3  LYS  42           1HD      LYS  42  -8.377 -14.054  16.093
  331    HE2  LYS  42           2HE      LYS  42  -8.879 -15.326  13.910
  332    HE3  LYS  42           1HE      LYS  42  -7.119 -15.499  13.752
  333    HZ1  LYS  42           3HZ      LYS  42  -7.776 -17.338  15.020
  334    HZ2  LYS  42           1HZ      LYS  42  -8.861 -16.430  15.956
  335    HZ3  LYS  42           2HZ      LYS  42  -7.187 -16.231  16.167
  336    H    CYS  43           H        CYS  43  -3.646 -11.185  12.982
  337    HA   CYS  43           HA       CYS  43  -2.478 -13.759  12.225
  338    HB2  CYS  43           2HB      CYS  43  -2.374 -11.561  10.956
  339    HB3  CYS  43           1HB      CYS  43  -1.264 -10.978  12.196
  340    HA   PRO  44           HA       PRO  44  -0.506 -13.941  16.261
  341    HB2  PRO  44           2HB      PRO  44   0.186 -16.578  16.088
  342    HB3  PRO  44           1HB      PRO  44  -1.447 -16.034  16.518
  343    HG2  PRO  44           2HG      PRO  44  -0.434 -17.132  13.966
  344    HG3  PRO  44           1HG      PRO  44  -2.038 -17.261  14.698
  345    HD2  PRO  44           2HD      PRO  44  -1.336 -15.552  12.618
  346    HD3  PRO  44           1HD      PRO  44  -2.782 -15.407  13.637
  347    H    GLU  45           H        GLU  45   0.826 -15.049  13.176
  348    HA   GLU  45           HA       GLU  45   3.033 -15.006  12.341
  349    HB2  GLU  45           2HB      GLU  45   3.190 -12.999  14.612
  350    HB3  GLU  45           1HB      GLU  45   4.441 -13.200  13.386
  351    HG2  GLU  45           2HG      GLU  45   3.291 -11.880  11.978
  352    HG3  GLU  45           1HG      GLU  45   1.918 -12.984  12.056
  353    H    ARG  46           H        ARG  46   4.972 -16.147  12.700
  354    HA   ARG  46           HA       ARG  46   6.293 -17.803  13.768
  355    HB2  ARG  46           2HB      ARG  46   5.849 -15.878  16.074
  356    HB3  ARG  46           1HB      ARG  46   7.237 -16.942  15.843
  357    HG2  ARG  46           2HG      ARG  46   6.493 -14.889  13.765
  358    HG3  ARG  46           1HG      ARG  46   7.496 -14.459  15.150
  359    HD2  ARG  46           2HD      ARG  46   8.255 -16.918  13.621
  360    HD3  ARG  46           1HD      ARG  46   8.606 -15.341  12.884
  361    HE   ARG  46           HE       ARG  46   9.512 -14.905  15.388
  362   HH11  ARG  46          1HH1      ARG  46   9.996 -17.415  13.081
  363   HH12  ARG  46          2HH1      ARG  46  11.451 -17.996  13.818
  364   HH21  ARG  46          1HH2      ARG  46  11.334 -15.745  16.451
  365   HH22  ARG  46          2HH2      ARG  46  12.208 -17.051  15.726
  366    H    GLN  47           H        GLN  47   4.610 -19.483  13.766
  367    HA   GLN  47           HA       GLN  47   3.074 -19.752  16.315
  368    HB2  GLN  47           2HB      GLN  47   2.742 -20.479  13.470
  369    HB3  GLN  47           1HB      GLN  47   2.203 -21.715  14.609
  370    HG2  GLN  47           2HG      GLN  47   0.702 -20.187  15.692
  371    HG3  GLN  47           1HG      GLN  47   1.389 -18.808  14.830
  372   HE21  GLN  47          1HE2      GLN  47   0.604 -18.366  12.711
  373   HE22  GLN  47          2HE2      GLN  47  -0.595 -19.293  11.949
  374    H    ALA  48           H        ALA  48   5.490 -21.337  14.292
  375    HA   ALA  48           HA       ALA  48   5.700 -23.540  16.311
  376    HB1  ALA  48           3HB      ALA  48   6.457 -24.888  14.510
  377    HB2  ALA  48           1HB      ALA  48   6.869 -23.483  13.526
  378    HB3  ALA  48           2HB      ALA  48   5.179 -23.904  13.800
  379    H    GLY  49           H        GLY  49   7.209 -22.734  17.798
  380    HA2  GLY  49           2HA      GLY  49   9.940 -22.867  17.364
  381    HA3  GLY  49           1HA      GLY  49   9.535 -21.199  16.956
  Start of MODEL    3
    1    H1   ALA   1           1HT      ALA   1  17.835  17.496  -2.070
    2    H2   ALA   1           2HT      ALA   1  18.907  18.809  -2.189
    3    H3   ALA   1           3HT      ALA   1  19.489  17.268  -1.775
    4    HA   ALA   1           HA       ALA   1  18.630  18.279  -4.406
    5    HB1  ALA   1           3HB      ALA   1  20.843  17.958  -4.798
    6    HB2  ALA   1           1HB      ALA   1  20.798  16.337  -4.105
    7    HB3  ALA   1           2HB      ALA   1  21.009  17.739  -3.057
    8    H    GLN   2           H        GLN   2  16.522  16.895  -3.815
    9    HA   GLN   2           HA       GLN   2  15.252  14.958  -4.288
   10    HB2  GLN   2           2HB      GLN   2  17.335  15.329  -6.255
   11    HB3  GLN   2           1HB      GLN   2  17.019  13.607  -6.042
   12    HG2  GLN   2           2HG      GLN   2  14.892  15.707  -6.555
   13    HG3  GLN   2           1HG      GLN   2  15.545  14.613  -7.774
   14   HE21  GLN   2          1HE2      GLN   2  12.814  14.434  -7.292
   15   HE22  GLN   2          2HE2      GLN   2  12.460  13.017  -6.426
   16    H    GLN   3           H        GLN   3  15.781  12.345  -4.588
   17    HA   GLN   3           HA       GLN   3  16.463  10.400  -3.428
   18    HB2  GLN   3           2HB      GLN   3  18.663  11.888  -4.135
   19    HB3  GLN   3           1HB      GLN   3  18.902  11.706  -2.397
   20    HG2  GLN   3           2HG      GLN   3  18.295   9.395  -4.260
   21    HG3  GLN   3           1HG      GLN   3  19.925   9.855  -3.767
   22   HE21  GLN   3          1HE2      GLN   3  16.853   8.518  -2.583
   23   HE22  GLN   3          2HE2      GLN   3  17.472   7.952  -1.108
   24    H    ARG   4           H        ARG   4  14.958  10.340  -1.701
   25    HA   ARG   4           HA       ARG   4  15.953  10.769   0.962
   26    HB2  ARG   4           2HB      ARG   4  14.460  12.724   1.496
   27    HB3  ARG   4           1HB      ARG   4  15.734  13.112   0.337
   28    HG2  ARG   4           2HG      ARG   4  14.219  13.651  -1.238
   29    HG3  ARG   4           1HG      ARG   4  13.400  12.102  -1.043
   30    HD2  ARG   4           2HD      ARG   4  11.801  12.979   0.351
   31    HD3  ARG   4           1HD      ARG   4  12.952  14.081   1.135
   32    HE   ARG   4           HE       ARG   4  12.392  15.702  -0.486
   33   HH11  ARG   4          1HH1      ARG   4   9.810  14.178  -0.952
   34   HH12  ARG   4          2HH1      ARG   4   9.833  13.981  -2.673
   35   HH21  ARG   4          1HH2      ARG   4  13.200  14.749  -2.981
   36   HH22  ARG   4          2HH2      ARG   4  11.753  14.304  -3.821
   37    H    LYS   5           H        LYS   5  14.894   9.109   1.957
   38    HA   LYS   5           HA       LYS   5  11.945   8.822   1.504
   39    HB2  LYS   5           2HB      LYS   5  12.428   6.322   1.637
   40    HB3  LYS   5           1HB      LYS   5  13.049   7.123   0.195
   41    HG2  LYS   5           2HG      LYS   5  15.271   7.310   1.241
   42    HG3  LYS   5           1HG      LYS   5  14.657   6.523   2.695
   43    HD2  LYS   5           2HD      LYS   5  14.054   4.531   1.299
   44    HD3  LYS   5           1HD      LYS   5  14.832   5.310  -0.078
   45    HE2  LYS   5           2HE      LYS   5  16.926   5.490   1.423
   46    HE3  LYS   5           1HE      LYS   5  16.113   4.311   2.473
   47    HZ1  LYS   5           3HZ      LYS   5  15.780   2.888   0.536
   48    HZ2  LYS   5           1HZ      LYS   5  17.430   3.174   0.801
   49    HZ3  LYS   5           2HZ      LYS   5  16.615   3.999  -0.441
   50    H    VAL   6           H        VAL   6  10.884   8.926   3.462
   51    HA   VAL   6           HA       VAL   6  12.441   8.170   5.915
   52    HB   VAL   6           HB       VAL   6  11.802  10.652   5.289
   53   HG11  VAL   6          1HG1      VAL   6   9.649  11.364   5.711
   54   HG12  VAL   6          2HG1      VAL   6   9.325  10.053   6.845
   55   HG13  VAL   6          3HG1      VAL   6   9.310   9.741   5.111
   56   HG21  VAL   6          3HG2      VAL   6  12.748  10.639   7.358
   57   HG22  VAL   6          1HG2      VAL   6  11.884   9.179   7.841
   58   HG23  VAL   6          2HG2      VAL   6  11.087  10.749   7.939
   59    H    ILE   7           H        ILE   7  11.436   6.826   7.352
   60    HA   ILE   7           HA       ILE   7   9.967   5.027   7.870
   61    HB   ILE   7           HB       ILE   7   9.470   7.378   8.963
   62   HG12  ILE   7          2HG1      ILE   7   9.027   5.034   9.846
   63   HG13  ILE   7          1HG1      ILE   7   7.932   6.284  10.438
   64   HG21  ILE   7          1HG2      ILE   7   6.852   6.791   7.563
   65   HG22  ILE   7          2HG2      ILE   7   7.955   8.082   7.090
   66   HG23  ILE   7          3HG2      ILE   7   7.181   8.119   8.674
   67   HD11  ILE   7          3HD1      ILE   7   6.619   4.347   9.782
   68   HD12  ILE   7          1HD1      ILE   7   7.387   4.325   8.194
   69   HD13  ILE   7          2HD1      ILE   7   6.316   5.656   8.637
   70    H    ARG   8           H        ARG   8   9.237   3.559   6.425
   71    HA   ARG   8           HA       ARG   8   7.644   4.300   4.083
   72    HB2  ARG   8           2HB      ARG   8   7.653   1.763   3.825
   73    HB3  ARG   8           1HB      ARG   8   9.247   2.513   3.909
   74    HG2  ARG   8           2HG      ARG   8   9.698   1.650   5.997
   75    HG3  ARG   8           1HG      ARG   8   8.004   1.662   6.484
   76    HD2  ARG   8           2HD      ARG   8   9.309  -0.305   4.570
   77    HD3  ARG   8           1HD      ARG   8   8.679  -0.660   6.190
   78    HE   ARG   8           HE       ARG   8   6.553   0.547   4.834
   79   HH11  ARG   8          1HH2      ARG   8   8.366  -2.359   4.921
   80   HH12  ARG   8          2HH2      ARG   8   7.286  -3.232   3.885
   81   HH21  ARG   8          1HH1      ARG   8   5.242  -0.496   3.270
   82   HH22  ARG   8          2HH1      ARG   8   5.516  -2.177   2.949
   83    H    CYS   9           H        CYS   9   5.459   4.569   4.165
   84    HA   CYS   9           HA       CYS   9   3.876   3.907   6.503
   85    HB2  CYS   9           2HB      CYS   9   3.275   5.797   5.179
   86    HB3  CYS   9           1HB      CYS   9   3.341   4.863   3.681
   87    H    TRP  10           H        TRP  10   3.175   1.842   6.960
   88    HA   TRP  10           HA       TRP  10   3.314  -0.325   5.071
   89    HB2  TRP  10           2HB      TRP  10   2.938  -1.533   6.975
   90    HB3  TRP  10           1HB      TRP  10   3.075   0.009   7.809
   91    HD1  TRP  10           HD       TRP  10   0.233  -1.892   5.956
   92    HE1  TRP  10           1HE      TRP  10  -1.923  -1.644   7.341
   93    HE3  TRP  10           3HE      TRP  10   1.992   0.955   9.792
   94    HZ2  TRP  10           2HZ      TRP  10  -2.787  -0.409   9.772
   95    HZ3  TRP  10           3HZ      TRP  10   0.488   1.651  11.640
   96    HH2  TRP  10           HH       TRP  10  -1.898   0.973  11.632
   97    H    ASN  11           H        ASN  11   0.602   1.533   6.405
   98    HA   ASN  11           HA       ASN  11  -1.610   0.355   5.284
   99    HB2  ASN  11           2HB      ASN  11  -1.023   2.644   6.610
  100    HB3  ASN  11           1HB      ASN  11  -1.469   3.299   5.032
  101   HD21  ASN  11          1HD2      ASN  11  -3.539   1.950   4.111
  102   HD22  ASN  11          2HD2      ASN  11  -4.818   1.835   5.221
  103    H    CYS  12           H        CYS  12   0.709   2.417   3.518
  104    HA   CYS  12           HA       CYS  12  -0.744   1.630   1.020
  105    HB2  CYS  12           2HB      CYS  12  -0.666   3.878   0.260
  106    HB3  CYS  12           1HB      CYS  12  -1.160   3.979   1.948
  107    H    GLY  13           H        GLY  13   2.151   1.574   2.701
  108    HA2  GLY  13           2HA      GLY  13   4.319   0.946   2.068
  109    HA3  GLY  13           1HA      GLY  13   3.625   0.436   0.530
  110    H    LYS  14           H        LYS  14   4.742   3.321   2.288
  111    HA   LYS  14           HA       LYS  14   6.128   4.317  -0.064
  112    HB2  LYS  14           2HB      LYS  14   3.509   4.729  -0.235
  113    HB3  LYS  14           1HB      LYS  14   3.874   6.073   0.847
  114    HG2  LYS  14           2HG      LYS  14   5.536   5.647  -1.620
  115    HG3  LYS  14           1HG      LYS  14   3.977   6.464  -1.740
  116    HD2  LYS  14           2HD      LYS  14   4.656   8.205  -0.275
  117    HD3  LYS  14           1HD      LYS  14   6.056   7.292   0.287
  118    HE2  LYS  14           2HE      LYS  14   6.007   7.738  -2.635
  119    HE3  LYS  14           1HE      LYS  14   6.187   9.213  -1.662
  120    HZ1  LYS  14           3HZ      LYS  14   7.913   8.068  -0.369
  121    HZ2  LYS  14           1HZ      LYS  14   8.342   8.212  -2.004
  122    HZ3  LYS  14           2HZ      LYS  14   7.790   6.723  -1.401
  123    H    GLU  15           H        GLU  15   7.853   5.414   0.780
  124    HA   GLU  15           HA       GLU  15   7.943   6.121   3.608
  125    HB2  GLU  15           2HB      GLU  15   9.709   5.833   1.299
  126    HB3  GLU  15           1HB      GLU  15  10.142   7.227   2.289
  127    HG2  GLU  15           2HG      GLU  15  10.749   5.939   4.079
  128    HG3  GLU  15           1HG      GLU  15   9.487   4.745   3.776
  129    H    GLY  16           H        GLY  16   8.271   8.289   4.424
  130    HA2  GLY  16           2HA      GLY  16   8.492  10.738   3.783
  131    HA3  GLY  16           1HA      GLY  16   7.222  10.421   2.599
  132    H    HIS  17           H        HIS  17   6.131   8.513   4.817
  133    HA   HIS  17           HA       HIS  17   5.147  10.381   6.855
  134    HB2  HIS  17           2HB      HIS  17   2.888  10.469   6.080
  135    HB3  HIS  17           1HB      HIS  17   3.874  10.783   4.653
  136    HD1  HIS  17           1HD      HIS  17   4.416   8.503   3.184
  137    HD2  HIS  17           2HD      HIS  17   1.126   8.377   5.739
  138    HE1  HIS  17           1HE      HIS  17   2.979   6.568   2.407
  139    H    SER  18           H        SER  18   3.451   9.162   8.273
  140    HA   SER  18           HA       SER  18   4.359   6.327   8.493
  141    HB2  SER  18           2HB      SER  18   2.896   6.935  10.742
  142    HB3  SER  18           1HB      SER  18   4.640   7.143  10.590
  143    HG   SER  18           HG       SER  18   3.844   9.106  11.185
  144    H    ALA  19           H        ALA  19   2.794   4.660   8.831
  145    HA   ALA  19           HA       ALA  19   0.438   4.799   7.206
  146    HB1  ALA  19           3HB      ALA  19   0.015   2.576   8.276
  147    HB2  ALA  19           1HB      ALA  19   1.308   2.923   9.424
  148    HB3  ALA  19           2HB      ALA  19   1.677   2.746   7.708
  149    H    ARG  20           H        ARG  20   0.960   5.132  10.704
  150    HA   ARG  20           HA       ARG  20  -1.640   5.083  11.717
  151    HB2  ARG  20           2HB      ARG  20  -0.760   6.560  13.440
  152    HB3  ARG  20           1HB      ARG  20   0.545   5.490  12.929
  153    HG2  ARG  20           2HG      ARG  20   1.739   7.399  12.637
  154    HG3  ARG  20           1HG      ARG  20   0.798   7.584  11.159
  155    HD2  ARG  20           2HD      ARG  20   0.697   9.649  12.529
  156    HD3  ARG  20           1HD      ARG  20  -0.906   8.891  12.435
  157    HE   ARG  20           HE       ARG  20   0.769   8.003  14.689
  158   HH11  ARG  20          1HH2      ARG  20  -0.459  10.993  14.195
  159   HH12  ARG  20          2HH2      ARG  20  -1.671  10.940  15.431
  160   HH21  ARG  20          1HH1      ARG  20  -1.315   7.536  15.998
  161   HH22  ARG  20          2HH1      ARG  20  -2.155   8.980  16.454
  162    H    GLN  21           H        GLN  21  -0.150   7.412   9.598
  163    HA   GLN  21           HA       GLN  21  -2.407   9.317   9.882
  164    HB2  GLN  21           2HB      GLN  21  -0.056  10.086   9.903
  165    HB3  GLN  21           1HB      GLN  21   0.181   9.384   8.302
  166    HG2  GLN  21           2HG      GLN  21  -0.928  11.068   7.257
  167    HG3  GLN  21           1HG      GLN  21  -2.148  11.177   8.525
  168   HE21  GLN  21          1HE2      GLN  21  -1.016  13.547   7.463
  169   HE22  GLN  21          2HE2      GLN  21  -0.035  14.275   8.654
  170    H    CYS  22           H        CYS  22  -0.806   7.247   7.471
  171    HA   CYS  22           HA       CYS  22  -2.844   7.879   5.418
  172    HB2  CYS  22           2HB      CYS  22  -0.135   7.035   5.540
  173    HB3  CYS  22           1HB      CYS  22  -1.035   5.730   4.773
  174    H    ARG  23           H        ARG  23  -4.527   6.509   4.916
  175    HA   ARG  23           HA       ARG  23  -4.608   3.854   6.266
  176    HB2  ARG  23           2HB      ARG  23  -6.713   5.981   5.833
  177    HB3  ARG  23           1HB      ARG  23  -7.123   4.327   6.294
  178    HG2  ARG  23           2HG      ARG  23  -5.200   6.083   7.847
  179    HG3  ARG  23           1HG      ARG  23  -6.908   5.899   8.250
  180    HD2  ARG  23           2HD      ARG  23  -6.638   3.721   8.997
  181    HD3  ARG  23           1HD      ARG  23  -5.273   3.406   7.911
  182    HE   ARG  23           HE       ARG  23  -3.964   5.025   9.398
  183   HH11  ARG  23          1HH1      ARG  23  -5.393   2.307  10.502
  184   HH12  ARG  23          2HH1      ARG  23  -5.538   2.788  12.160
  185   HH21  ARG  23          1HH2      ARG  23  -4.731   6.104  11.545
  186   HH22  ARG  23          2HH2      ARG  23  -5.164   4.937  12.750
  187    H    ALA  24           H        ALA  24  -4.454   5.487   3.335
  188    HA   ALA  24           HA       ALA  24  -5.067   4.888   1.106
  189    HB1  ALA  24           3HB      ALA  24  -4.790   2.051   2.034
  190    HB2  ALA  24           1HB      ALA  24  -3.416   3.129   2.280
  191    HB3  ALA  24           2HB      ALA  24  -4.037   2.849   0.653
  192    HA   PRO  25           HA       PRO  25  -9.152   3.200   0.886
  193    HB2  PRO  25           2HB      PRO  25  -9.253   0.723  -0.291
  194    HB3  PRO  25           1HB      PRO  25  -8.968   2.217  -1.203
  195    HG2  PRO  25           2HG      PRO  25  -7.030   0.157  -0.299
  196    HG3  PRO  25           1HG      PRO  25  -7.067   1.094  -1.800
  197    HD2  PRO  25           2HD      PRO  25  -5.420   1.644   0.299
  198    HD3  PRO  25           1HD      PRO  25  -5.958   2.867  -0.871
  199    H    ARG  26           H        ARG  26  -8.645  -0.214   1.130
  200    HA   ARG  26           HA       ARG  26  -9.581  -0.122   3.856
  201    HB2  ARG  26           2HB      ARG  26  -9.722  -1.863   1.560
  202    HB3  ARG  26           1HB      ARG  26  -9.305  -2.764   3.023
  203    HG2  ARG  26           2HG      ARG  26 -11.637  -0.879   2.661
  204    HG3  ARG  26           1HG      ARG  26 -11.716  -2.633   2.857
  205    HD2  ARG  26           2HD      ARG  26 -10.333  -2.106   5.082
  206    HD3  ARG  26           1HD      ARG  26 -11.125  -0.526   4.911
  207    HE   ARG  26           HE       ARG  26 -13.088  -2.536   4.457
  208   HH11  ARG  26          1HH2      ARG  26 -10.842  -2.157   6.976
  209   HH12  ARG  26          2HH2      ARG  26 -12.023  -2.176   8.244
  210   HH21  ARG  26          1HH1      ARG  26 -14.732  -2.195   6.078
  211   HH22  ARG  26          2HH1      ARG  26 -14.226  -2.199   7.735
  212    H    ARG  27           H        ARG  27  -6.773   0.648   3.457
  213    HA   ARG  27           HA       ARG  27  -4.629   0.071   4.341
  214    HB2  ARG  27           2HB      ARG  27  -6.208  -1.748   6.146
  215    HB3  ARG  27           1HB      ARG  27  -4.791  -0.775   6.535
  216    HG2  ARG  27           2HG      ARG  27  -6.048   1.255   6.477
  217    HG3  ARG  27           1HG      ARG  27  -7.436   0.455   5.733
  218    HD2  ARG  27           2HD      ARG  27  -8.227  -0.202   7.742
  219    HD3  ARG  27           1HD      ARG  27  -6.647  -0.859   8.210
  220    HE   ARG  27           HE       ARG  27  -6.301   1.895   8.309
  221   HH11  ARG  27          1HH2      ARG  27  -6.490  -0.223  10.620
  222   HH12  ARG  27          2HH2      ARG  27  -7.590   0.604  11.672
  223   HH21  ARG  27          1HH1      ARG  27  -8.569   2.909   9.274
  224   HH22  ARG  27          2HH1      ARG  27  -8.770   2.375  10.909
  225    H    GLN  28           H        GLN  28  -3.321  -1.996   5.026
  226    HA   GLN  28           HA       GLN  28  -3.634  -3.917   2.796
  227    HB2  GLN  28           2HB      GLN  28  -1.551  -3.041   4.727
  228    HB3  GLN  28           1HB      GLN  28  -1.437  -4.713   4.176
  229    HG2  GLN  28           2HG      GLN  28  -0.168  -3.425   2.612
  230    HG3  GLN  28           1HG      GLN  28  -1.689  -3.805   1.802
  231   HE21  GLN  28          1HE2      GLN  28  -3.476  -2.028   2.239
  232   HE22  GLN  28          2HE2      GLN  28  -2.952  -0.408   2.181
  233    H    GLY  29           H        GLY  29  -5.248  -5.408   3.282
  234    HA2  GLY  29           2HA      GLY  29  -6.164  -6.403   5.671
  235    HA3  GLY  29           1HA      GLY  29  -6.008  -7.435   4.248
  236    H    CYS  30           H        CYS  30  -3.616  -8.146   3.863
  237    HA   CYS  30           HA       CYS  30  -2.712  -9.472   6.331
  238    HB2  CYS  30           2HB      CYS  30  -2.716  -9.943   3.550
  239    HB3  CYS  30           1HB      CYS  30  -1.019  -9.781   4.001
  240    H    TRP  31           H        TRP  31  -0.949  -8.820   7.531
  241    HA   TRP  31           HA       TRP  31   0.462  -6.340   6.710
  242    HB2  TRP  31           2HB      TRP  31  -0.351  -7.706   9.133
  243    HB3  TRP  31           1HB      TRP  31   1.364  -7.309   9.202
  244    HD1  TRP  31           HD       TRP  31  -1.674  -5.372   7.784
  245    HE1  TRP  31           1HE      TRP  31  -1.631  -2.983   8.761
  246    HE3  TRP  31           3HE      TRP  31   2.428  -5.760  10.753
  247    HZ2  TRP  31           2HZ      TRP  31  -0.025  -1.452  10.614
  248    HZ3  TRP  31           3HZ      TRP  31   3.202  -3.841  12.118
  249    HH2  TRP  31           HH       TRP  31   1.981  -1.686  12.044
  250    H    LYS  32           H        LYS  32   1.590  -9.328   8.332
  251    HA   LYS  32           HA       LYS  32   4.292  -9.141   7.532
  252    HB2  LYS  32           2HB      LYS  32   3.545 -10.640   9.269
  253    HB3  LYS  32           1HB      LYS  32   2.478 -11.490   8.150
  254    HG2  LYS  32           2HG      LYS  32   4.619 -12.016   6.804
  255    HG3  LYS  32           1HG      LYS  32   5.495 -11.531   8.257
  256    HD2  LYS  32           2HD      LYS  32   4.600 -13.285   9.537
  257    HD3  LYS  32           1HD      LYS  32   3.248 -13.526   8.430
  258    HE2  LYS  32           2HE      LYS  32   4.437 -15.098   7.319
  259    HE3  LYS  32           1HE      LYS  32   5.704 -13.903   6.974
  260    HZ1  LYS  32           3HZ      LYS  32   5.528 -14.900   9.709
  261    HZ2  LYS  32           1HZ      LYS  32   6.895 -14.489   8.794
  262    HZ3  LYS  32           2HZ      LYS  32   6.127 -15.984   8.545
  263    H    CYS  33           H        CYS  33   1.494 -10.001   5.677
  264    HA   CYS  33           HA       CYS  33   3.195 -11.158   3.502
  265    HB2  CYS  33           2HB      CYS  33   1.332 -12.527   4.336
  266    HB3  CYS  33           1HB      CYS  33   0.208 -11.199   4.047
  267    H    GLY  34           H        GLY  34   0.579  -8.795   4.107
  268    HA2  GLY  34           2HA      GLY  34   0.234  -6.704   3.054
  269    HA3  GLY  34           1HA      GLY  34   1.661  -7.007   2.062
  270    H    LYS  35           H        LYS  35  -1.774  -7.163   2.184
  271    HA   LYS  35           HA       LYS  35  -1.823  -8.015  -0.663
  272    HB2  LYS  35           2HB      LYS  35  -2.722  -9.535   1.712
  273    HB3  LYS  35           1HB      LYS  35  -3.880  -9.486   0.382
  274    HG2  LYS  35           2HG      LYS  35  -0.964 -10.247   0.051
  275    HG3  LYS  35           1HG      LYS  35  -2.269 -11.417   0.253
  276    HD2  LYS  35           2HD      LYS  35  -2.533 -11.333  -1.987
  277    HD3  LYS  35           1HD      LYS  35  -3.200  -9.717  -1.749
  278    HE2  LYS  35           2HE      LYS  35  -0.378  -9.432  -1.636
  279    HE3  LYS  35           1HE      LYS  35  -0.737 -10.442  -3.051
  280    HZ1  LYS  35           3HZ      LYS  35  -2.042  -8.843  -3.990
  281    HZ2  LYS  35           1HZ      LYS  35  -0.948  -7.839  -3.172
  282    HZ3  LYS  35           2HZ      LYS  35  -2.478  -8.151  -2.501
  283    H    THR  36           H        THR  36  -4.564  -8.033   1.540
  284    HA   THR  36           HA       THR  36  -5.435  -5.325   1.149
  285    HB   THR  36           HB       THR  36  -5.792  -5.648  -1.119
  286    HG1  THR  36           1HG      THR  36  -8.130  -7.001  -0.474
  287   HG21  THR  36          3HG2      THR  36  -6.894  -8.108  -1.666
  288   HG22  THR  36          1HG2      THR  36  -5.798  -8.489  -0.338
  289   HG23  THR  36          2HG2      THR  36  -5.178  -7.723  -1.800
  290    H    GLY  37           H        GLY  37  -7.247  -8.378   0.813
  291    HA2  GLY  37           2HA      GLY  37  -8.820  -7.599   3.215
  292    HA3  GLY  37           1HA      GLY  37  -9.325  -8.787   2.009
  293    H    HIS  38           H        HIS  38  -7.574 -10.664   1.824
  294    HA   HIS  38           HA       HIS  38  -7.655 -12.264   4.106
  295    HB2  HIS  38           2HB      HIS  38  -6.765 -13.606   2.515
  296    HB3  HIS  38           1HB      HIS  38  -6.422 -12.200   1.518
  297    HD1  HIS  38           1HD      HIS  38  -4.027 -12.133   0.875
  298    HD2  HIS  38           2HD      HIS  38  -4.522 -13.713   4.700
  299    HE1  HIS  38           1HE      HIS  38  -1.706 -12.668   1.733
  300    H    VAL  39           H        VAL  39  -6.980 -11.591   6.121
  301    HA   VAL  39           HA       VAL  39  -4.519  -9.944   6.382
  302    HB   VAL  39           HB       VAL  39  -5.366  -9.672   8.694
  303   HG11  VAL  39          1HG1      VAL  39  -6.421  -8.596   6.444
  304   HG12  VAL  39          2HG1      VAL  39  -6.989  -8.186   8.062
  305   HG13  VAL  39          3HG1      VAL  39  -7.856  -9.384   7.100
  306   HG21  VAL  39          3HG2      VAL  39  -6.307 -12.057   8.735
  307   HG22  VAL  39          1HG2      VAL  39  -7.693 -11.416   7.850
  308   HG23  VAL  39          2HG2      VAL  39  -7.321 -10.813   9.465
  309    H    MET  40           H        MET  40  -2.941 -10.587   8.117
  310    HA   MET  40           HA       MET  40  -1.774 -13.094   7.810
  311    HB2  MET  40           2HB      MET  40  -0.526 -12.523   9.756
  312    HB3  MET  40           1HB      MET  40  -1.018 -10.970   9.079
  313    HG2  MET  40           2HG      MET  40  -3.140 -11.390  10.660
  314    HG3  MET  40           1HG      MET  40  -1.957 -12.342  11.559
  315    HE1  MET  40           3HE      MET  40  -0.323 -10.361  13.665
  316    HE2  MET  40           1HE      MET  40   0.798 -10.624  12.321
  317    HE3  MET  40           2HE      MET  40  -0.399 -11.851  12.727
  318    H    ALA  41           H        ALA  41  -4.553 -12.220   9.751
  319    HA   ALA  41           HA       ALA  41  -4.753 -14.456  11.503
  320    HB1  ALA  41           3HB      ALA  41  -6.916 -13.617  11.829
  321    HB2  ALA  41           1HB      ALA  41  -7.131 -13.252  10.117
  322    HB3  ALA  41           2HB      ALA  41  -6.124 -12.208  11.120
  323    H    LYS  42           H        LYS  42  -6.228 -13.884   8.348
  324    HA   LYS  42           HA       LYS  42  -7.013 -16.724   8.091
  325    HB2  LYS  42           2HB      LYS  42  -7.858 -14.071   7.328
  326    HB3  LYS  42           1HB      LYS  42  -7.800 -15.127   5.903
  327    HG2  LYS  42           2HG      LYS  42  -8.949 -16.495   8.200
  328    HG3  LYS  42           1HG      LYS  42  -9.837 -15.017   7.829
  329    HD2  LYS  42           2HD      LYS  42  -9.066 -16.842   5.580
  330    HD3  LYS  42           1HD      LYS  42 -10.443 -17.276   6.593
  331    HE2  LYS  42           2HE      LYS  42 -10.204 -14.500   5.419
  332    HE3  LYS  42           1HE      LYS  42 -10.941 -15.829   4.502
  333    HZ1  LYS  42           3HZ      LYS  42 -12.764 -15.222   5.672
  334    HZ2  LYS  42           1HZ      LYS  42 -11.872 -14.516   6.929
  335    HZ3  LYS  42           2HZ      LYS  42 -12.067 -16.204   6.871
  336    H    CYS  43           H        CYS  43  -4.202 -15.240   7.559
  337    HA   CYS  43           HA       CYS  43  -3.594 -15.615   4.786
  338    HB2  CYS  43           2HB      CYS  43  -2.345 -14.836   7.231
  339    HB3  CYS  43           1HB      CYS  43  -1.322 -16.061   6.478
  340    HA   PRO  44           HA       PRO  44  -2.727 -19.928   4.560
  341    HB2  PRO  44           2HB      PRO  44  -0.306 -20.078   3.298
  342    HB3  PRO  44           1HB      PRO  44  -1.788 -19.549   2.480
  343    HG2  PRO  44           2HG      PRO  44   0.504 -17.957   3.440
  344    HG3  PRO  44           1HG      PRO  44  -0.598 -17.658   2.091
  345    HD2  PRO  44           2HD      PRO  44  -0.682 -16.423   4.602
  346    HD3  PRO  44           1HD      PRO  44  -1.962 -16.391   3.371
  347    H    GLU  45           H        GLU  45  -1.161 -18.129   6.765
  348    HA   GLU  45           HA       GLU  45   0.801 -20.221   7.589
  349    HB2  GLU  45           2HB      GLU  45   0.330 -17.412   8.637
  350    HB3  GLU  45           1HB      GLU  45   1.746 -18.421   8.923
  351    HG2  GLU  45           2HG      GLU  45   0.955 -17.785   6.099
  352    HG3  GLU  45           1HG      GLU  45   1.815 -16.572   7.046
  353    H    ARG  46           H        ARG  46   0.291 -18.675  10.347
  354    HA   ARG  46           HA       ARG  46  -2.206 -19.275  11.367
  355    HB2  ARG  46           2HB      ARG  46  -0.681 -21.601  10.629
  356    HB3  ARG  46           1HB      ARG  46  -0.931 -21.603  12.375
  357    HG2  ARG  46           2HG      ARG  46  -3.389 -21.087  11.874
  358    HG3  ARG  46           1HG      ARG  46  -3.027 -21.505  10.200
  359    HD2  ARG  46           2HD      ARG  46  -2.870 -23.737  10.660
  360    HD3  ARG  46           1HD      ARG  46  -2.061 -23.454  12.215
  361    HE   ARG  46           HE       ARG  46  -4.988 -23.465  11.771
  362   HH11  ARG  46          1HH1      ARG  46  -2.946 -21.578  13.609
  363   HH12  ARG  46          2HH1      ARG  46  -3.575 -22.065  15.147
  364   HH21  ARG  46          1HH2      ARG  46  -5.525 -24.615  13.845
  365   HH22  ARG  46          2HH2      ARG  46  -5.032 -23.781  15.281
  366    H    GLN  47           H        GLN  47  -1.482 -17.453  12.632
  367    HA   GLN  47           HA       GLN  47   0.842 -17.709  14.397
  368    HB2  GLN  47           2HB      GLN  47   0.122 -15.590  13.352
  369    HB3  GLN  47           1HB      GLN  47  -1.415 -15.689  14.210
  370    HG2  GLN  47           2HG      GLN  47   0.203 -15.926  16.320
  371    HG3  GLN  47           1HG      GLN  47   1.303 -15.043  15.261
  372   HE21  GLN  47          1HE2      GLN  47   1.163 -12.844  15.705
  373   HE22  GLN  47          2HE2      GLN  47  -0.272 -12.004  16.043
  374    H    ALA  48           H        ALA  48   0.096 -19.679  15.575
  375    HA   ALA  48           HA       ALA  48  -2.263 -19.352  17.338
  376    HB1  ALA  48           3HB      ALA  48  -0.262 -21.619  17.066
  377    HB2  ALA  48           1HB      ALA  48  -1.701 -21.452  16.060
  378    HB3  ALA  48           2HB      ALA  48  -1.865 -21.710  17.797
  379    H    GLY  49           H        GLY  49   0.433 -17.840  17.594
  380    HA2  GLY  49           2HA      GLY  49   1.343 -16.884  19.593
  381    HA3  GLY  49           1HA      GLY  49   0.656 -18.221  20.517
  Start of MODEL    4
    1    H1   ALA   1           1HT      ALA   1  24.860   0.187  -0.105
    2    H2   ALA   1           2HT      ALA   1  25.015  -1.440  -0.567
    3    H3   ALA   1           3HT      ALA   1  24.682  -1.042   1.051
    4    HA   ALA   1           HA       ALA   1  22.826  -0.314  -1.144
    5    HB1  ALA   1           3HB      ALA   1  23.656  -2.874  -0.527
    6    HB2  ALA   1           1HB      ALA   1  22.097  -2.469  -1.244
    7    HB3  ALA   1           2HB      ALA   1  22.237  -2.683   0.501
    8    H    GLN   2           H        GLN   2  21.632   1.279  -0.172
    9    HA   GLN   2           HA       GLN   2  20.996   1.001   2.745
   10    HB2  GLN   2           2HB      GLN   2  21.178   3.419   0.917
   11    HB3  GLN   2           1HB      GLN   2  20.771   3.482   2.633
   12    HG2  GLN   2           2HG      GLN   2  22.926   3.132   3.288
   13    HG3  GLN   2           1HG      GLN   2  23.239   1.987   1.983
   14   HE21  GLN   2          1HE2      GLN   2  24.957   2.835   0.783
   15   HE22  GLN   2          2HE2      GLN   2  25.068   4.446   0.259
   16    H    GLN   3           H        GLN   3  19.495   3.025   0.258
   17    HA   GLN   3           HA       GLN   3  17.068   1.378   0.128
   18    HB2  GLN   3           2HB      GLN   3  17.138   2.724   2.347
   19    HB3  GLN   3           1HB      GLN   3  16.848   4.139   1.333
   20    HG2  GLN   3           2HG      GLN   3  14.733   3.403   0.672
   21    HG3  GLN   3           1HG      GLN   3  15.104   1.714   1.020
   22   HE21  GLN   3          1HE2      GLN   3  15.808   1.520   3.573
   23   HE22  GLN   3          2HE2      GLN   3  14.694   2.244   4.630
   24    H    ARG   4           H        ARG   4  15.333   2.704  -1.146
   25    HA   ARG   4           HA       ARG   4  16.736   4.416  -3.174
   26    HB2  ARG   4           2HB      ARG   4  15.905   1.976  -3.672
   27    HB3  ARG   4           1HB      ARG   4  14.309   2.725  -3.732
   28    HG2  ARG   4           2HG      ARG   4  14.933   2.964  -5.946
   29    HG3  ARG   4           1HG      ARG   4  15.574   4.472  -5.290
   30    HD2  ARG   4           2HD      ARG   4  17.760   3.790  -5.505
   31    HD3  ARG   4           1HD      ARG   4  17.370   2.097  -5.139
   32    HE   ARG   4           HE       ARG   4  16.181   2.979  -7.642
   33   HH11  ARG   4          1HH1      ARG   4  19.268   3.490  -7.532
   34   HH12  ARG   4          2HH1      ARG   4  19.827   2.063  -8.340
   35   HH21  ARG   4          1HH2      ARG   4  16.795   0.403  -8.075
   36   HH22  ARG   4          2HH2      ARG   4  18.427   0.315  -8.645
   37    H    LYS   5           H        LYS   5  15.853   6.438  -3.404
   38    HA   LYS   5           HA       LYS   5  14.313   8.222  -3.228
   39    HB2  LYS   5           2HB      LYS   5  12.275   5.986  -3.092
   40    HB3  LYS   5           1HB      LYS   5  12.046   7.610  -3.739
   41    HG2  LYS   5           2HG      LYS   5  13.907   7.031  -5.412
   42    HG3  LYS   5           1HG      LYS   5  13.690   5.357  -4.899
   43    HD2  LYS   5           2HD      LYS   5  11.131   5.907  -5.349
   44    HD3  LYS   5           1HD      LYS   5  11.819   7.132  -6.417
   45    HE2  LYS   5           2HE      LYS   5  13.267   5.258  -7.407
   46    HE3  LYS   5           1HE      LYS   5  12.202   4.129  -6.546
   47    HZ1  LYS   5           3HZ      LYS   5  11.344   6.236  -8.459
   48    HZ2  LYS   5           1HZ      LYS   5  10.293   5.245  -7.573
   49    HZ3  LYS   5           2HZ      LYS   5  11.320   4.561  -8.740
   50    H    VAL   6           H        VAL   6  12.718   9.190  -1.669
   51    HA   VAL   6           HA       VAL   6  13.454   8.729   1.062
   52    HB   VAL   6           HB       VAL   6  11.456  10.279   1.422
   53   HG11  VAL   6          1HG1      VAL   6  13.116  11.384  -0.810
   54   HG12  VAL   6          2HG1      VAL   6  13.944  10.852   0.655
   55   HG13  VAL   6          3HG1      VAL   6  12.707  12.106   0.746
   56   HG21  VAL   6          3HG2      VAL   6  10.497   9.238  -0.864
   57   HG22  VAL   6          1HG2      VAL   6  11.344  10.631  -1.538
   58   HG23  VAL   6          2HG2      VAL   6  10.080  10.866  -0.331
   59    H    ILE   7           H        ILE   7  12.121   7.882   2.786
   60    HA   ILE   7           HA       ILE   7  11.049   5.420   2.649
   61    HB   ILE   7           HB       ILE   7  10.873   7.749   4.358
   62   HG12  ILE   7          2HG1      ILE   7  12.082   5.488   4.637
   63   HG13  ILE   7          1HG1      ILE   7  11.290   6.161   6.062
   64   HG21  ILE   7          1HG2      ILE   7   8.528   7.798   4.265
   65   HG22  ILE   7          2HG2      ILE   7   8.844   6.761   5.657
   66   HG23  ILE   7          3HG2      ILE   7   8.402   6.046   4.106
   67   HD11  ILE   7          3HD1      ILE   7   9.323   4.736   5.655
   68   HD12  ILE   7          1HD1      ILE   7  10.779   3.753   5.805
   69   HD13  ILE   7          2HD1      ILE   7  10.092   4.074   4.212
   70    H    ARG   8           H        ARG   8   9.560   4.565   1.252
   71    HA   ARG   8           HA       ARG   8   7.435   6.233   0.060
   72    HB2  ARG   8           2HB      ARG   8   8.735   4.601  -1.251
   73    HB3  ARG   8           1HB      ARG   8   8.194   3.302  -0.187
   74    HG2  ARG   8           2HG      ARG   8   5.994   3.389  -0.976
   75    HG3  ARG   8           1HG      ARG   8   6.168   5.044  -1.565
   76    HD2  ARG   8           2HD      ARG   8   7.703   4.246  -3.346
   77    HD3  ARG   8           1HD      ARG   8   7.480   2.580  -2.772
   78    HE   ARG   8           HE       ARG   8   4.912   3.270  -3.103
   79   HH11  ARG   8          1HH2      ARG   8   7.163   2.328  -5.256
   80   HH12  ARG   8          2HH2      ARG   8   6.503   3.131  -6.641
   81   HH21  ARG   8          1HH1      ARG   8   4.259   5.030  -4.803
   82   HH22  ARG   8          2HH1      ARG   8   4.860   4.661  -6.385
   83    H    CYS   9           H        CYS   9   5.199   5.930   0.472
   84    HA   CYS   9           HA       CYS   9   4.512   4.802   3.082
   85    HB2  CYS   9           2HB      CYS   9   3.432   6.813   2.432
   86    HB3  CYS   9           1HB      CYS   9   3.041   6.187   0.832
   87    H    TRP  10           H        TRP  10   3.313   2.938   3.461
   88    HA   TRP  10           HA       TRP  10   3.299   0.868   1.351
   89    HB2  TRP  10           2HB      TRP  10   3.636   1.094   4.112
   90    HB3  TRP  10           1HB      TRP  10   2.125   0.226   3.918
   91    HD1  TRP  10           HD       TRP  10   4.678  -0.376   1.213
   92    HE1  TRP  10           1HE      TRP  10   5.675  -2.736   1.548
   93    HE3  TRP  10           3HE      TRP  10   2.739  -1.530   5.777
   94    HZ2  TRP  10           2HZ      TRP  10   5.678  -4.814   3.523
   95    HZ3  TRP  10           3HZ      TRP  10   3.254  -3.668   6.872
   96    HH2  TRP  10           HH       TRP  10   4.712  -5.300   5.757
   97    H    ASN  11           H        ASN  11   0.887   1.458   3.890
   98    HA   ASN  11           HA       ASN  11  -1.306   0.357   2.556
   99    HB2  ASN  11           2HB      ASN  11  -0.695   1.718   4.950
  100    HB3  ASN  11           1HB      ASN  11  -2.085   2.551   4.254
  101   HD21  ASN  11          1HD2      ASN  11  -4.104   1.443   4.232
  102   HD22  ASN  11          2HD2      ASN  11  -4.320  -0.106   4.891
  103    H    CYS  12           H        CYS  12   0.251   3.332   1.810
  104    HA   CYS  12           HA       CYS  12  -2.108   4.056   0.117
  105    HB2  CYS  12           2HB      CYS  12  -2.070   6.247   0.898
  106    HB3  CYS  12           1HB      CYS  12  -1.653   5.328   2.339
  107    H    GLY  13           H        GLY  13   1.033   3.101   0.043
  108    HA2  GLY  13           2HA      GLY  13   2.827   3.434  -1.462
  109    HA3  GLY  13           1HA      GLY  13   1.525   3.459  -2.649
  110    H    LYS  14           H        LYS  14   3.643   5.450  -0.693
  111    HA   LYS  14           HA       LYS  14   3.734   7.589  -2.585
  112    HB2  LYS  14           2HB      LYS  14   1.310   7.456  -1.283
  113    HB3  LYS  14           1HB      LYS  14   2.189   8.629  -0.302
  114    HG2  LYS  14           2HG      LYS  14   1.754   8.756  -3.302
  115    HG3  LYS  14           1HG      LYS  14   1.017   9.805  -2.091
  116    HD2  LYS  14           2HD      LYS  14   3.951   9.701  -1.924
  117    HD3  LYS  14           1HD      LYS  14   3.353  10.360  -3.444
  118    HE2  LYS  14           2HE      LYS  14   2.546  12.250  -2.441
  119    HE3  LYS  14           1HE      LYS  14   1.957  11.355  -1.026
  120    HZ1  LYS  14           3HZ      LYS  14   3.772  12.417  -0.136
  121    HZ2  LYS  14           1HZ      LYS  14   4.656  12.377  -1.582
  122    HZ3  LYS  14           2HZ      LYS  14   4.492  10.967  -0.649
  123    H    GLU  15           H        GLU  15   5.709   8.436  -2.114
  124    HA   GLU  15           HA       GLU  15   7.264   8.046   0.175
  125    HB2  GLU  15           2HB      GLU  15   7.082  10.229  -1.901
  126    HB3  GLU  15           1HB      GLU  15   8.328  10.267  -0.652
  127    HG2  GLU  15           2HG      GLU  15   9.122   8.051  -1.347
  128    HG3  GLU  15           1HG      GLU  15   7.850   7.962  -2.565
  129    H    GLY  16           H        GLY  16   7.937   9.806   1.773
  130    HA2  GLY  16           2HA      GLY  16   7.245  11.914   2.909
  131    HA3  GLY  16           1HA      GLY  16   5.573  11.438   2.606
  132    H    HIS  17           H        HIS  17   5.987   8.631   3.312
  133    HA   HIS  17           HA       HIS  17   6.960   8.595   6.082
  134    HB2  HIS  17           2HB      HIS  17   4.625   8.034   6.923
  135    HB3  HIS  17           1HB      HIS  17   4.850   9.706   6.412
  136    HD1  HIS  17           1HD      HIS  17   4.182  10.085   3.727
  137    HD2  HIS  17           2HD      HIS  17   2.447   6.859   5.718
  138    HE1  HIS  17           1HE      HIS  17   2.159   9.409   2.364
  139    H    SER  18           H        SER  18   6.118   6.344   7.081
  140    HA   SER  18           HA       SER  18   6.675   4.292   4.986
  141    HB2  SER  18           2HB      SER  18   7.691   3.130   6.703
  142    HB3  SER  18           1HB      SER  18   7.803   4.749   7.390
  143    HG   SER  18           HG       SER  18   6.794   3.709   8.963
  144    H    ALA  19           H        ALA  19   5.543   2.143   6.603
  145    HA   ALA  19           HA       ALA  19   2.736   2.414   5.757
  146    HB1  ALA  19           3HB      ALA  19   4.551   0.365   5.824
  147    HB2  ALA  19           1HB      ALA  19   2.808   0.145   5.722
  148    HB3  ALA  19           2HB      ALA  19   3.615   0.034   7.283
  149    H    ARG  20           H        ARG  20   4.566   2.857   8.639
  150    HA   ARG  20           HA       ARG  20   2.593   2.188  10.617
  151    HB2  ARG  20           2HB      ARG  20   4.974   2.550  11.089
  152    HB3  ARG  20           1HB      ARG  20   4.846   4.226  10.554
  153    HG2  ARG  20           2HG      ARG  20   3.150   4.612  12.362
  154    HG3  ARG  20           1HG      ARG  20   3.465   2.977  12.946
  155    HD2  ARG  20           2HD      ARG  20   4.912   4.302  14.271
  156    HD3  ARG  20           1HD      ARG  20   5.978   3.747  12.965
  157    HE   ARG  20           HE       ARG  20   4.636   6.151  12.152
  158   HH11  ARG  20          1HH1      ARG  20   7.644   4.972  12.723
  159   HH12  ARG  20          2HH1      ARG  20   8.320   6.420  13.391
  160   HH21  ARG  20          1HH2      ARG  20   5.261   8.032  13.675
  161   HH22  ARG  20          2HH2      ARG  20   6.969   8.153  13.928
  162    H    GLN  21           H        GLN  21   2.694   4.637   8.250
  163    HA   GLN  21           HA       GLN  21   0.713   6.308   9.757
  164    HB2  GLN  21           2HB      GLN  21   2.782   6.891   7.627
  165    HB3  GLN  21           1HB      GLN  21   1.513   8.046   8.038
  166    HG2  GLN  21           2HG      GLN  21   2.260   7.949  10.422
  167    HG3  GLN  21           1HG      GLN  21   3.595   6.907   9.924
  168   HE21  GLN  21          1HE2      GLN  21   2.171   9.931   8.545
  169   HE22  GLN  21          2HE2      GLN  21   3.663  10.751   8.436
  170    H    CYS  22           H        CYS  22   1.250   4.277   7.023
  171    HA   CYS  22           HA       CYS  22  -1.011   5.348   5.451
  172    HB2  CYS  22           2HB      CYS  22   0.753   2.897   5.112
  173    HB3  CYS  22           1HB      CYS  22  -0.311   3.585   3.882
  174    H    ARG  23           H        ARG  23  -2.992   4.516   5.401
  175    HA   ARG  23           HA       ARG  23  -3.628   1.850   6.441
  176    HB2  ARG  23           2HB      ARG  23  -3.520   2.867   8.538
  177    HB3  ARG  23           1HB      ARG  23  -4.016   4.437   7.913
  178    HG2  ARG  23           2HG      ARG  23  -5.765   3.361   9.305
  179    HG3  ARG  23           1HG      ARG  23  -6.302   3.653   7.654
  180    HD2  ARG  23           2HD      ARG  23  -6.837   1.442   7.549
  181    HD3  ARG  23           1HD      ARG  23  -5.096   1.098   7.604
  182    HE   ARG  23           HE       ARG  23  -5.468   0.348   9.805
  183   HH11  ARG  23          1HH1      ARG  23  -8.502   0.810   9.239
  184   HH12  ARG  23          2HH1      ARG  23  -8.928   1.727  10.645
  185   HH21  ARG  23          1HH2      ARG  23  -5.644   2.424  11.510
  186   HH22  ARG  23          2HH2      ARG  23  -7.309   2.640  11.932
  187    H    ALA  24           H        ALA  24  -4.033   3.959   4.106
  188    HA   ALA  24           HA       ALA  24  -6.622   4.777   3.680
  189    HB1  ALA  24           3HB      ALA  24  -4.800   3.222   1.808
  190    HB2  ALA  24           1HB      ALA  24  -4.754   4.963   2.086
  191    HB3  ALA  24           2HB      ALA  24  -6.147   4.233   1.287
  192    HA   PRO  25           HA       PRO  25  -9.264   1.288   3.917
  193    HB2  PRO  25           2HB      PRO  25 -11.104   1.846   1.960
  194    HB3  PRO  25           1HB      PRO  25 -11.057   2.694   3.521
  195    HG2  PRO  25           2HG      PRO  25  -9.990   3.551   0.871
  196    HG3  PRO  25           1HG      PRO  25 -10.841   4.496   2.103
  197    HD2  PRO  25           2HD      PRO  25  -8.156   4.604   1.789
  198    HD3  PRO  25           1HD      PRO  25  -8.943   4.807   3.371
  199    H    ARG  26           H        ARG  26  -8.312   2.198   0.621
  200    HA   ARG  26           HA       ARG  26  -8.796   0.052  -0.931
  201    HB2  ARG  26           2HB      ARG  26  -7.121   2.242  -0.871
  202    HB3  ARG  26           1HB      ARG  26  -5.988   0.895  -0.988
  203    HG2  ARG  26           2HG      ARG  26  -8.225   0.454  -2.743
  204    HG3  ARG  26           1HG      ARG  26  -7.501   2.032  -3.066
  205    HD2  ARG  26           2HD      ARG  26  -5.342   1.081  -3.462
  206    HD3  ARG  26           1HD      ARG  26  -5.829  -0.480  -2.770
  207    HE   ARG  26           HE       ARG  26  -7.279  -0.830  -4.719
  208   HH11  ARG  26          1HH1      ARG  26  -6.929   2.382  -5.008
  209   HH12  ARG  26          2HH1      ARG  26  -6.292   2.401  -6.618
  210   HH21  ARG  26          1HH2      ARG  26  -5.714  -1.015  -6.716
  211   HH22  ARG  26          2HH2      ARG  26  -5.605   0.479  -7.586
  212    H    ARG  27           H        ARG  27  -5.767   0.275   0.914
  213    HA   ARG  27           HA       ARG  27  -4.997  -2.405   0.576
  214    HB2  ARG  27           2HB      ARG  27  -4.261  -0.445   2.752
  215    HB3  ARG  27           1HB      ARG  27  -3.297  -1.823   2.221
  216    HG2  ARG  27           2HG      ARG  27  -4.076   0.527   0.466
  217    HG3  ARG  27           1HG      ARG  27  -2.507   0.308   1.223
  218    HD2  ARG  27           2HD      ARG  27  -3.434  -2.032  -0.328
  219    HD3  ARG  27           1HD      ARG  27  -3.091  -0.582  -1.291
  220    HE   ARG  27           HE       ARG  27  -1.121  -1.616   0.713
  221   HH11  ARG  27          1HH1      ARG  27  -0.747   0.966  -0.883
  222   HH12  ARG  27          2HH1      ARG  27   0.311   0.424  -2.142
  223   HH21  ARG  27          1HH2      ARG  27  -0.294  -2.941  -1.570
  224   HH22  ARG  27          2HH2      ARG  27   0.568  -1.786  -2.530
  225    H    GLN  28           H        GLN  28  -4.401  -3.605   2.791
  226    HA   GLN  28           HA       GLN  28  -6.823  -3.711   4.546
  227    HB2  GLN  28           2HB      GLN  28  -5.586  -5.846   2.818
  228    HB3  GLN  28           1HB      GLN  28  -6.456  -6.298   4.285
  229    HG2  GLN  28           2HG      GLN  28  -8.458  -5.895   3.325
  230    HG3  GLN  28           1HG      GLN  28  -7.927  -4.321   2.730
  231   HE21  GLN  28          1HE2      GLN  28  -6.022  -4.780   0.891
  232   HE22  GLN  28          2HE2      GLN  28  -6.547  -5.846  -0.333
  233    H    GLY  29           H        GLY  29  -5.340  -2.692   6.116
  234    HA2  GLY  29           2HA      GLY  29  -3.727  -2.723   7.824
  235    HA3  GLY  29           1HA      GLY  29  -4.222  -4.405   8.007
  236    H    CYS  30           H        CYS  30  -2.719  -5.942   7.570
  237    HA   CYS  30           HA       CYS  30  -0.003  -5.486   7.192
  238    HB2  CYS  30           2HB      CYS  30  -1.670  -7.627   7.472
  239    HB3  CYS  30           1HB      CYS  30  -1.108  -7.856   5.817
  240    H    TRP  31           H        TRP  31   1.210  -6.414   5.146
  241    HA   TRP  31           HA       TRP  31   0.077  -5.068   2.715
  242    HB2  TRP  31           2HB      TRP  31   2.419  -4.601   4.214
  243    HB3  TRP  31           1HB      TRP  31   2.937  -5.342   2.695
  244    HD1  TRP  31           HD       TRP  31   0.252  -2.738   3.665
  245    HE1  TRP  31           1HE      TRP  31   0.351  -0.815   1.953
  246    HE3  TRP  31           3HE      TRP  31   4.016  -4.416   0.718
  247    HZ2  TRP  31           2HZ      TRP  31   1.868  -0.087  -0.379
  248    HZ3  TRP  31           3HZ      TRP  31   4.781  -3.115  -1.253
  249    HH2  TRP  31           HH       TRP  31   3.707  -0.948  -1.803
  250    H    LYS  32           H        LYS  32   2.246  -7.691   3.814
  251    HA   LYS  32           HA       LYS  32   1.955  -9.001   1.158
  252    HB2  LYS  32           2HB      LYS  32   3.800 -10.407   2.027
  253    HB3  LYS  32           1HB      LYS  32   4.184  -8.692   2.184
  254    HG2  LYS  32           2HG      LYS  32   2.796  -9.385   4.540
  255    HG3  LYS  32           1HG      LYS  32   3.949 -10.690   4.258
  256    HD2  LYS  32           2HD      LYS  32   5.547  -8.588   3.721
  257    HD3  LYS  32           1HD      LYS  32   4.448  -7.821   4.869
  258    HE2  LYS  32           2HE      LYS  32   5.601  -8.799   6.553
  259    HE3  LYS  32           1HE      LYS  32   5.097 -10.385   5.932
  260    HZ1  LYS  32           3HZ      LYS  32   7.254  -8.905   4.585
  261    HZ2  LYS  32           1HZ      LYS  32   6.967 -10.577   4.626
  262    HZ3  LYS  32           2HZ      LYS  32   7.608  -9.793   5.990
  263    H    CYS  33           H        CYS  33   0.051  -8.890   3.749
  264    HA   CYS  33           HA       CYS  33  -0.500 -11.843   3.769
  265    HB2  CYS  33           2HB      CYS  33  -1.036  -9.765   5.914
  266    HB3  CYS  33           1HB      CYS  33  -1.212 -11.512   6.076
  267    H    GLY  34           H        GLY  34  -2.006  -8.606   4.055
  268    HA2  GLY  34           2HA      GLY  34  -4.033  -7.887   3.039
  269    HA3  GLY  34           1HA      GLY  34  -4.296  -9.534   2.462
  270    H    LYS  35           H        LYS  35  -4.552  -7.438   5.307
  271    HA   LYS  35           HA       LYS  35  -6.704  -9.251   6.317
  272    HB2  LYS  35           2HB      LYS  35  -4.193  -8.283   7.677
  273    HB3  LYS  35           1HB      LYS  35  -5.616  -8.704   8.631
  274    HG2  LYS  35           2HG      LYS  35  -5.259 -10.778   6.723
  275    HG3  LYS  35           1HG      LYS  35  -3.679 -10.463   7.445
  276    HD2  LYS  35           2HD      LYS  35  -4.314 -11.560   9.301
  277    HD3  LYS  35           1HD      LYS  35  -5.612 -10.389   9.541
  278    HE2  LYS  35           2HE      LYS  35  -5.975 -12.614   7.540
  279    HE3  LYS  35           1HE      LYS  35  -6.252 -12.918   9.266
  280    HZ1  LYS  35           3HZ      LYS  35  -8.049 -11.600   9.299
  281    HZ2  LYS  35           1HZ      LYS  35  -8.063 -11.795   7.614
  282    HZ3  LYS  35           2HZ      LYS  35  -7.339 -10.420   8.302
  283    H    THR  36           H        THR  36  -5.447  -6.659   8.272
  284    HA   THR  36           HA       THR  36  -6.869  -4.418   7.325
  285    HB   THR  36           HB       THR  36  -8.950  -5.441   7.436
  286    HG1  THR  36           1HG      THR  36  -9.275  -3.775   8.769
  287   HG21  THR  36          3HG2      THR  36  -8.857  -7.573   8.194
  288   HG22  THR  36          1HG2      THR  36  -9.269  -6.883   9.765
  289   HG23  THR  36          2HG2      THR  36  -7.583  -7.201   9.353
  290    H    GLY  37           H        GLY  37  -7.227  -5.836  10.572
  291    HA2  GLY  37           2HA      GLY  37  -6.102  -3.443  11.795
  292    HA3  GLY  37           1HA      GLY  37  -6.620  -4.895  12.653
  293    H    HIS  38           H        HIS  38  -5.110  -6.890  11.930
  294    HA   HIS  38           HA       HIS  38  -2.597  -6.587  13.106
  295    HB2  HIS  38           2HB      HIS  38  -2.987  -8.804  12.767
  296    HB3  HIS  38           1HB      HIS  38  -4.034  -8.483  11.390
  297    HD1  HIS  38           1HD      HIS  38  -3.146  -9.637   9.380
  298    HD2  HIS  38           2HD      HIS  38  -0.059  -8.157  11.758
  299    HE1  HIS  38           1HE      HIS  38  -0.989 -10.189   8.177
  300    H    VAL  39           H        VAL  39  -0.446  -6.340  12.181
  301    HA   VAL  39           HA       VAL  39  -0.302  -5.280   9.401
  302    HB   VAL  39           HB       VAL  39  -0.684  -3.322  10.684
  303   HG11  VAL  39          1HG1      VAL  39  -0.309  -4.464  12.894
  304   HG12  VAL  39          2HG1      VAL  39   0.386  -2.845  12.805
  305   HG13  VAL  39          3HG1      VAL  39   1.425  -4.260  12.642
  306   HG21  VAL  39          3HG2      VAL  39   1.283  -3.205   9.154
  307   HG22  VAL  39          1HG2      VAL  39   2.323  -3.590  10.521
  308   HG23  VAL  39          2HG2      VAL  39   1.400  -2.090  10.514
  309    H    MET  40           H        MET  40   2.107  -4.860   8.874
  310    HA   MET  40           HA       MET  40   3.660  -7.150   8.957
  311    HB2  MET  40           2HB      MET  40   4.140  -5.095   7.668
  312    HB3  MET  40           1HB      MET  40   4.600  -4.267   9.156
  313    HG2  MET  40           2HG      MET  40   5.944  -6.856   8.460
  314    HG3  MET  40           1HG      MET  40   6.448  -5.384   7.632
  315    HE1  MET  40           3HE      MET  40   9.352  -5.206   9.940
  316    HE2  MET  40           1HE      MET  40   8.660  -4.749   8.377
  317    HE3  MET  40           2HE      MET  40   8.735  -6.445   8.848
  318    H    ALA  41           H        ALA  41   3.193  -4.819  11.528
  319    HA   ALA  41           HA       ALA  41   5.351  -5.387  13.267
  320    HB1  ALA  41           3HB      ALA  41   2.530  -5.019  14.238
  321    HB2  ALA  41           1HB      ALA  41   3.278  -3.730  13.295
  322    HB3  ALA  41           2HB      ALA  41   4.007  -4.247  14.815
  323    H    LYS  42           H        LYS  42   2.189  -6.924  12.923
  324    HA   LYS  42           HA       LYS  42   3.131  -9.213  14.609
  325    HB2  LYS  42           2HB      LYS  42   0.805  -7.441  14.510
  326    HB3  LYS  42           1HB      LYS  42   0.348  -9.155  14.560
  327    HG2  LYS  42           2HG      LYS  42   2.534  -8.522  16.395
  328    HG3  LYS  42           1HG      LYS  42   1.080  -7.586  16.741
  329    HD2  LYS  42           2HD      LYS  42   0.065 -10.109  16.245
  330    HD3  LYS  42           1HD      LYS  42   1.574 -10.458  17.090
  331    HE2  LYS  42           2HE      LYS  42  -0.068 -10.193  18.817
  332    HE3  LYS  42           1HE      LYS  42   0.822  -8.656  18.795
  333    HZ1  LYS  42           3HZ      LYS  42  -0.835  -7.626  17.541
  334    HZ2  LYS  42           1HZ      LYS  42  -1.711  -8.531  18.676
  335    HZ3  LYS  42           2HZ      LYS  42  -1.549  -9.099  17.083
  336    H    CYS  43           H        CYS  43   3.486  -8.901  11.695
  337    HA   CYS  43           HA       CYS  43   1.486 -10.672  10.453
  338    HB2  CYS  43           2HB      CYS  43   2.373  -8.627   9.376
  339    HB3  CYS  43           1HB      CYS  43   3.986  -9.341   9.384
  340    HA   PRO  44           HA       PRO  44   5.525 -13.306  10.281
  341    HB2  PRO  44           2HB      PRO  44   6.853 -13.496  12.667
  342    HB3  PRO  44           1HB      PRO  44   7.285 -12.327  11.403
  343    HG2  PRO  44           2HG      PRO  44   5.749 -11.922  13.910
  344    HG3  PRO  44           1HG      PRO  44   6.906 -10.850  13.107
  345    HD2  PRO  44           2HD      PRO  44   4.199 -10.549  12.983
  346    HD3  PRO  44           1HD      PRO  44   5.315  -9.951  11.738
  347    H    GLU  45           H        GLU  45   3.625 -14.701  10.264
  348    HA   GLU  45           HA       GLU  45   2.915 -15.981  12.866
  349    HB2  GLU  45           2HB      GLU  45   1.636 -16.278  10.133
  350    HB3  GLU  45           1HB      GLU  45   0.918 -16.662  11.697
  351    HG2  GLU  45           2HG      GLU  45   1.154 -14.218  12.303
  352    HG3  GLU  45           1HG      GLU  45   1.619 -13.916  10.629
  353    H    ARG  46           H        ARG  46   5.460 -16.533  11.452
  354    HA   ARG  46           HA       ARG  46   6.772 -18.428  10.937
  355    HB2  ARG  46           2HB      ARG  46   4.420 -19.325  12.466
  356    HB3  ARG  46           1HB      ARG  46   5.161 -20.594  11.492
  357    HG2  ARG  46           2HG      ARG  46   6.224 -20.567  13.680
  358    HG3  ARG  46           1HG      ARG  46   7.379 -19.988  12.479
  359    HD2  ARG  46           2HD      ARG  46   5.884 -17.728  13.399
  360    HD3  ARG  46           1HD      ARG  46   6.471 -18.620  14.817
  361    HE   ARG  46           HE       ARG  46   8.618 -18.593  13.021
  362   HH11  ARG  46          1HH2      ARG  46   8.211 -17.190  15.803
  363   HH12  ARG  46          2HH2      ARG  46   8.737 -15.591  15.396
  364   HH21  ARG  46          1HH1      ARG  46   8.618 -16.138  11.973
  365   HH22  ARG  46          2HH1      ARG  46   8.968 -14.996  13.227
  366    H    GLN  47           H        GLN  47   7.167 -19.242   8.913
  367    HA   GLN  47           HA       GLN  47   4.848 -19.568   7.055
  368    HB2  GLN  47           2HB      GLN  47   7.829 -19.173   6.643
  369    HB3  GLN  47           1HB      GLN  47   6.660 -19.348   5.333
  370    HG2  GLN  47           2HG      GLN  47   5.718 -17.367   7.202
  371    HG3  GLN  47           1HG      GLN  47   7.362 -16.970   6.699
  372   HE21  GLN  47          1HE2      GLN  47   4.351 -16.139   5.877
  373   HE22  GLN  47          2HE2      GLN  47   4.491 -16.019   4.190
  374    H    ALA  48           H        ALA  48   4.370 -21.586   6.267
  375    HA   ALA  48           HA       ALA  48   6.357 -23.703   6.016
  376    HB1  ALA  48           3HB      ALA  48   4.758 -23.345   8.454
  377    HB2  ALA  48           1HB      ALA  48   6.197 -24.330   8.197
  378    HB3  ALA  48           2HB      ALA  48   4.608 -24.959   7.762
  379    H    GLY  49           H        GLY  49   2.873 -23.761   6.826
  380    HA2  GLY  49           2HA      GLY  49   2.395 -25.235   4.288
  381    HA3  GLY  49           1HA      GLY  49   1.288 -25.177   5.661
  Start of MODEL    5
    1    H1   ALA   1           1HT      ALA   1   3.653  24.102  -6.378
    2    H2   ALA   1           2HT      ALA   1   4.831  24.757  -5.343
    3    H3   ALA   1           3HT      ALA   1   3.181  24.901  -4.959
    4    HA   ALA   1           HA       ALA   1   3.030  22.465  -4.732
    5    HB1  ALA   1           3HB      ALA   1   4.668  21.340  -5.808
    6    HB2  ALA   1           1HB      ALA   1   5.792  21.878  -4.560
    7    HB3  ALA   1           2HB      ALA   1   5.588  22.828  -6.033
    8    H    GLN   2           H        GLN   2   3.825  21.392  -2.658
    9    HA   GLN   2           HA       GLN   2   5.403  22.923  -0.761
   10    HB2  GLN   2           2HB      GLN   2   3.607  23.742   0.611
   11    HB3  GLN   2           1HB      GLN   2   3.206  24.198  -1.045
   12    HG2  GLN   2           2HG      GLN   2   1.694  22.317  -1.260
   13    HG3  GLN   2           1HG      GLN   2   2.187  21.688   0.311
   14   HE21  GLN   2          1HE2      GLN   2   2.164  24.966   0.801
   15   HE22  GLN   2          2HE2      GLN   2   0.562  25.166   1.318
   16    H    GLN   3           H        GLN   3   4.821  21.956   1.587
   17    HA   GLN   3           HA       GLN   3   4.650  20.032   2.957
   18    HB2  GLN   3           2HB      GLN   3   2.700  19.854   0.921
   19    HB3  GLN   3           1HB      GLN   3   3.459  18.263   0.998
   20    HG2  GLN   3           2HG      GLN   3   2.960  18.030   3.323
   21    HG3  GLN   3           1HG      GLN   3   2.513  19.730   3.467
   22   HE21  GLN   3          1HE2      GLN   3   1.555  17.403   0.902
   23   HE22  GLN   3          2HE2      GLN   3  -0.110  17.521   1.204
   24    H    ARG   4           H        ARG   4   7.002  19.785   2.789
   25    HA   ARG   4           HA       ARG   4   8.163  18.152   0.656
   26    HB2  ARG   4           2HB      ARG   4  10.211  18.502   1.965
   27    HB3  ARG   4           1HB      ARG   4   9.313  20.017   1.862
   28    HG2  ARG   4           2HG      ARG   4   8.215  19.239   4.098
   29    HG3  ARG   4           1HG      ARG   4   9.600  18.153   4.208
   30    HD2  ARG   4           2HD      ARG   4  10.389  20.880   3.469
   31    HD3  ARG   4           1HD      ARG   4   9.584  20.800   5.050
   32    HE   ARG   4           HE       ARG   4  11.232  19.074   5.714
   33   HH11  ARG   4          1HH1      ARG   4  12.191  18.096   3.117
   34   HH12  ARG   4          2HH1      ARG   4  13.701  18.918   2.916
   35   HH21  ARG   4          1HH2      ARG   4  13.021  21.318   5.326
   36   HH22  ARG   4          2HH2      ARG   4  14.173  20.740   4.167
   37    H    LYS   5           H        LYS   5   8.875  15.976   0.877
   38    HA   LYS   5           HA       LYS   5   7.394  14.052   2.143
   39    HB2  LYS   5           2HB      LYS   5   9.605  12.740   2.207
   40    HB3  LYS   5           1HB      LYS   5   9.148  13.431   0.651
   41    HG2  LYS   5           2HG      LYS   5  10.601  15.395   1.119
   42    HG3  LYS   5           1HG      LYS   5  11.092  14.648   2.638
   43    HD2  LYS   5           2HD      LYS   5  11.440  12.676   0.640
   44    HD3  LYS   5           1HD      LYS   5  12.111  14.168  -0.016
   45    HE2  LYS   5           2HE      LYS   5  13.780  14.278   1.576
   46    HE3  LYS   5           1HE      LYS   5  12.779  13.508   2.824
   47    HZ1  LYS   5           3HZ      LYS   5  12.935  11.422   1.645
   48    HZ2  LYS   5           1HZ      LYS   5  14.495  11.996   1.977
   49    HZ3  LYS   5           2HZ      LYS   5  13.853  12.143   0.411
   50    H    VAL   6           H        VAL   6   6.947  13.514   4.228
   51    HA   VAL   6           HA       VAL   6   8.931  14.148   6.366
   52    HB   VAL   6           HB       VAL   6   6.135  15.182   5.983
   53   HG11  VAL   6          1HG1      VAL   6   5.599  14.446   8.078
   54   HG12  VAL   6          2HG1      VAL   6   6.600  15.803   8.596
   55   HG13  VAL   6          3HG1      VAL   6   7.286  14.180   8.523
   56   HG21  VAL   6          3HG2      VAL   6   8.856  16.214   6.638
   57   HG22  VAL   6          1HG2      VAL   6   7.479  17.083   7.315
   58   HG23  VAL   6          2HG2      VAL   6   7.627  16.889   5.568
   59    H    ILE   7           H        ILE   7   9.307  12.000   6.949
   60    HA   ILE   7           HA       ILE   7   8.851   9.899   7.912
   61    HB   ILE   7           HB       ILE   7   7.115  11.851   8.999
   62   HG12  ILE   7          2HG1      ILE   7   8.790  10.271  10.091
   63   HG13  ILE   7          1HG1      ILE   7   7.281  10.512  10.973
   64   HG21  ILE   7          1HG2      ILE   7   5.069  10.655   9.502
   65   HG22  ILE   7          2HG2      ILE   7   5.647   9.220   8.656
   66   HG23  ILE   7          3HG2      ILE   7   5.268  10.684   7.749
   67   HD11  ILE   7          3HD1      ILE   7   6.846   8.309  10.870
   68   HD12  ILE   7          1HD1      ILE   7   8.380   8.058  10.037
   69   HD13  ILE   7          2HD1      ILE   7   6.912   8.366   9.109
   70    H    ARG   8           H        ARG   8   8.126   7.963   7.033
   71    HA   ARG   8           HA       ARG   8   6.195   8.172   4.753
   72    HB2  ARG   8           2HB      ARG   8   8.322   7.426   4.013
   73    HB3  ARG   8           1HB      ARG   8   8.546   6.401   5.430
   74    HG2  ARG   8           2HG      ARG   8   7.464   4.668   4.464
   75    HG3  ARG   8           1HG      ARG   8   6.138   5.701   3.929
   76    HD2  ARG   8           2HD      ARG   8   7.487   4.633   2.045
   77    HD3  ARG   8           1HD      ARG   8   7.395   6.404   1.971
   78    HE   ARG   8           HE       ARG   8   9.687   6.518   2.603
   79   HH11  ARG   8          1HH1      ARG   8   9.412   4.516   4.879
   80   HH12  ARG   8          2HH1      ARG   8  10.474   3.255   4.350
   81   HH21  ARG   8          1HH2      ARG   8  10.617   4.388   1.075
   82   HH22  ARG   8          2HH2      ARG   8  11.156   3.182   2.195
   83    H    CYS   9           H        CYS   9   4.196   7.703   5.622
   84    HA   CYS   9           HA       CYS   9   3.611   6.069   7.852
   85    HB2  CYS   9           2HB      CYS   9   1.340   6.152   6.957
   86    HB3  CYS   9           1HB      CYS   9   2.130   7.702   6.648
   87    H    TRP  10           H        TRP  10   3.321   3.846   8.092
   88    HA   TRP  10           HA       TRP  10   4.280   2.130   5.909
   89    HB2  TRP  10           2HB      TRP  10   4.670   0.635   7.609
   90    HB3  TRP  10           1HB      TRP  10   4.541   2.085   8.594
   91    HD1  TRP  10           HD       TRP  10   2.210  -0.697   7.255
   92    HE1  TRP  10           1HE      TRP  10   0.453  -1.216   9.059
   93    HE3  TRP  10           3HE      TRP  10   3.500   2.790  10.729
   94    HZ2  TRP  10           2HZ      TRP  10  -0.307  -0.260  11.655
   95    HZ3  TRP  10           3HZ      TRP  10   2.252   2.971  12.864
   96    HH2  TRP  10           HH       TRP  10   0.349   1.451  13.328
   97    H    ASN  11           H        ASN  11   1.217   3.199   7.158
   98    HA   ASN  11           HA       ASN  11  -0.453   1.021   6.452
   99    HB2  ASN  11           2HB      ASN  11  -1.380   2.836   7.675
  100    HB3  ASN  11           1HB      ASN  11  -0.789   4.024   6.512
  101   HD21  ASN  11          1HD2      ASN  11  -3.101   1.267   6.759
  102   HD22  ASN  11          2HD2      ASN  11  -4.176   1.874   5.593
  103    H    CYS  12           H        CYS  12   0.155   3.965   4.493
  104    HA   CYS  12           HA       CYS  12  -0.502   2.395   2.043
  105    HB2  CYS  12           2HB      CYS  12  -1.055   4.522   1.097
  106    HB3  CYS  12           1HB      CYS  12  -1.688   4.540   2.743
  107    H    GLY  13           H        GLY  13   2.150   3.696   3.769
  108    HA2  GLY  13           2HA      GLY  13   4.447   3.647   3.254
  109    HA3  GLY  13           1HA      GLY  13   4.035   2.828   1.751
  110    H    LYS  14           H        LYS  14   4.116   6.057   3.269
  111    HA   LYS  14           HA       LYS  14   5.034   7.187   0.702
  112    HB2  LYS  14           2HB      LYS  14   2.449   7.014   0.799
  113    HB3  LYS  14           1HB      LYS  14   2.547   8.318   1.983
  114    HG2  LYS  14           2HG      LYS  14   4.033   8.601  -0.605
  115    HG3  LYS  14           1HG      LYS  14   2.291   8.881  -0.586
  116    HD2  LYS  14           2HD      LYS  14   2.516  10.590   1.111
  117    HD3  LYS  14           1HD      LYS  14   4.229  10.222   1.318
  118    HE2  LYS  14           2HE      LYS  14   3.471  10.844  -1.468
  119    HE3  LYS  14           1HE      LYS  14   3.286  12.198  -0.336
  120    HZ1  LYS  14           3HZ      LYS  14   5.699  10.522  -0.761
  121    HZ2  LYS  14           1HZ      LYS  14   5.527  11.592   0.545
  122    HZ3  LYS  14           2HZ      LYS  14   5.541  12.191  -1.045
  123    H    GLU  15           H        GLU  15   6.654   8.563   1.282
  124    HA   GLU  15           HA       GLU  15   7.201   9.438   3.940
  125    HB2  GLU  15           2HB      GLU  15   8.304   9.580   1.321
  126    HB3  GLU  15           1HB      GLU  15   8.280  11.221   1.966
  127    HG2  GLU  15           2HG      GLU  15   9.370  10.378   4.048
  128    HG3  GLU  15           1HG      GLU  15   9.484   8.782   3.305
  129    H    GLY  16           H        GLY  16   4.890  10.218   4.414
  130    HA2  GLY  16           2HA      GLY  16   4.793  13.146   3.969
  131    HA3  GLY  16           1HA      GLY  16   3.384  12.207   3.468
  132    H    HIS  17           H        HIS  17   3.426  10.289   5.576
  133    HA   HIS  17           HA       HIS  17   3.337  11.765   8.127
  134    HB2  HIS  17           2HB      HIS  17   0.850  11.137   8.320
  135    HB3  HIS  17           1HB      HIS  17   1.238  12.452   7.211
  136    HD1  HIS  17           1HD      HIS  17   1.611  11.608   4.606
  137    HD2  HIS  17           2HD      HIS  17  -0.566   9.093   7.121
  138    HE1  HIS  17           1HE      HIS  17   0.344  10.015   3.100
  139    H    SER  18           H        SER  18   1.732   9.974   9.548
  140    HA   SER  18           HA       SER  18   3.380   7.489   9.399
  141    HB2  SER  18           2HB      SER  18   1.910   7.403  11.722
  142    HB3  SER  18           1HB      SER  18   3.515   8.121  11.582
  143    HG   SER  18           HG       SER  18   1.642   9.429  12.450
  144    H    ALA  19           H        ALA  19   2.246   5.409   9.730
  145    HA   ALA  19           HA       ALA  19   0.114   4.904   7.979
  146    HB1  ALA  19           3HB      ALA  19   0.811   3.508  10.579
  147    HB2  ALA  19           1HB      ALA  19   1.622   3.239   9.038
  148    HB3  ALA  19           2HB      ALA  19  -0.073   2.790   9.235
  149    H    ARG  20           H        ARG  20  -0.100   5.318  11.536
  150    HA   ARG  20           HA       ARG  20  -2.797   5.076  12.024
  151    HB2  ARG  20           2HB      ARG  20  -1.028   5.724  13.648
  152    HB3  ARG  20           1HB      ARG  20  -0.994   7.342  12.944
  153    HG2  ARG  20           2HG      ARG  20  -3.623   7.188  13.421
  154    HG3  ARG  20           1HG      ARG  20  -3.073   6.066  14.668
  155    HD2  ARG  20           2HD      ARG  20  -1.301   8.053  15.099
  156    HD3  ARG  20           1HD      ARG  20  -2.651   9.011  14.459
  157    HE   ARG  20           HE       ARG  20  -3.999   7.474  16.193
  158   HH11  ARG  20          1HH1      ARG  20  -0.810   7.436  16.969
  159   HH12  ARG  20          2HH1      ARG  20  -0.947   8.282  18.475
  160   HH21  ARG  20          1HH2      ARG  20  -4.239   9.233  17.946
  161   HH22  ARG  20          2HH2      ARG  20  -2.886   9.301  19.026
  162    H    GLN  21           H        GLN  21  -1.214   7.781  10.370
  163    HA   GLN  21           HA       GLN  21  -3.684   9.348  10.126
  164    HB2  GLN  21           2HB      GLN  21  -0.814   9.504   9.247
  165    HB3  GLN  21           1HB      GLN  21  -1.999  10.571   8.493
  166    HG2  GLN  21           2HG      GLN  21  -2.666  10.856  11.114
  167    HG3  GLN  21           1HG      GLN  21  -0.928  10.591  11.248
  168   HE21  GLN  21          1HE2      GLN  21   0.104  12.586  11.336
  169   HE22  GLN  21          2HE2      GLN  21  -0.298  13.937  10.376
  170    H    CYS  22           H        CYS  22  -1.622   7.389   7.973
  171    HA   CYS  22           HA       CYS  22  -3.488   7.717   5.705
  172    HB2  CYS  22           2HB      CYS  22  -0.773   7.337   6.034
  173    HB3  CYS  22           1HB      CYS  22  -1.323   5.736   5.553
  174    H    ARG  23           H        ARG  23  -4.817   6.105   4.927
  175    HA   ARG  23           HA       ARG  23  -4.839   3.486   6.367
  176    HB2  ARG  23           2HB      ARG  23  -6.639   5.504   6.802
  177    HB3  ARG  23           1HB      ARG  23  -7.432   4.622   5.497
  178    HG2  ARG  23           2HG      ARG  23  -6.404   2.697   7.336
  179    HG3  ARG  23           1HG      ARG  23  -7.280   3.914   8.266
  180    HD2  ARG  23           2HD      ARG  23  -8.582   2.956   5.754
  181    HD3  ARG  23           1HD      ARG  23  -8.556   1.840   7.133
  182    HE   ARG  23           HE       ARG  23  -9.488   4.658   7.484
  183   HH11  ARG  23          1HH1      ARG  23 -10.950   1.860   6.628
  184   HH12  ARG  23          2HH1      ARG  23 -11.926   1.680   8.048
  185   HH21  ARG  23          1HH2      ARG  23 -10.288   4.178   9.810
  186   HH22  ARG  23          2HH2      ARG  23 -11.551   2.994   9.849
  187    H    ALA  24           H        ALA  24  -4.207   4.906   3.552
  188    HA   ALA  24           HA       ALA  24  -4.489   4.356   1.259
  189    HB1  ALA  24           3HB      ALA  24  -3.196   2.509   2.577
  190    HB2  ALA  24           1HB      ALA  24  -3.787   2.106   0.965
  191    HB3  ALA  24           2HB      ALA  24  -4.669   1.558   2.392
  192    HA   PRO  25           HA       PRO  25  -8.690   3.161   0.373
  193    HB2  PRO  25           2HB      PRO  25  -9.077   0.531  -0.332
  194    HB3  PRO  25           1HB      PRO  25  -8.387   1.736  -1.438
  195    HG2  PRO  25           2HG      PRO  25  -7.016  -0.342   0.190
  196    HG3  PRO  25           1HG      PRO  25  -6.665   0.220  -1.452
  197    HD2  PRO  25           2HD      PRO  25  -5.243   0.983   0.718
  198    HD3  PRO  25           1HD      PRO  25  -5.429   2.012  -0.717
  199    H    ARG  26           H        ARG  26  -8.527  -0.180   1.419
  200    HA   ARG  26           HA       ARG  26  -9.969   0.544   3.842
  201    HB2  ARG  26           2HB      ARG  26 -10.864  -1.581   3.700
  202    HB3  ARG  26           1HB      ARG  26 -10.388  -1.385   2.017
  203    HG2  ARG  26           2HG      ARG  26  -9.430  -3.450   2.515
  204    HG3  ARG  26           1HG      ARG  26  -8.086  -2.365   2.866
  205    HD2  ARG  26           2HD      ARG  26  -8.362  -3.959   4.723
  206    HD3  ARG  26           1HD      ARG  26  -8.813  -2.340   5.281
  207    HE   ARG  26           HE       ARG  26 -10.928  -4.155   4.216
  208   HH11  ARG  26          1HH2      ARG  26 -10.307  -4.865   7.005
  209   HH12  ARG  26          2HH2      ARG  26 -11.326  -3.803   7.918
  210   HH21  ARG  26          1HH1      ARG  26 -11.915  -1.655   5.262
  211   HH22  ARG  26          2HH1      ARG  26 -12.234  -1.983   6.932
  212    H    ARG  27           H        ARG  27  -6.931  -0.601   2.698
  213    HA   ARG  27           HA       ARG  27  -4.979  -0.055   4.313
  214    HB2  ARG  27           2HB      ARG  27  -6.857  -1.784   5.908
  215    HB3  ARG  27           1HB      ARG  27  -5.126  -1.909   6.197
  216    HG2  ARG  27           2HG      ARG  27  -5.662   0.846   6.040
  217    HG3  ARG  27           1HG      ARG  27  -6.932   0.164   7.054
  218    HD2  ARG  27           2HD      ARG  27  -3.949  -0.259   7.446
  219    HD3  ARG  27           1HD      ARG  27  -4.998   0.761   8.453
  220    HE   ARG  27           HE       ARG  27  -5.168  -2.209   8.265
  221   HH11  ARG  27          1HH1      ARG  27  -7.002   0.515   9.052
  222   HH12  ARG  27          2HH1      ARG  27  -7.471  -0.048  10.621
  223   HH21  ARG  27          1HH2      ARG  27  -5.391  -2.826  10.530
  224   HH22  ARG  27          2HH2      ARG  27  -6.557  -1.944  11.460
  225    H    GLN  28           H        GLN  28  -3.369  -1.998   4.841
  226    HA   GLN  28           HA       GLN  28  -3.405  -3.722   2.445
  227    HB2  GLN  28           2HB      GLN  28  -1.481  -2.843   4.530
  228    HB3  GLN  28           1HB      GLN  28  -1.178  -4.427   3.820
  229    HG2  GLN  28           2HG      GLN  28  -0.014  -2.626   2.578
  230    HG3  GLN  28           1HG      GLN  28  -1.204  -3.455   1.574
  231   HE21  GLN  28          1HE2      GLN  28  -1.784  -0.945   4.084
  232   HE22  GLN  28          2HE2      GLN  28  -2.508   0.170   3.013
  233    H    GLY  29           H        GLY  29  -5.472  -4.330   4.137
  234    HA2  GLY  29           2HA      GLY  29  -6.288  -5.949   5.722
  235    HA3  GLY  29           1HA      GLY  29  -5.764  -6.966   4.382
  236    H    CYS  30           H        CYS  30  -3.785  -8.055   4.535
  237    HA   CYS  30           HA       CYS  30  -2.834  -8.557   7.294
  238    HB2  CYS  30           2HB      CYS  30  -3.268 -10.012   4.957
  239    HB3  CYS  30           1HB      CYS  30  -1.513  -9.891   5.066
  240    H    TRP  31           H        TRP  31  -0.937  -7.614   8.033
  241    HA   TRP  31           HA       TRP  31   0.872  -6.417   5.969
  242    HB2  TRP  31           2HB      TRP  31  -0.373  -5.347   8.277
  243    HB3  TRP  31           1HB      TRP  31   1.356  -5.458   8.633
  244    HD1  TRP  31           HD       TRP  31  -1.077  -3.982   6.086
  245    HE1  TRP  31           1HE      TRP  31   0.116  -2.057   4.820
  246    HE3  TRP  31           3HE      TRP  31   3.616  -4.517   7.952
  247    HZ2  TRP  31           2HZ      TRP  31   2.765  -0.941   4.616
  248    HZ3  TRP  31           3HZ      TRP  31   5.465  -3.038   7.213
  249    HH2  TRP  31           HH       TRP  31   5.043  -1.252   5.547
  250    H    LYS  32           H        LYS  32   0.587  -8.524   8.733
  251    HA   LYS  32           HA       LYS  32   3.475  -8.954   9.024
  252    HB2  LYS  32           2HB      LYS  32   1.949  -9.138  10.922
  253    HB3  LYS  32           1HB      LYS  32   0.982 -10.341  10.065
  254    HG2  LYS  32           2HG      LYS  32   2.666 -11.982  10.215
  255    HG3  LYS  32           1HG      LYS  32   3.917 -10.788  10.569
  256    HD2  LYS  32           2HD      LYS  32   2.013 -10.442  12.589
  257    HD3  LYS  32           1HD      LYS  32   2.155 -12.191  12.400
  258    HE2  LYS  32           2HE      LYS  32   4.545 -12.115  12.756
  259    HE3  LYS  32           1HE      LYS  32   4.546 -10.341  12.688
  260    HZ1  LYS  32           3HZ      LYS  32   3.644 -10.164  14.732
  261    HZ2  LYS  32           1HZ      LYS  32   4.307 -11.708  14.964
  262    HZ3  LYS  32           2HZ      LYS  32   2.667 -11.543  14.550
  263    H    CYS  33           H        CYS  33   1.270  -9.769   6.689
  264    HA   CYS  33           HA       CYS  33   2.596 -12.401   6.110
  265    HB2  CYS  33           2HB      CYS  33   0.079 -12.212   6.671
  266    HB3  CYS  33           1HB      CYS  33  -0.086 -11.436   5.097
  267    H    GLY  34           H        GLY  34   0.765  -9.929   4.257
  268    HA2  GLY  34           2HA      GLY  34   2.331  -8.567   2.685
  269    HA3  GLY  34           1HA      GLY  34   2.837 -10.160   2.119
  270    H    LYS  35           H        LYS  35  -0.442  -9.110   3.004
  271    HA   LYS  35           HA       LYS  35  -1.301  -8.950   0.204
  272    HB2  LYS  35           2HB      LYS  35  -1.215 -11.440   1.622
  273    HB3  LYS  35           1HB      LYS  35  -2.906 -11.013   1.358
  274    HG2  LYS  35           2HG      LYS  35  -0.752 -11.118  -0.777
  275    HG3  LYS  35           1HG      LYS  35  -2.035 -12.306  -0.549
  276    HD2  LYS  35           2HD      LYS  35  -2.571  -9.370  -1.069
  277    HD3  LYS  35           1HD      LYS  35  -2.501 -10.582  -2.348
  278    HE2  LYS  35           2HE      LYS  35  -4.215 -11.407  -0.113
  279    HE3  LYS  35           1HE      LYS  35  -4.780  -9.929  -0.917
  280    HZ1  LYS  35           3HZ      LYS  35  -4.609 -10.994  -3.036
  281    HZ2  LYS  35           1HZ      LYS  35  -5.536 -11.995  -2.030
  282    HZ3  LYS  35           2HZ      LYS  35  -3.914 -12.383  -2.350
  283    H    THR  36           H        THR  36  -3.051  -7.593   0.140
  284    HA   THR  36           HA       THR  36  -4.166  -6.456   2.540
  285    HB   THR  36           HB       THR  36  -3.993  -5.206   0.479
  286    HG1  THR  36           1HG      THR  36  -5.809  -4.298   0.935
  287   HG21  THR  36          3HG2      THR  36  -5.644  -6.030  -1.412
  288   HG22  THR  36          1HG2      THR  36  -5.420  -7.593  -0.630
  289   HG23  THR  36          2HG2      THR  36  -4.029  -6.723  -1.275
  290    H    GLY  37           H        GLY  37  -6.780  -6.344   2.513
  291    HA2  GLY  37           2HA      GLY  37  -8.783  -7.500   2.909
  292    HA3  GLY  37           1HA      GLY  37  -8.222  -8.704   1.750
  293    H    HIS  38           H        HIS  38  -7.382 -10.619   2.521
  294    HA   HIS  38           HA       HIS  38  -7.991 -11.688   4.985
  295    HB2  HIS  38           2HB      HIS  38  -6.939 -13.419   3.979
  296    HB3  HIS  38           1HB      HIS  38  -6.423 -12.307   2.717
  297    HD1  HIS  38           1HD      HIS  38  -3.974 -12.524   2.353
  298    HD2  HIS  38           2HD      HIS  38  -4.962 -12.944   6.379
  299    HE1  HIS  38           1HE      HIS  38  -1.790 -12.859   3.590
  300    H    VAL  39           H        VAL  39  -7.004 -11.779   7.044
  301    HA   VAL  39           HA       VAL  39  -4.771  -9.823   7.510
  302    HB   VAL  39           HB       VAL  39  -6.930 -10.505   9.506
  303   HG11  VAL  39          1HG1      VAL  39  -4.648  -8.901   9.551
  304   HG12  VAL  39          2HG1      VAL  39  -5.980  -8.848  10.705
  305   HG13  VAL  39          3HG1      VAL  39  -5.972  -7.759   9.319
  306   HG21  VAL  39          3HG2      VAL  39  -8.186  -9.833   7.551
  307   HG22  VAL  39          1HG2      VAL  39  -7.080  -8.496   7.237
  308   HG23  VAL  39          2HG2      VAL  39  -8.138  -8.452   8.648
  309    H    MET  40           H        MET  40  -3.438 -10.379   9.455
  310    HA   MET  40           HA       MET  40  -2.371 -12.938   9.523
  311    HB2  MET  40           2HB      MET  40  -1.417 -12.264  11.615
  312    HB3  MET  40           1HB      MET  40  -1.684 -10.767  10.722
  313    HG2  MET  40           2HG      MET  40  -3.988 -10.715  11.915
  314    HG3  MET  40           1HG      MET  40  -3.278 -11.896  13.018
  315    HE1  MET  40           3HE      MET  40  -3.088  -7.525  13.327
  316    HE2  MET  40           1HE      MET  40  -4.381  -8.728  13.240
  317    HE3  MET  40           2HE      MET  40  -3.476  -8.296  11.790
  318    H    ALA  41           H        ALA  41  -5.364 -11.814  10.934
  319    HA   ALA  41           HA       ALA  41  -5.856 -14.094  12.675
  320    HB1  ALA  41           3HB      ALA  41  -7.555 -12.708  13.285
  321    HB2  ALA  41           1HB      ALA  41  -8.183 -12.673  11.637
  322    HB3  ALA  41           2HB      ALA  41  -6.912 -11.551  12.119
  323    H    LYS  42           H        LYS  42  -7.142 -13.017   9.564
  324    HA   LYS  42           HA       LYS  42  -8.355 -15.685   9.077
  325    HB2  LYS  42           2HB      LYS  42  -8.872 -12.876   8.610
  326    HB3  LYS  42           1HB      LYS  42  -9.013 -13.793   7.097
  327    HG2  LYS  42           2HG      LYS  42 -10.240 -15.256   9.266
  328    HG3  LYS  42           1HG      LYS  42 -10.906 -13.624   9.190
  329    HD2  LYS  42           2HD      LYS  42 -10.570 -15.146   6.632
  330    HD3  LYS  42           1HD      LYS  42 -11.922 -15.561   7.686
  331    HE2  LYS  42           2HE      LYS  42 -11.604 -12.662   7.358
  332    HE3  LYS  42           1HE      LYS  42 -11.943 -13.504   5.833
  333    HZ1  LYS  42           3HZ      LYS  42 -13.918 -14.297   6.588
  334    HZ2  LYS  42           1HZ      LYS  42 -13.864 -12.880   7.520
  335    HZ3  LYS  42           2HZ      LYS  42 -13.410 -14.366   8.208
  336    H    CYS  43           H        CYS  43  -5.423 -15.253   8.785
  337    HA   CYS  43           HA       CYS  43  -4.958 -15.177   5.865
  338    HB2  CYS  43           2HB      CYS  43  -3.534 -14.125   7.738
  339    HB3  CYS  43           1HB      CYS  43  -2.995 -15.768   8.091
  340    HA   PRO  44           HA       PRO  44  -5.330 -19.610   5.750
  341    HB2  PRO  44           2HB      PRO  44  -4.719 -19.906   3.100
  342    HB3  PRO  44           1HB      PRO  44  -6.301 -19.339   3.670
  343    HG2  PRO  44           2HG      PRO  44  -4.036 -17.800   2.531
  344    HG3  PRO  44           1HG      PRO  44  -5.778 -17.536   2.370
  345    HD2  PRO  44           2HD      PRO  44  -4.115 -16.106   4.047
  346    HD3  PRO  44           1HD      PRO  44  -5.874 -16.251   4.243
  347    H    GLU  45           H        GLU  45  -2.552 -17.759   5.581
  348    HA   GLU  45           HA       GLU  45  -0.243 -18.284   5.577
  349    HB2  GLU  45           2HB      GLU  45  -1.804 -20.284   7.067
  350    HB3  GLU  45           1HB      GLU  45  -0.211 -20.862   6.574
  351    HG2  GLU  45           2HG      GLU  45   0.784 -18.772   7.545
  352    HG3  GLU  45           1HG      GLU  45  -0.816 -18.347   8.158
  353    H    ARG  46           H        ARG  46  -0.704 -18.410   3.054
  354    HA   ARG  46           HA       ARG  46  -0.376 -19.544   0.998
  355    HB2  ARG  46           2HB      ARG  46   1.536 -21.125   2.738
  356    HB3  ARG  46           1HB      ARG  46   1.715 -20.743   1.025
  357    HG2  ARG  46           2HG      ARG  46   1.529 -18.246   1.912
  358    HG3  ARG  46           1HG      ARG  46   2.102 -18.979   3.411
  359    HD2  ARG  46           2HD      ARG  46   4.049 -18.256   2.135
  360    HD3  ARG  46           1HD      ARG  46   3.986 -20.028   2.064
  361    HE   ARG  46           HE       ARG  46   2.927 -19.810  -0.177
  362   HH11  ARG  46          1HH1      ARG  46   2.039 -16.977  -0.041
  363   HH12  ARG  46          2HH1      ARG  46   3.250 -16.156  -0.969
  364   HH21  ARG  46          1HH2      ARG  46   5.508 -18.784  -0.838
  365   HH22  ARG  46          2HH2      ARG  46   5.214 -17.179  -1.418
  366    H    GLN  47           H        GLN  47  -2.451 -20.629   0.871
  367    HA   GLN  47           HA       GLN  47  -2.362 -23.524   1.666
  368    HB2  GLN  47           2HB      GLN  47  -3.997 -21.621   2.669
  369    HB3  GLN  47           1HB      GLN  47  -4.946 -22.100   1.261
  370    HG2  GLN  47           2HG      GLN  47  -5.097 -24.352   1.989
  371    HG3  GLN  47           1HG      GLN  47  -3.801 -24.143   3.167
  372   HE21  GLN  47          1HE2      GLN  47  -4.790 -24.330   5.193
  373   HE22  GLN  47          2HE2      GLN  47  -6.194 -23.499   5.661
  374    H    ALA  48           H        ALA  48  -4.997 -23.771   0.196
  375    HA   ALA  48           HA       ALA  48  -4.085 -24.756  -2.289
  376    HB1  ALA  48           3HB      ALA  48  -6.493 -24.722  -2.859
  377    HB2  ALA  48           1HB      ALA  48  -6.793 -23.617  -1.517
  378    HB3  ALA  48           2HB      ALA  48  -6.250 -25.265  -1.198
  379    H    GLY  49           H        GLY  49  -3.371 -23.682  -4.087
  380    HA2  GLY  49           2HA      GLY  49  -4.638 -21.310  -5.109
  381    HA3  GLY  49           1HA      GLY  49  -3.121 -20.892  -4.312
  Start of MODEL    6
    1    H1   ALA   1           1HT      ALA   1   8.799  22.525   7.286
    2    H2   ALA   1           2HT      ALA   1   8.457  21.176   8.259
    3    H3   ALA   1           3HT      ALA   1   9.042  20.962   6.678
    4    HA   ALA   1           HA       ALA   1  10.815  22.591   8.223
    5    HB1  ALA   1           3HB      ALA   1  10.650  19.753   9.161
    6    HB2  ALA   1           1HB      ALA   1   9.483  20.904   9.810
    7    HB3  ALA   1           2HB      ALA   1  11.210  21.183  10.025
    8    H    GLN   2           H        GLN   2  12.498  20.056   8.493
    9    HA   GLN   2           HA       GLN   2  13.664  20.131   5.822
   10    HB2  GLN   2           2HB      GLN   2  14.160  18.662   8.411
   11    HB3  GLN   2           1HB      GLN   2  15.094  18.286   6.964
   12    HG2  GLN   2           2HG      GLN   2  15.294  20.978   6.932
   13    HG3  GLN   2           1HG      GLN   2  15.144  20.717   8.670
   14   HE21  GLN   2          1HE2      GLN   2  17.598  21.660   7.861
   15   HE22  GLN   2          2HE2      GLN   2  18.763  20.427   7.897
   16    H    GLN   3           H        GLN   3  12.093  17.601   7.780
   17    HA   GLN   3           HA       GLN   3  10.888  15.680   7.110
   18    HB2  GLN   3           2HB      GLN   3  10.514  17.751   5.148
   19    HB3  GLN   3           1HB      GLN   3  10.593  16.192   4.325
   20    HG2  GLN   3           2HG      GLN   3   8.697  15.388   5.364
   21    HG3  GLN   3           1HG      GLN   3   8.957  16.355   6.817
   22   HE21  GLN   3          1HE2      GLN   3   9.179  18.944   5.738
   23   HE22  GLN   3          2HE2      GLN   3   7.718  19.369   4.984
   24    H    ARG   4           H        ARG   4  13.055  14.595   7.437
   25    HA   ARG   4           HA       ARG   4  15.025  14.145   5.502
   26    HB2  ARG   4           2HB      ARG   4  15.315  11.970   6.735
   27    HB3  ARG   4           1HB      ARG   4  15.150  13.361   7.807
   28    HG2  ARG   4           2HG      ARG   4  12.531  12.633   7.454
   29    HG3  ARG   4           1HG      ARG   4  13.341  11.065   7.418
   30    HD2  ARG   4           2HD      ARG   4  14.070  11.239   9.615
   31    HD3  ARG   4           1HD      ARG   4  14.128  13.012   9.560
   32    HE   ARG   4           HE       ARG   4  11.484  11.643   9.393
   33   HH11  ARG   4          1HH1      ARG   4  12.902  14.560   9.981
   34   HH12  ARG   4          2HH1      ARG   4  12.122  14.867  11.496
   35   HH21  ARG   4          1HH2      ARG   4  10.829  11.661  11.781
   36   HH22  ARG   4          2HH2      ARG   4  10.947  13.225  12.516
   37    H    LYS   5           H        LYS   5  14.589  13.612   3.383
   38    HA   LYS   5           HA       LYS   5  13.745  12.400   1.538
   39    HB2  LYS   5           2HB      LYS   5  13.349  10.355   3.749
   40    HB3  LYS   5           1HB      LYS   5  13.434  10.000   2.023
   41    HG2  LYS   5           2HG      LYS   5  15.732  11.084   2.027
   42    HG3  LYS   5           1HG      LYS   5  15.634  11.097   3.788
   43    HD2  LYS   5           2HD      LYS   5  14.933   8.499   2.633
   44    HD3  LYS   5           1HD      LYS   5  16.582   8.997   2.249
   45    HE2  LYS   5           2HE      LYS   5  17.117   8.208   4.321
   46    HE3  LYS   5           1HE      LYS   5  16.319   9.668   4.941
   47    HZ1  LYS   5           3HZ      LYS   5  15.041   7.044   4.383
   48    HZ2  LYS   5           1HZ      LYS   5  14.186   8.453   4.783
   49    HZ3  LYS   5           2HZ      LYS   5  15.258   7.763   5.907
   50    H    VAL   6           H        VAL   6  11.686  11.645   0.596
   51    HA   VAL   6           HA       VAL   6   9.358  12.883   1.889
   52    HB   VAL   6           HB       VAL   6   8.301  12.215  -0.274
   53   HG11  VAL   6          1HG1      VAL   6   9.227  14.053  -1.203
   54   HG12  VAL   6          2HG1      VAL   6  10.808  13.280  -1.311
   55   HG13  VAL   6          3HG1      VAL   6  10.323  14.087   0.179
   56   HG21  VAL   6          3HG2      VAL   6   9.157  10.475  -1.418
   57   HG22  VAL   6          1HG2      VAL   6  10.480  10.355  -0.258
   58   HG23  VAL   6          2HG2      VAL   6  10.643  11.389  -1.678
   59    H    ILE   7           H        ILE   7   9.448  11.302   3.748
   60    HA   ILE   7           HA       ILE   7   9.249   8.800   4.301
   61    HB   ILE   7           HB       ILE   7   6.593  10.205   4.560
   62   HG12  ILE   7          2HG1      ILE   7   8.457  11.859   5.015
   63   HG13  ILE   7          1HG1      ILE   7   7.458  11.501   6.417
   64   HG21  ILE   7          1HG2      ILE   7   6.928   7.919   5.483
   65   HG22  ILE   7          2HG2      ILE   7   6.628   9.109   6.749
   66   HG23  ILE   7          3HG2      ILE   7   8.268   8.530   6.453
   67   HD11  ILE   7          3HD1      ILE   7   9.073  10.034   7.344
   68   HD12  ILE   7          1HD1      ILE   7   9.981  11.447   6.808
   69   HD13  ILE   7          2HD1      ILE   7   9.990   9.973   5.839
   70    H    ARG   8           H        ARG   8   8.931   7.043   2.963
   71    HA   ARG   8           HA       ARG   8   6.915   7.046   0.832
   72    HB2  ARG   8           2HB      ARG   8   9.282   5.913   1.045
   73    HB3  ARG   8           1HB      ARG   8   8.389   4.637   1.874
   74    HG2  ARG   8           2HG      ARG   8   7.324   3.959  -0.031
   75    HG3  ARG   8           1HG      ARG   8   7.193   5.602  -0.662
   76    HD2  ARG   8           2HD      ARG   8   9.619   5.564  -1.226
   77    HD3  ARG   8           1HD      ARG   8   9.701   3.883  -0.661
   78    HE   ARG   8           HE       ARG   8   8.141   3.265  -2.455
   79   HH11  ARG   8          1HH2      ARG   8  10.371   5.568  -3.186
   80   HH12  ARG   8          2HH2      ARG   8   9.517   6.272  -4.518
   81   HH21  ARG   8          1HH1      ARG   8   6.570   4.566  -3.876
   82   HH22  ARG   8          2HH1      ARG   8   7.367   5.705  -4.909
   83    H    CYS   9           H        CYS   9   4.800   6.987   1.631
   84    HA   CYS   9           HA       CYS   9   3.967   5.660   4.035
   85    HB2  CYS   9           2HB      CYS   9   2.754   7.486   2.929
   86    HB3  CYS   9           1HB      CYS   9   2.471   6.462   1.517
   87    H    TRP  10           H        TRP  10   4.045   3.471   4.328
   88    HA   TRP  10           HA       TRP  10   3.857   1.636   2.016
   89    HB2  TRP  10           2HB      TRP  10   5.345   0.557   3.325
   90    HB3  TRP  10           1HB      TRP  10   5.104   1.745   4.595
   91    HD1  TRP  10           HD       TRP  10   5.171  -1.733   4.324
   92    HE1  TRP  10           1HE      TRP  10   3.595  -2.940   5.963
   93    HE3  TRP  10           3HE      TRP  10   2.122   2.149   5.639
   94    HZ2  TRP  10           2HZ      TRP  10   1.347  -2.342   7.621
   95    HZ3  TRP  10           3HZ      TRP  10   0.279   1.801   7.255
   96    HH2  TRP  10           HH       TRP  10  -0.114  -0.435   8.247
   97    H    ASN  11           H        ASN  11   1.549   3.245   3.501
   98    HA   ASN  11           HA       ASN  11  -0.229   0.916   4.077
   99    HB2  ASN  11           2HB      ASN  11   0.190   3.000   5.593
  100    HB3  ASN  11           1HB      ASN  11  -0.872   3.836   4.457
  101   HD21  ASN  11          1HD2      ASN  11  -3.076   2.763   4.102
  102   HD22  ASN  11          2HD2      ASN  11  -3.780   1.945   5.411
  103    H    CYS  12           H        CYS  12   0.227   3.657   1.930
  104    HA   CYS  12           HA       CYS  12  -2.139   2.729   0.325
  105    HB2  CYS  12           2HB      CYS  12  -2.546   5.042  -0.203
  106    HB3  CYS  12           1HB      CYS  12  -2.288   4.955   1.542
  107    H    GLY  13           H        GLY  13   1.239   3.542   0.373
  108    HA2  GLY  13           2HA      GLY  13   2.817   2.878  -1.303
  109    HA3  GLY  13           1HA      GLY  13   1.482   2.659  -2.437
  110    H    LYS  14           H        LYS  14   2.490   5.457  -0.442
  111    HA   LYS  14           HA       LYS  14   3.257   6.984  -2.831
  112    HB2  LYS  14           2HB      LYS  14   0.911   7.202  -3.097
  113    HB3  LYS  14           1HB      LYS  14   0.648   7.375  -1.362
  114    HG2  LYS  14           2HG      LYS  14   0.505   9.525  -2.756
  115    HG3  LYS  14           1HG      LYS  14   1.550   9.578  -1.337
  116    HD2  LYS  14           2HD      LYS  14   3.520   9.401  -2.634
  117    HD3  LYS  14           1HD      LYS  14   2.639   8.829  -4.049
  118    HE2  LYS  14           2HE      LYS  14   2.491  10.970  -4.779
  119    HE3  LYS  14           1HE      LYS  14   1.551  11.376  -3.329
  120    HZ1  LYS  14           3HZ      LYS  14   4.432  11.615  -3.799
  121    HZ2  LYS  14           1HZ      LYS  14   3.922  11.206  -2.234
  122    HZ3  LYS  14           2HZ      LYS  14   3.386  12.650  -2.951
  123    H    GLU  15           H        GLU  15   5.046   7.997  -2.020
  124    HA   GLU  15           HA       GLU  15   5.759   8.441   0.636
  125    HB2  GLU  15           2HB      GLU  15   6.314  10.027  -1.887
  126    HB3  GLU  15           1HB      GLU  15   7.202  10.260  -0.381
  127    HG2  GLU  15           2HG      GLU  15   8.502   8.475  -0.816
  128    HG3  GLU  15           1HG      GLU  15   7.082   7.447  -1.021
  129    H    GLY  16           H        GLY  16   6.097  10.878   1.468
  130    HA2  GLY  16           2HA      GLY  16   4.958  13.125   1.453
  131    HA3  GLY  16           1HA      GLY  16   3.441  12.243   1.272
  132    H    HIS  17           H        HIS  17   4.328  10.130   3.183
  133    HA   HIS  17           HA       HIS  17   4.743  11.498   5.743
  134    HB2  HIS  17           2HB      HIS  17   2.457  10.670   6.550
  135    HB3  HIS  17           1HB      HIS  17   2.426  12.025   5.422
  136    HD1  HIS  17           1HD      HIS  17   1.951  11.377   2.849
  137    HD2  HIS  17           2HD      HIS  17   1.136   8.393   5.644
  138    HE1  HIS  17           1HE      HIS  17   0.475   9.684   1.678
  139    H    SER  18           H        SER  18   4.029   9.634   7.532
  140    HA   SER  18           HA       SER  18   5.773   7.369   6.914
  141    HB2  SER  18           2HB      SER  18   5.219   6.763   9.255
  142    HB3  SER  18           1HB      SER  18   5.707   8.446   9.112
  143    HG   SER  18           HG       SER  18   3.000   7.772   8.851
  144    H    ALA  19           H        ALA  19   4.702   5.196   7.971
  145    HA   ALA  19           HA       ALA  19   2.532   4.512   6.081
  146    HB1  ALA  19           3HB      ALA  19   4.754   3.238   7.449
  147    HB2  ALA  19           1HB      ALA  19   3.877   2.702   6.017
  148    HB3  ALA  19           2HB      ALA  19   3.279   2.289   7.623
  149    H    ARG  20           H        ARG  20   3.116   4.428   9.612
  150    HA   ARG  20           HA       ARG  20   0.563   3.308  10.303
  151    HB2  ARG  20           2HB      ARG  20   1.272   3.764  12.527
  152    HB3  ARG  20           1HB      ARG  20   2.760   3.492  11.628
  153    HG2  ARG  20           2HG      ARG  20   1.824   6.307  11.674
  154    HG3  ARG  20           1HG      ARG  20   2.340   5.656  13.224
  155    HD2  ARG  20           2HD      ARG  20   4.177   4.896  11.086
  156    HD3  ARG  20           1HD      ARG  20   4.030   6.658  11.249
  157    HE   ARG  20           HE       ARG  20   4.218   5.322  13.828
  158   HH11  ARG  20          1HH2      ARG  20   5.548   7.682  11.908
  159   HH12  ARG  20          2HH2      ARG  20   7.182   7.471  12.444
  160   HH21  ARG  20          1HH1      ARG  20   6.507   4.559  14.203
  161   HH22  ARG  20          2HH1      ARG  20   7.724   5.702  13.745
  162    H    GLN  21           H        GLN  21   1.332   6.391   9.091
  163    HA   GLN  21           HA       GLN  21  -0.824   7.802  10.541
  164    HB2  GLN  21           2HB      GLN  21   1.480   8.710   9.843
  165    HB3  GLN  21           1HB      GLN  21   0.833   8.768   8.203
  166    HG2  GLN  21           2HG      GLN  21  -0.193  10.711   8.668
  167    HG3  GLN  21           1HG      GLN  21  -1.109   9.919   9.951
  168   HE21  GLN  21          1HE2      GLN  21   0.102  12.669   9.960
  169   HE22  GLN  21          2HE2      GLN  21   1.156  12.696  11.300
  170    H    CYS  22           H        CYS  22  -0.154   6.572   7.271
  171    HA   CYS  22           HA       CYS  22  -2.759   7.541   6.260
  172    HB2  CYS  22           2HB      CYS  22  -0.205   6.957   5.235
  173    HB3  CYS  22           1HB      CYS  22  -1.271   5.729   4.552
  174    H    ARG  23           H        ARG  23  -4.449   6.172   5.652
  175    HA   ARG  23           HA       ARG  23  -4.267   3.328   6.527
  176    HB2  ARG  23           2HB      ARG  23  -5.880   3.984   7.997
  177    HB3  ARG  23           1HB      ARG  23  -6.026   5.555   7.223
  178    HG2  ARG  23           2HG      ARG  23  -8.174   4.530   7.025
  179    HG3  ARG  23           1HG      ARG  23  -7.436   4.387   5.431
  180    HD2  ARG  23           2HD      ARG  23  -7.674   2.138   5.541
  181    HD3  ARG  23           1HD      ARG  23  -6.651   2.106   6.989
  182    HE   ARG  23           HE       ARG  23  -9.509   1.870   7.007
  183   HH11  ARG  23          1HH1      ARG  23  -6.953   1.864   9.052
  184   HH12  ARG  23          2HH1      ARG  23  -7.721   2.696  10.364
  185   HH21  ARG  23          1HH2      ARG  23 -10.490   3.630   8.498
  186   HH22  ARG  23          2HH2      ARG  23  -9.724   3.691  10.051
  187    H    ALA  24           H        ALA  24  -4.506   5.450   3.939
  188    HA   ALA  24           HA       ALA  24  -5.365   5.246   1.728
  189    HB1  ALA  24           3HB      ALA  24  -3.547   3.363   2.395
  190    HB2  ALA  24           1HB      ALA  24  -4.280   3.433   0.793
  191    HB3  ALA  24           2HB      ALA  24  -4.906   2.310   2.000
  192    HA   PRO  25           HA       PRO  25  -9.384   3.440   1.606
  193    HB2  PRO  25           2HB      PRO  25  -9.532   1.407  -0.227
  194    HB3  PRO  25           1HB      PRO  25  -9.417   3.117  -0.686
  195    HG2  PRO  25           2HG      PRO  25  -7.310   1.026  -0.655
  196    HG3  PRO  25           1HG      PRO  25  -7.560   2.366  -1.783
  197    HD2  PRO  25           2HD      PRO  25  -5.698   2.362   0.220
  198    HD3  PRO  25           1HD      PRO  25  -6.386   3.836  -0.489
  199    H    ARG  26           H        ARG  26  -8.622   0.161   0.760
  200    HA   ARG  26           HA       ARG  26  -9.203  -0.606   3.496
  201    HB2  ARG  26           2HB      ARG  26  -9.192  -2.026   0.854
  202    HB3  ARG  26           1HB      ARG  26  -9.380  -2.908   2.369
  203    HG2  ARG  26           2HG      ARG  26 -11.265  -1.017   1.032
  204    HG3  ARG  26           1HG      ARG  26 -11.609  -2.494   1.925
  205    HD2  ARG  26           2HD      ARG  26 -11.063  -1.305   4.064
  206    HD3  ARG  26           1HD      ARG  26 -10.814   0.189   3.136
  207    HE   ARG  26           HE       ARG  26 -13.393  -0.901   3.808
  208   HH11  ARG  26          1HH2      ARG  26 -12.839   1.933   2.925
  209   HH12  ARG  26          2HH2      ARG  26 -13.662   1.995   1.402
  210   HH21  ARG  26          1HH1      ARG  26 -13.926  -1.448   1.101
  211   HH22  ARG  26          2HH1      ARG  26 -14.278   0.082   0.370
  212    H    ARG  27           H        ARG  27  -6.551   0.375   2.334
  213    HA   ARG  27           HA       ARG  27  -4.267  -0.596   2.245
  214    HB2  ARG  27           2HB      ARG  27  -3.657  -0.137   4.671
  215    HB3  ARG  27           1HB      ARG  27  -4.552   1.149   3.855
  216    HG2  ARG  27           2HG      ARG  27  -6.051   1.011   5.534
  217    HG3  ARG  27           1HG      ARG  27  -6.547  -0.521   4.843
  218    HD2  ARG  27           2HD      ARG  27  -5.890  -1.495   6.785
  219    HD3  ARG  27           1HD      ARG  27  -4.224  -1.149   6.287
  220    HE   ARG  27           HE       ARG  27  -5.032   1.255   7.331
  221   HH11  ARG  27          1HH2      ARG  27  -4.915  -2.022   8.407
  222   HH12  ARG  27          2HH2      ARG  27  -4.910  -1.608  10.088
  223   HH21  ARG  27          1HH1      ARG  27  -5.132   1.806   9.528
  224   HH22  ARG  27          2HH1      ARG  27  -5.033   0.556  10.723
  225    H    GLN  28           H        GLN  28  -5.402  -2.885   1.796
  226    HA   GLN  28           HA       GLN  28  -5.932  -5.103   2.893
  227    HB2  GLN  28           2HB      GLN  28  -3.151  -4.603   1.822
  228    HB3  GLN  28           1HB      GLN  28  -3.774  -6.223   2.141
  229    HG2  GLN  28           2HG      GLN  28  -4.937  -4.171   0.248
  230    HG3  GLN  28           1HG      GLN  28  -4.183  -5.706  -0.183
  231   HE21  GLN  28          1HE2      GLN  28  -7.107  -4.227   1.143
  232   HE22  GLN  28          2HE2      GLN  28  -8.056  -5.644   1.108
  233    H    GLY  29           H        GLY  29  -6.031  -5.792   4.966
  234    HA2  GLY  29           2HA      GLY  29  -4.794  -4.955   7.223
  235    HA3  GLY  29           1HA      GLY  29  -5.154  -6.665   6.992
  236    H    CYS  30           H        CYS  30  -3.448  -8.069   6.287
  237    HA   CYS  30           HA       CYS  30  -0.777  -7.237   7.101
  238    HB2  CYS  30           2HB      CYS  30  -2.147  -9.588   6.886
  239    HB3  CYS  30           1HB      CYS  30  -1.160  -9.649   5.428
  240    H    TRP  31           H        TRP  31   1.091  -7.285   5.566
  241    HA   TRP  31           HA       TRP  31   0.295  -6.125   2.948
  242    HB2  TRP  31           2HB      TRP  31   2.322  -5.699   4.922
  243    HB3  TRP  31           1HB      TRP  31   3.109  -6.108   3.395
  244    HD1  TRP  31           HD       TRP  31  -0.087  -4.080   4.144
  245    HE1  TRP  31           1HE      TRP  31   0.082  -1.818   2.900
  246    HE3  TRP  31           3HE      TRP  31   4.538  -4.585   2.108
  247    HZ2  TRP  31           2HZ      TRP  31   1.977  -0.422   1.240
  248    HZ3  TRP  31           3HZ      TRP  31   5.517  -2.795   0.697
  249    HH2  TRP  31           HH       TRP  31   4.239  -0.714   0.261
  250    H    LYS  32           H        LYS  32   2.823  -8.406   4.104
  251    HA   LYS  32           HA       LYS  32   3.433  -9.502   1.565
  252    HB2  LYS  32           2HB      LYS  32   3.438 -10.738   4.342
  253    HB3  LYS  32           1HB      LYS  32   4.283 -11.411   2.948
  254    HG2  LYS  32           2HG      LYS  32   6.024 -10.045   3.331
  255    HG3  LYS  32           1HG      LYS  32   4.970  -8.644   3.146
  256    HD2  LYS  32           2HD      LYS  32   4.837  -8.304   5.383
  257    HD3  LYS  32           1HD      LYS  32   4.640 -10.025   5.719
  258    HE2  LYS  32           2HE      LYS  32   6.973 -10.411   5.749
  259    HE3  LYS  32           1HE      LYS  32   7.320  -8.898   4.887
  260    HZ1  LYS  32           3HZ      LYS  32   6.071  -7.845   6.881
  261    HZ2  LYS  32           1HZ      LYS  32   7.701  -8.283   7.060
  262    HZ3  LYS  32           2HZ      LYS  32   6.478  -9.287   7.681
  263    H    CYS  33           H        CYS  33   0.882 -10.309   3.896
  264    HA   CYS  33           HA       CYS  33  -0.691 -11.645   1.802
  265    HB2  CYS  33           2HB      CYS  33  -0.709 -13.805   3.019
  266    HB3  CYS  33           1HB      CYS  33   0.929 -13.367   2.530
  267    H    GLY  34           H        GLY  34  -1.867  -9.608   2.765
  268    HA2  GLY  34           2HA      GLY  34  -3.114 -10.159   5.396
  269    HA3  GLY  34           1HA      GLY  34  -3.240  -8.648   4.497
  270    H    LYS  35           H        LYS  35  -4.765  -8.520   2.773
  271    HA   LYS  35           HA       LYS  35  -6.854  -8.977   1.759
  272    HB2  LYS  35           2HB      LYS  35  -5.480 -11.613   2.144
  273    HB3  LYS  35           1HB      LYS  35  -7.159 -11.619   1.602
  274    HG2  LYS  35           2HG      LYS  35  -6.405  -9.889  -0.159
  275    HG3  LYS  35           1HG      LYS  35  -4.761 -10.385   0.245
  276    HD2  LYS  35           2HD      LYS  35  -4.974 -12.379  -0.820
  277    HD3  LYS  35           1HD      LYS  35  -6.610 -12.632  -0.210
  278    HE2  LYS  35           2HE      LYS  35  -6.097 -10.549  -2.334
  279    HE3  LYS  35           1HE      LYS  35  -6.320 -12.254  -2.774
  280    HZ1  LYS  35           3HZ      LYS  35  -8.159 -10.739  -1.000
  281    HZ2  LYS  35           1HZ      LYS  35  -8.383 -12.310  -1.600
  282    HZ3  LYS  35           2HZ      LYS  35  -8.432 -10.984  -2.660
  283    H    THR  36           H        THR  36  -6.601  -8.711   4.755
  284    HA   THR  36           HA       THR  36  -9.325  -9.325   5.469
  285    HB   THR  36           HB       THR  36  -8.545 -11.612   5.459
  286    HG1  THR  36           1HG      THR  36  -9.543 -11.830   7.275
  287   HG21  THR  36          3HG2      THR  36  -6.476 -11.427   7.484
  288   HG22  THR  36          1HG2      THR  36  -6.076 -10.441   6.079
  289   HG23  THR  36          2HG2      THR  36  -6.405 -12.162   5.882
  290    H    GLY  37           H        GLY  37  -8.213  -9.968   8.317
  291    HA2  GLY  37           2HA      GLY  37  -7.572  -7.127   8.981
  292    HA3  GLY  37           1HA      GLY  37  -8.362  -8.256  10.084
  293    H    HIS  38           H        HIS  38  -6.630 -10.497   9.601
  294    HA   HIS  38           HA       HIS  38  -4.659 -10.230  11.533
  295    HB2  HIS  38           2HB      HIS  38  -4.424 -12.389  10.911
  296    HB3  HIS  38           1HB      HIS  38  -5.487 -12.067   9.548
  297    HD1  HIS  38           1HD      HIS  38  -4.414 -13.069   7.541
  298    HD2  HIS  38           2HD      HIS  38  -1.622 -11.149   9.965
  299    HE1  HIS  38           1HE      HIS  38  -2.194 -13.234   6.338
  300    H    VAL  39           H        VAL  39  -2.740  -9.148  11.678
  301    HA   VAL  39           HA       VAL  39  -1.759  -7.717   9.240
  302    HB   VAL  39           HB       VAL  39  -0.835  -6.145  10.859
  303   HG11  VAL  39          1HG1      VAL  39  -3.654  -7.079  11.408
  304   HG12  VAL  39          2HG1      VAL  39  -3.132  -5.712  10.423
  305   HG13  VAL  39          3HG1      VAL  39  -2.978  -5.645  12.178
  306   HG21  VAL  39          3HG2      VAL  39  -0.688  -6.554  13.163
  307   HG22  VAL  39          1HG2      VAL  39  -0.336  -8.147  12.493
  308   HG23  VAL  39          2HG2      VAL  39  -1.944  -7.790  13.122
  309    H    MET  40           H        MET  40   0.723  -7.324   9.358
  310    HA   MET  40           HA       MET  40   2.103  -9.847   9.272
  311    HB2  MET  40           2HB      MET  40   4.022  -8.415   8.792
  312    HB3  MET  40           1HB      MET  40   2.603  -7.739   7.990
  313    HG2  MET  40           2HG      MET  40   2.409  -6.487  10.378
  314    HG3  MET  40           1HG      MET  40   4.160  -6.682  10.288
  315    HE1  MET  40           3HE      MET  40   3.536  -4.070  10.617
  316    HE2  MET  40           1HE      MET  40   4.001  -3.061   9.240
  317    HE3  MET  40           2HE      MET  40   5.104  -4.292   9.846
  318    H    ALA  41           H        ALA  41   1.370  -7.678  11.848
  319    HA   ALA  41           HA       ALA  41   3.559  -8.039  13.631
  320    HB1  ALA  41           3HB      ALA  41   2.078  -7.100  15.182
  321    HB2  ALA  41           1HB      ALA  41   0.693  -7.977  14.534
  322    HB3  ALA  41           2HB      ALA  41   1.347  -6.593  13.658
  323    H    LYS  42           H        LYS  42   1.135 -10.249  12.561
  324    HA   LYS  42           HA       LYS  42   2.146 -12.295  14.471
  325    HB2  LYS  42           2HB      LYS  42  -0.338 -10.798  14.539
  326    HB3  LYS  42           1HB      LYS  42  -0.657 -12.540  14.411
  327    HG2  LYS  42           2HG      LYS  42   1.423 -11.597  16.346
  328    HG3  LYS  42           1HG      LYS  42  -0.277 -11.396  16.774
  329    HD2  LYS  42           2HD      LYS  42   0.808 -14.036  15.782
  330    HD3  LYS  42           1HD      LYS  42   0.845 -13.602  17.491
  331    HE2  LYS  42           2HE      LYS  42  -1.344 -14.140  17.712
  332    HE3  LYS  42           1HE      LYS  42  -1.778 -13.044  16.383
  333    HZ1  LYS  42           3HZ      LYS  42  -0.737 -14.854  14.911
  334    HZ2  LYS  42           1HZ      LYS  42  -2.296 -15.121  15.524
  335    HZ3  LYS  42           2HZ      LYS  42  -0.957 -15.877  16.248
  336    H    CYS  43           H        CYS  43   1.834 -11.619  11.372
  337    HA   CYS  43           HA       CYS  43   0.345 -14.009  10.469
  338    HB2  CYS  43           2HB      CYS  43   0.236 -11.742   9.387
  339    HB3  CYS  43           1HB      CYS  43   1.927 -11.934   8.926
  340    HA   PRO  44           HA       PRO  44   4.106 -16.377  10.376
  341    HB2  PRO  44           2HB      PRO  44   3.064 -18.579   9.132
  342    HB3  PRO  44           1HB      PRO  44   2.785 -18.220  10.848
  343    HG2  PRO  44           2HG      PRO  44   0.995 -17.807   8.512
  344    HG3  PRO  44           1HG      PRO  44   0.602 -18.297  10.166
  345    HD2  PRO  44           2HD      PRO  44   0.243 -15.760   9.186
  346    HD3  PRO  44           1HD      PRO  44   0.466 -16.145  10.907
  347    H    GLU  45           H        GLU  45   5.341 -15.187   8.833
  348    HA   GLU  45           HA       GLU  45   4.678 -15.436   5.955
  349    HB2  GLU  45           2HB      GLU  45   5.917 -13.559   7.686
  350    HB3  GLU  45           1HB      GLU  45   7.164 -14.102   6.563
  351    HG2  GLU  45           2HG      GLU  45   4.417 -13.287   5.609
  352    HG3  GLU  45           1HG      GLU  45   5.717 -12.112   5.811
  353    H    ARG  46           H        ARG  46   5.395 -17.918   7.151
  354    HA   ARG  46           HA       ARG  46   6.992 -19.672   7.011
  355    HB2  ARG  46           2HB      ARG  46   7.497 -18.199   4.404
  356    HB3  ARG  46           1HB      ARG  46   7.731 -19.923   4.703
  357    HG2  ARG  46           2HG      ARG  46   5.050 -18.544   4.986
  358    HG3  ARG  46           1HG      ARG  46   5.577 -19.342   3.504
  359    HD2  ARG  46           2HD      ARG  46   5.964 -21.440   4.887
  360    HD3  ARG  46           1HD      ARG  46   5.134 -20.614   6.221
  361    HE   ARG  46           HE       ARG  46   3.866 -21.079   3.546
  362   HH11  ARG  46          1HH1      ARG  46   3.306 -19.448   6.372
  363   HH12  ARG  46          2HH1      ARG  46   1.820 -20.245   6.770
  364   HH21  ARG  46          1HH2      ARG  46   2.147 -22.661   4.304
  365   HH22  ARG  46          2HH2      ARG  46   1.164 -22.065   5.600
  366    H    GLN  47           H        GLN  47   8.267 -18.375   8.757
  367    HA   GLN  47           HA       GLN  47  10.762 -17.149   7.685
  368    HB2  GLN  47           2HB      GLN  47  11.025 -16.547  10.132
  369    HB3  GLN  47           1HB      GLN  47   9.563 -15.908   9.382
  370    HG2  GLN  47           2HG      GLN  47   8.184 -17.517  10.427
  371    HG3  GLN  47           1HG      GLN  47   9.548 -18.568  10.805
  372   HE21  GLN  47          1HE2      GLN  47  11.322 -17.204  12.208
  373   HE22  GLN  47          2HE2      GLN  47  10.652 -16.373  13.528
  374    H    ALA  48           H        ALA  48  11.463 -19.407   6.965
  375    HA   ALA  48           HA       ALA  48  12.139 -21.338   9.073
  376    HB1  ALA  48           3HB      ALA  48  13.321 -22.311   6.902
  377    HB2  ALA  48           1HB      ALA  48  12.336 -21.094   6.092
  378    HB3  ALA  48           2HB      ALA  48  11.565 -22.352   7.058
  379    H    GLY  49           H        GLY  49  13.708 -20.318  10.413
  380    HA2  GLY  49           2HA      GLY  49  16.261 -20.544  10.480
  381    HA3  GLY  49           1HA      GLY  49  16.244 -19.514   9.047
  Start of MODEL    7
    1    H1   ALA   1           1HT      ALA   1  11.693   0.137 -14.802
    2    H2   ALA   1           2HT      ALA   1  11.019  -1.342 -15.295
    3    H3   ALA   1           3HT      ALA   1  11.520  -1.128 -13.685
    4    HA   ALA   1           HA       ALA   1   9.346   0.462 -14.945
    5    HB1  ALA   1           3HB      ALA   1   9.294  -2.212 -14.596
    6    HB2  ALA   1           1HB      ALA   1   7.871  -1.204 -14.337
    7    HB3  ALA   1           2HB      ALA   1   8.854  -1.711 -12.963
    8    H    GLN   2           H        GLN   2  11.687   1.138 -13.143
    9    HA   GLN   2           HA       GLN   2  12.055   2.323 -11.131
   10    HB2  GLN   2           2HB      GLN   2   9.622   3.120 -12.404
   11    HB3  GLN   2           1HB      GLN   2   9.355   3.161 -10.660
   12    HG2  GLN   2           2HG      GLN   2  10.682   4.969 -10.409
   13    HG3  GLN   2           1HG      GLN   2  11.963   4.247 -11.381
   14   HE21  GLN   2          1HE2      GLN   2   8.822   5.966 -11.707
   15   HE22  GLN   2          2HE2      GLN   2   9.179   6.646 -13.220
   16    H    GLN   3           H        GLN   3  12.150  -0.112 -10.329
   17    HA   GLN   3           HA       GLN   3   9.918  -0.854  -8.532
   18    HB2  GLN   3           2HB      GLN   3  11.913  -2.145 -10.060
   19    HB3  GLN   3           1HB      GLN   3  12.314  -2.477  -8.375
   20    HG2  GLN   3           2HG      GLN   3   9.497  -2.746  -8.619
   21    HG3  GLN   3           1HG      GLN   3  10.217  -3.621  -9.971
   22   HE21  GLN   3          1HE2      GLN   3   9.344  -3.982  -6.740
   23   HE22  GLN   3          2HE2      GLN   3  10.361  -5.281  -6.339
   24    H    ARG   4           H        ARG   4  10.120  -0.903  -6.256
   25    HA   ARG   4           HA       ARG   4  10.934  -0.253  -4.137
   26    HB2  ARG   4           2HB      ARG   4  12.619  -1.912  -4.635
   27    HB3  ARG   4           1HB      ARG   4  13.482  -0.794  -5.691
   28    HG2  ARG   4           2HG      ARG   4  14.636  -0.881  -3.557
   29    HG3  ARG   4           1HG      ARG   4  13.862   0.697  -3.710
   30    HD2  ARG   4           2HD      ARG   4  11.880  -0.295  -2.426
   31    HD3  ARG   4           1HD      ARG   4  12.943  -1.666  -2.051
   32    HE   ARG   4           HE       ARG   4  13.122   0.920  -0.823
   33   HH11  ARG   4          1HH2      ARG   4  14.626  -2.051  -1.121
   34   HH12  ARG   4          2HH2      ARG   4  16.206  -1.500  -0.673
   35   HH21  ARG   4          1HH1      ARG   4  15.344   1.856  -0.737
   36   HH22  ARG   4          2HH1      ARG   4  16.612   0.710  -0.456
   37    H    LYS   5           H        LYS   5  11.546   1.679  -3.067
   38    HA   LYS   5           HA       LYS   5  13.186   3.759  -4.041
   39    HB2  LYS   5           2HB      LYS   5  10.759   3.401  -5.508
   40    HB3  LYS   5           1HB      LYS   5  10.634   4.924  -4.627
   41    HG2  LYS   5           2HG      LYS   5  12.862   5.592  -5.517
   42    HG3  LYS   5           1HG      LYS   5  12.905   4.102  -6.463
   43    HD2  LYS   5           2HD      LYS   5  12.089   5.776  -7.952
   44    HD3  LYS   5           1HD      LYS   5  10.671   4.849  -7.464
   45    HE2  LYS   5           2HE      LYS   5  10.869   6.814  -5.495
   46    HE3  LYS   5           1HE      LYS   5  11.262   7.670  -7.000
   47    HZ1  LYS   5           3HZ      LYS   5   8.910   5.918  -6.520
   48    HZ2  LYS   5           1HZ      LYS   5   9.325   6.573  -8.029
   49    HZ3  LYS   5           2HZ      LYS   5   8.886   7.602  -6.750
   50    H    VAL   6           H        VAL   6  13.525   4.043  -1.780
   51    HA   VAL   6           HA       VAL   6  13.119   4.996   0.339
   52    HB   VAL   6           HB       VAL   6  10.826   6.254  -1.202
   53   HG11  VAL   6          1HG1      VAL   6  10.355   6.993   0.905
   54   HG12  VAL   6          2HG1      VAL   6  11.692   8.103   0.599
   55   HG13  VAL   6          3HG1      VAL   6  11.970   6.615   1.503
   56   HG21  VAL   6          3HG2      VAL   6  13.409   7.657  -0.695
   57   HG22  VAL   6          1HG2      VAL   6  12.309   7.792  -2.067
   58   HG23  VAL   6          2HG2      VAL   6  13.402   6.413  -1.946
   59    H    ILE   7           H        ILE   7  11.804   4.625   2.182
   60    HA   ILE   7           HA       ILE   7  10.523   2.312   2.605
   61    HB   ILE   7           HB       ILE   7  10.919   4.665   3.935
   62   HG12  ILE   7          2HG1      ILE   7  10.882   2.280   4.779
   63   HG13  ILE   7          1HG1      ILE   7  10.210   3.470   5.894
   64   HG21  ILE   7          1HG2      ILE   7   8.913   5.613   4.694
   65   HG22  ILE   7          2HG2      ILE   7   7.952   4.229   4.181
   66   HG23  ILE   7          3HG2      ILE   7   8.595   5.345   2.980
   67   HD11  ILE   7          3HD1      ILE   7   8.916   1.194   5.245
   68   HD12  ILE   7          1HD1      ILE   7   8.306   2.247   3.969
   69   HD13  ILE   7          2HD1      ILE   7   8.070   2.686   5.660
   70    H    ARG   8           H        ARG   8   8.514   1.364   2.271
   71    HA   ARG   8           HA       ARG   8   6.627   2.816   0.449
   72    HB2  ARG   8           2HB      ARG   8   6.055   0.632  -0.352
   73    HB3  ARG   8           1HB      ARG   8   7.811   0.638  -0.191
   74    HG2  ARG   8           2HG      ARG   8   7.472  -0.330   2.146
   75    HG3  ARG   8           1HG      ARG   8   5.786  -0.586   1.694
   76    HD2  ARG   8           2HD      ARG   8   6.316  -2.217   0.108
   77    HD3  ARG   8           1HD      ARG   8   7.961  -1.593  -0.126
   78    HE   ARG   8           HE       ARG   8   7.245  -3.552   1.825
   79   HH11  ARG   8          1HH2      ARG   8   9.610  -1.346   0.890
   80   HH12  ARG   8          2HH2      ARG   8  10.460  -1.352   2.399
   81   HH21  ARG   8          1HH1      ARG   8   8.071  -3.259   4.039
   82   HH22  ARG   8          2HH1      ARG   8   9.590  -2.440   4.181
   83    H    CYS   9           H        CYS   9   4.571   3.231   1.206
   84    HA   CYS   9           HA       CYS   9   3.910   2.951   3.980
   85    HB2  CYS   9           2HB      CYS   9   1.789   3.885   3.247
   86    HB3  CYS   9           1HB      CYS   9   3.080   4.639   2.306
   87    H    TRP  10           H        TRP  10   2.229   1.621   4.929
   88    HA   TRP  10           HA       TRP  10   2.128  -1.137   3.908
   89    HB2  TRP  10           2HB      TRP  10   1.234   0.419   6.300
   90    HB3  TRP  10           1HB      TRP  10   0.510  -1.156   6.003
   91    HD1  TRP  10           HD       TRP  10   3.472  -2.209   4.740
   92    HE1  TRP  10           1HE      TRP  10   5.192  -2.961   6.518
   93    HE3  TRP  10           3HE      TRP  10   1.505   0.067   8.810
   94    HZ2  TRP  10           2HZ      TRP  10   5.660  -2.611   9.342
   95    HZ3  TRP  10           3HZ      TRP  10   2.584  -0.137  11.045
   96    HH2  TRP  10           HH       TRP  10   4.655  -1.476  11.311
   97    H    ASN  11           H        ASN  11  -0.475   0.734   5.322
   98    HA   ASN  11           HA       ASN  11  -2.712  -0.373   4.357
   99    HB2  ASN  11           2HB      ASN  11  -3.740   1.778   4.637
  100    HB3  ASN  11           1HB      ASN  11  -2.369   1.729   5.746
  101   HD21  ASN  11          1HD2      ASN  11  -3.438   2.979   2.595
  102   HD22  ASN  11          2HD2      ASN  11  -2.295   4.224   2.509
  103    H    CYS  12           H        CYS  12  -0.752   1.932   2.420
  104    HA   CYS  12           HA       CYS  12  -2.460   1.328   0.064
  105    HB2  CYS  12           2HB      CYS  12  -1.541   3.315  -0.844
  106    HB3  CYS  12           1HB      CYS  12  -1.738   3.656   0.870
  107    H    GLY  13           H        GLY  13   0.523   0.404   1.480
  108    HA2  GLY  13           2HA      GLY  13   2.348  -0.846   0.672
  109    HA3  GLY  13           1HA      GLY  13   1.121  -1.654  -0.301
  110    H    LYS  14           H        LYS  14   3.282   1.181  -0.277
  111    HA   LYS  14           HA       LYS  14   4.016   0.779  -3.037
  112    HB2  LYS  14           2HB      LYS  14   1.519   1.855  -2.705
  113    HB3  LYS  14           1HB      LYS  14   2.507   3.311  -2.823
  114    HG2  LYS  14           2HG      LYS  14   2.561   1.015  -4.804
  115    HG3  LYS  14           1HG      LYS  14   1.721   2.546  -5.053
  116    HD2  LYS  14           2HD      LYS  14   3.656   3.706  -5.421
  117    HD3  LYS  14           1HD      LYS  14   4.575   2.742  -4.269
  118    HE2  LYS  14           2HE      LYS  14   3.751   1.060  -6.471
  119    HE3  LYS  14           1HE      LYS  14   4.596   2.489  -7.094
  120    HZ1  LYS  14           3HZ      LYS  14   6.511   1.764  -6.255
  121    HZ2  LYS  14           1HZ      LYS  14   5.752   0.294  -5.890
  122    HZ3  LYS  14           2HZ      LYS  14   5.832   1.521  -4.718
  123    H    GLU  15           H        GLU  15   6.095   1.432  -2.871
  124    HA   GLU  15           HA       GLU  15   7.537   2.864  -1.108
  125    HB2  GLU  15           2HB      GLU  15   9.009   3.349  -2.941
  126    HB3  GLU  15           1HB      GLU  15   8.165   1.865  -3.367
  127    HG2  GLU  15           2HG      GLU  15   7.852   3.040  -5.326
  128    HG3  GLU  15           1HG      GLU  15   6.435   3.595  -4.435
  129    H    GLY  16           H        GLY  16   7.755   5.018  -0.415
  130    HA2  GLY  16           2HA      GLY  16   7.350   7.404  -1.614
  131    HA3  GLY  16           1HA      GLY  16   5.682   6.907  -1.334
  132    H    HIS  17           H        HIS  17   5.773   5.751   1.152
  133    HA   HIS  17           HA       HIS  17   7.228   7.491   3.031
  134    HB2  HIS  17           2HB      HIS  17   4.967   8.245   4.001
  135    HB3  HIS  17           1HB      HIS  17   5.439   8.974   2.466
  136    HD1  HIS  17           1HD      HIS  17   4.458   7.622   0.271
  137    HD2  HIS  17           2HD      HIS  17   2.485   7.031   3.896
  138    HE1  HIS  17           1HE      HIS  17   2.183   6.666  -0.299
  139    H    SER  18           H        SER  18   5.692   7.018   5.307
  140    HA   SER  18           HA       SER  18   6.017   4.072   5.604
  141    HB2  SER  18           2HB      SER  18   5.477   5.099   8.083
  142    HB3  SER  18           1HB      SER  18   7.096   5.001   7.387
  143    HG   SER  18           HG       SER  18   7.108   7.094   7.256
  144    H    ALA  19           H        ALA  19   4.335   3.243   7.403
  145    HA   ALA  19           HA       ALA  19   1.686   3.447   6.170
  146    HB1  ALA  19           3HB      ALA  19   1.177   1.661   7.743
  147    HB2  ALA  19           1HB      ALA  19   2.611   2.040   8.696
  148    HB3  ALA  19           2HB      ALA  19   2.780   1.364   7.075
  149    H    ARG  20           H        ARG  20   3.361   5.089   8.668
  150    HA   ARG  20           HA       ARG  20   1.135   5.699  10.418
  151    HB2  ARG  20           2HB      ARG  20   3.450   5.806  11.144
  152    HB3  ARG  20           1HB      ARG  20   3.832   6.978   9.882
  153    HG2  ARG  20           2HG      ARG  20   2.113   8.517  10.936
  154    HG3  ARG  20           1HG      ARG  20   2.044   7.387  12.290
  155    HD2  ARG  20           2HD      ARG  20   4.735   7.698  12.101
  156    HD3  ARG  20           1HD      ARG  20   4.197   9.293  11.538
  157    HE   ARG  20           HE       ARG  20   2.659   9.179  13.661
  158   HH11  ARG  20          1HH1      ARG  20   5.891   9.537  13.583
  159   HH12  ARG  20          2HH1      ARG  20   6.231   8.878  15.148
  160   HH21  ARG  20          1HH2      ARG  20   3.048   7.573  15.584
  161   HH22  ARG  20          2HH2      ARG  20   4.622   7.771  16.282
  162    H    GLN  21           H        GLN  21   2.406   7.118   7.457
  163    HA   GLN  21           HA       GLN  21   0.811   9.583   7.754
  164    HB2  GLN  21           2HB      GLN  21   3.176   8.925   6.562
  165    HB3  GLN  21           1HB      GLN  21   2.084   8.870   5.179
  166    HG2  GLN  21           2HG      GLN  21   2.749  11.124   5.225
  167    HG3  GLN  21           1HG      GLN  21   1.204  11.152   6.076
  168   HE21  GLN  21          1HE2      GLN  21   4.502  10.177   7.175
  169   HE22  GLN  21          2HE2      GLN  21   4.531  11.244   8.504
  170    H    CYS  22           H        CYS  22   0.971   6.913   5.371
  171    HA   CYS  22           HA       CYS  22  -1.584   7.647   4.148
  172    HB2  CYS  22           2HB      CYS  22   0.608   5.675   3.832
  173    HB3  CYS  22           1HB      CYS  22  -0.969   5.168   3.240
  174    H    ARG  23           H        ARG  23  -3.490   6.586   4.285
  175    HA   ARG  23           HA       ARG  23  -3.837   4.375   6.225
  176    HB2  ARG  23           2HB      ARG  23  -4.090   6.244   7.651
  177    HB3  ARG  23           1HB      ARG  23  -4.833   7.219   6.385
  178    HG2  ARG  23           2HG      ARG  23  -6.403   6.388   8.187
  179    HG3  ARG  23           1HG      ARG  23  -6.885   6.015   6.536
  180    HD2  ARG  23           2HD      ARG  23  -6.935   3.814   7.086
  181    HD3  ARG  23           1HD      ARG  23  -5.196   3.888   7.443
  182    HE   ARG  23           HE       ARG  23  -7.363   4.091   9.417
  183   HH11  ARG  23          1HH2      ARG  23  -4.952   2.536  10.029
  184   HH12  ARG  23          2HH2      ARG  23  -4.037   3.602  11.041
  185   HH21  ARG  23          1HH1      ARG  23  -5.805   6.433  10.116
  186   HH22  ARG  23          2HH1      ARG  23  -4.517   5.804  11.088
  187    H    ALA  24           H        ALA  24  -4.065   5.065   3.249
  188    HA   ALA  24           HA       ALA  24  -6.469   5.361   2.051
  189    HB1  ALA  24           3HB      ALA  24  -4.125   4.283   1.330
  190    HB2  ALA  24           1HB      ALA  24  -5.568   4.104   0.332
  191    HB3  ALA  24           2HB      ALA  24  -5.073   2.798   1.408
  192    HA   PRO  25           HA       PRO  25  -9.560   2.681   3.576
  193    HB2  PRO  25           2HB      PRO  25 -10.879   1.983   1.271
  194    HB3  PRO  25           1HB      PRO  25 -11.016   3.577   2.040
  195    HG2  PRO  25           2HG      PRO  25  -9.320   2.731  -0.266
  196    HG3  PRO  25           1HG      PRO  25 -10.273   4.208  -0.051
  197    HD2  PRO  25           2HD      PRO  25  -7.607   4.174   0.310
  198    HD3  PRO  25           1HD      PRO  25  -8.675   5.207   1.287
  199    H    ARG  26           H        ARG  26  -8.797   1.112   0.457
  200    HA   ARG  26           HA       ARG  26  -9.209  -1.496   1.014
  201    HB2  ARG  26           2HB      ARG  26  -7.244  -1.942  -0.516
  202    HB3  ARG  26           1HB      ARG  26  -8.377  -0.731  -1.120
  203    HG2  ARG  26           2HG      ARG  26  -6.431   0.450  -1.425
  204    HG3  ARG  26           1HG      ARG  26  -6.736   0.896   0.251
  205    HD2  ARG  26           2HD      ARG  26  -4.504   0.168   0.367
  206    HD3  ARG  26           1HD      ARG  26  -5.363  -1.336   0.753
  207    HE   ARG  26           HE       ARG  26  -4.849  -2.169  -1.408
  208   HH11  ARG  26          1HH2      ARG  26  -2.446  -0.246  -0.926
  209   HH12  ARG  26          2HH2      ARG  26  -2.336   0.491  -2.489
  210   HH21  ARG  26          1HH1      ARG  26  -5.458  -0.626  -3.513
  211   HH22  ARG  26          2HH1      ARG  26  -4.047   0.274  -3.959
  212    H    ARG  27           H        ARG  27  -6.257   0.256   1.905
  213    HA   ARG  27           HA       ARG  27  -4.506  -0.303   3.363
  214    HB2  ARG  27           2HB      ARG  27  -7.120  -0.661   4.566
  215    HB3  ARG  27           1HB      ARG  27  -5.895  -1.663   5.357
  216    HG2  ARG  27           2HG      ARG  27  -4.408   0.295   5.499
  217    HG3  ARG  27           1HG      ARG  27  -5.670   1.290   4.781
  218    HD2  ARG  27           2HD      ARG  27  -5.673   1.481   7.276
  219    HD3  ARG  27           1HD      ARG  27  -7.177   0.738   6.693
  220    HE   ARG  27           HE       ARG  27  -5.150  -1.269   7.135
  221   HH11  ARG  27          1HH1      ARG  27  -6.875   1.029   8.992
  222   HH12  ARG  27          2HH1      ARG  27  -7.318  -0.094  10.234
  223   HH21  ARG  27          1HH2      ARG  27  -5.960  -2.838   8.607
  224   HH22  ARG  27          2HH2      ARG  27  -6.800  -2.283  10.016
  225    H    GLN  28           H        GLN  28  -3.568  -2.192   4.724
  226    HA   GLN  28           HA       GLN  28  -3.554  -4.613   2.990
  227    HB2  GLN  28           2HB      GLN  28  -1.675  -3.089   4.623
  228    HB3  GLN  28           1HB      GLN  28  -1.618  -4.807   5.017
  229    HG2  GLN  28           2HG      GLN  28  -0.057  -4.136   3.156
  230    HG3  GLN  28           1HG      GLN  28  -1.208  -5.395   2.711
  231   HE21  GLN  28          1HE2      GLN  28  -2.150  -1.985   3.054
  232   HE22  GLN  28          2HE2      GLN  28  -2.462  -1.730   1.397
  233    H    GLY  29           H        GLY  29  -5.012  -6.152   3.670
  234    HA2  GLY  29           2HA      GLY  29  -6.408  -6.425   6.018
  235    HA3  GLY  29           1HA      GLY  29  -5.820  -7.843   5.144
  236    H    CYS  30           H        CYS  30  -3.159  -7.813   5.470
  237    HA   CYS  30           HA       CYS  30  -2.819  -8.262   8.377
  238    HB2  CYS  30           2HB      CYS  30  -1.750  -9.214   5.861
  239    HB3  CYS  30           1HB      CYS  30  -0.451  -8.755   6.958
  240    H    TRP  31           H        TRP  31  -2.230  -6.448   9.504
  241    HA   TRP  31           HA       TRP  31  -0.434  -4.464   8.160
  242    HB2  TRP  31           2HB      TRP  31  -2.886  -4.282   9.453
  243    HB3  TRP  31           1HB      TRP  31  -1.737  -3.734  10.674
  244    HD1  TRP  31           HD       TRP  31  -2.574  -3.082   6.970
  245    HE1  TRP  31           1HE      TRP  31  -2.062  -0.597   6.467
  246    HE3  TRP  31           3HE      TRP  31  -0.604  -1.703  11.441
  247    HZ2  TRP  31           2HZ      TRP  31  -0.944   1.679   7.814
  248    HZ3  TRP  31           3HZ      TRP  31   0.184   0.623  11.826
  249    HH2  TRP  31           HH       TRP  31   0.020   2.311  10.015
  250    H    LYS  32           H        LYS  32  -0.083  -7.055  10.099
  251    HA   LYS  32           HA       LYS  32   2.303  -5.900  11.400
  252    HB2  LYS  32           2HB      LYS  32   0.479  -5.336  12.915
  253    HB3  LYS  32           1HB      LYS  32  -0.096  -7.002  12.892
  254    HG2  LYS  32           2HG      LYS  32   1.317  -6.320  14.915
  255    HG3  LYS  32           1HG      LYS  32   1.818  -7.786  14.075
  256    HD2  LYS  32           2HD      LYS  32   3.745  -6.836  13.287
  257    HD3  LYS  32           1HD      LYS  32   2.996  -5.251  13.078
  258    HE2  LYS  32           2HE      LYS  32   4.415  -4.845  14.899
  259    HE3  LYS  32           1HE      LYS  32   2.917  -5.296  15.732
  260    HZ1  LYS  32           3HZ      LYS  32   5.358  -6.606  15.869
  261    HZ2  LYS  32           1HZ      LYS  32   4.347  -7.616  14.956
  262    HZ3  LYS  32           2HZ      LYS  32   3.875  -7.127  16.512
  263    H    CYS  33           H        CYS  33   1.129  -8.375   9.632
  264    HA   CYS  33           HA       CYS  33   3.136 -10.254  10.724
  265    HB2  CYS  33           2HB      CYS  33   1.303 -12.018  11.000
  266    HB3  CYS  33           1HB      CYS  33   1.336 -10.730  12.203
  267    H    GLY  34           H        GLY  34   0.538  -9.746   8.295
  268    HA2  GLY  34           2HA      GLY  34   2.171 -11.485   6.500
  269    HA3  GLY  34           1HA      GLY  34   0.450 -11.795   6.668
  270    H    LYS  35           H        LYS  35  -0.282 -11.314   4.674
  271    HA   LYS  35           HA       LYS  35   0.513  -8.729   3.405
  272    HB2  LYS  35           2HB      LYS  35  -0.754 -11.285   2.381
  273    HB3  LYS  35           1HB      LYS  35  -0.429  -9.875   1.373
  274    HG2  LYS  35           2HG      LYS  35   1.746 -11.152   3.029
  275    HG3  LYS  35           1HG      LYS  35   1.360 -11.736   1.409
  276    HD2  LYS  35           2HD      LYS  35   1.517  -8.885   1.301
  277    HD3  LYS  35           1HD      LYS  35   2.956  -9.479   2.132
  278    HE2  LYS  35           2HE      LYS  35   3.767 -10.518   0.254
  279    HE3  LYS  35           1HE      LYS  35   2.149 -10.992  -0.302
  280    HZ1  LYS  35           3HZ      LYS  35   3.039  -9.231  -1.697
  281    HZ2  LYS  35           1HZ      LYS  35   3.265  -8.237  -0.341
  282    HZ3  LYS  35           2HZ      LYS  35   1.695  -8.668  -0.823
  283    H    THR  36           H        THR  36  -2.432 -10.376   2.481
  284    HA   THR  36           HA       THR  36  -4.083  -8.338   3.904
  285    HB   THR  36           HB       THR  36  -3.512  -7.346   1.783
  286    HG1  THR  36           1HG      THR  36  -5.513  -6.841   1.499
  287   HG21  THR  36          3HG2      THR  36  -2.869  -9.634   0.807
  288   HG22  THR  36          1HG2      THR  36  -3.621  -8.482  -0.295
  289   HG23  THR  36          2HG2      THR  36  -4.573  -9.800   0.385
  290    H    GLY  37           H        GLY  37  -4.096 -11.213   1.791
  291    HA2  GLY  37           2HA      GLY  37  -6.711 -12.026   1.776
  292    HA3  GLY  37           1HA      GLY  37  -5.406 -13.184   2.037
  293    H    HIS  38           H        HIS  38  -4.717 -13.526   4.301
  294    HA   HIS  38           HA       HIS  38  -6.993 -13.719   6.113
  295    HB2  HIS  38           2HB      HIS  38  -5.474 -15.010   7.406
  296    HB3  HIS  38           1HB      HIS  38  -4.979 -15.302   5.738
  297    HD1  HIS  38           1HD      HIS  38  -2.484 -15.128   5.504
  298    HD2  HIS  38           2HD      HIS  38  -4.026 -12.489   8.312
  299    HE1  HIS  38           1HE      HIS  38  -0.508 -13.795   6.370
  300    H    VAL  39           H        VAL  39  -7.158 -12.591   8.177
  301    HA   VAL  39           HA       VAL  39  -5.774  -9.935   8.106
  302    HB   VAL  39           HB       VAL  39  -7.729  -9.217   9.446
  303   HG11  VAL  39          1HG1      VAL  39  -7.763  -9.306   6.917
  304   HG12  VAL  39          2HG1      VAL  39  -9.353  -9.379   7.676
  305   HG13  VAL  39          3HG1      VAL  39  -8.604 -10.850   7.051
  306   HG21  VAL  39          3HG2      VAL  39  -7.923 -11.662  10.397
  307   HG22  VAL  39          1HG2      VAL  39  -8.947 -11.928   8.986
  308   HG23  VAL  39          2HG2      VAL  39  -9.385 -10.699  10.174
  309    H    MET  40           H        MET  40  -5.696  -8.973  10.474
  310    HA   MET  40           HA       MET  40  -3.786 -10.425  11.998
  311    HB2  MET  40           2HB      MET  40  -5.551  -8.036  12.336
  312    HB3  MET  40           1HB      MET  40  -4.743  -8.667  13.772
  313    HG2  MET  40           2HG      MET  40  -2.800  -8.648  11.716
  314    HG3  MET  40           1HG      MET  40  -3.633  -7.096  11.625
  315    HE1  MET  40           3HE      MET  40  -3.032  -9.223  15.149
  316    HE2  MET  40           1HE      MET  40  -1.286  -8.985  15.005
  317    HE3  MET  40           2HE      MET  40  -2.186  -9.744  13.694
  318    H    ALA  41           H        ALA  41  -7.256 -10.545  11.950
  319    HA   ALA  41           HA       ALA  41  -7.764 -11.613  14.568
  320    HB1  ALA  41           3HB      ALA  41  -9.826 -12.490  13.282
  321    HB2  ALA  41           1HB      ALA  41  -9.111 -11.720  11.867
  322    HB3  ALA  41           2HB      ALA  41  -9.562 -10.745  13.264
  323    H    LYS  42           H        LYS  42  -6.084 -12.944  11.939
  324    HA   LYS  42           HA       LYS  42  -6.168 -15.631  13.177
  325    HB2  LYS  42           2HB      LYS  42  -7.731 -14.682  10.912
  326    HB3  LYS  42           1HB      LYS  42  -6.740 -16.086  10.473
  327    HG2  LYS  42           2HG      LYS  42  -7.863 -16.562  13.059
  328    HG3  LYS  42           1HG      LYS  42  -9.162 -16.032  11.991
  329    HD2  LYS  42           2HD      LYS  42  -7.294 -17.959  10.768
  330    HD3  LYS  42           1HD      LYS  42  -8.228 -18.604  12.119
  331    HE2  LYS  42           2HE      LYS  42 -10.324 -17.870  11.046
  332    HE3  LYS  42           1HE      LYS  42  -9.397 -17.192   9.693
  333    HZ1  LYS  42           3HZ      LYS  42  -9.438 -20.029  10.576
  334    HZ2  LYS  42           1HZ      LYS  42  -8.379 -19.413   9.403
  335    HZ3  LYS  42           2HZ      LYS  42 -10.054 -19.411   9.117
  336    H    CYS  43           H        CYS  43  -4.268 -13.298  12.022
  337    HA   CYS  43           HA       CYS  43  -2.588 -14.955  10.246
  338    HB2  CYS  43           2HB      CYS  43  -1.587 -12.950   9.632
  339    HB3  CYS  43           1HB      CYS  43  -3.233 -12.442   9.986
  340    HA   PRO  44           HA       PRO  44   0.239 -14.282  13.983
  341    HB2  PRO  44           2HB      PRO  44  -0.929 -14.033  16.439
  342    HB3  PRO  44           1HB      PRO  44  -0.543 -12.639  15.412
  343    HG2  PRO  44           2HG      PRO  44  -3.148 -13.899  15.974
  344    HG3  PRO  44           1HG      PRO  44  -2.764 -12.225  15.558
  345    HD2  PRO  44           2HD      PRO  44  -3.802 -14.173  13.834
  346    HD3  PRO  44           1HD      PRO  44  -3.125 -12.603  13.368
  347    H    GLU  45           H        GLU  45  -2.230 -15.496  16.148
  348    HA   GLU  45           HA       GLU  45  -1.725 -18.316  15.426
  349    HB2  GLU  45           2HB      GLU  45  -1.155 -17.693  18.267
  350    HB3  GLU  45           1HB      GLU  45  -0.310 -18.784  17.174
  351    HG2  GLU  45           2HG      GLU  45   0.819 -16.875  16.105
  352    HG3  GLU  45           1HG      GLU  45  -0.068 -15.752  17.136
  353    H    ARG  46           H        ARG  46  -3.765 -19.163  15.562
  354    HA   ARG  46           HA       ARG  46  -6.102 -18.209  16.448
  355    HB2  ARG  46           2HB      ARG  46  -4.869 -20.819  16.163
  356    HB3  ARG  46           1HB      ARG  46  -6.111 -20.843  17.415
  357    HG2  ARG  46           2HG      ARG  46  -7.710 -20.852  15.836
  358    HG3  ARG  46           1HG      ARG  46  -7.111 -19.312  15.218
  359    HD2  ARG  46           2HD      ARG  46  -5.242 -20.932  14.146
  360    HD3  ARG  46           1HD      ARG  46  -6.600 -22.073  14.216
  361    HE   ARG  46           HE       ARG  46  -7.948 -20.241  13.048
  362   HH11  ARG  46          1HH1      ARG  46  -5.814 -18.152  13.088
  363   HH12  ARG  46          2HH1      ARG  46  -5.129 -18.293  11.503
  364   HH21  ARG  46          1HH2      ARG  46  -6.512 -21.415  10.895
  365   HH22  ARG  46          2HH2      ARG  46  -5.524 -20.142  10.263
  366    H    GLN  47           H        GLN  47  -5.981 -16.807  18.289
  367    HA   GLN  47           HA       GLN  47  -5.158 -18.036  20.883
  368    HB2  GLN  47           2HB      GLN  47  -5.379 -15.293  19.707
  369    HB3  GLN  47           1HB      GLN  47  -5.533 -15.455  21.456
  370    HG2  GLN  47           2HG      GLN  47  -3.314 -17.024  20.360
  371    HG3  GLN  47           1HG      GLN  47  -3.141 -15.292  20.069
  372   HE21  GLN  47          1HE2      GLN  47  -2.287 -14.109  21.788
  373   HE22  GLN  47          2HE2      GLN  47  -2.256 -14.627  23.404
  374    H    ALA  48           H        ALA  48  -7.405 -19.248  20.511
  375    HA   ALA  48           HA       ALA  48  -9.719 -17.558  21.306
  376    HB1  ALA  48           3HB      ALA  48 -10.944 -19.190  20.267
  377    HB2  ALA  48           1HB      ALA  48  -9.978 -20.491  20.965
  378    HB3  ALA  48           2HB      ALA  48  -9.392 -19.620  19.547
  379    H    GLY  49           H        GLY  49  -7.292 -19.391  22.791
  380    HA2  GLY  49           2HA      GLY  49  -8.351 -19.097  25.415
  381    HA3  GLY  49           1HA      GLY  49  -8.703 -20.738  24.869
  Start of MODEL    8
    1    H1   ALA   1           1HT      ALA   1   5.233  -2.487  -6.635
    2    H2   ALA   1           2HT      ALA   1   6.078  -1.076  -7.063
    3    H3   ALA   1           3HT      ALA   1   6.759  -2.603  -7.364
    4    HA   ALA   1           HA       ALA   1   4.537  -2.905  -8.753
    5    HB1  ALA   1           3HB      ALA   1   3.418  -0.951  -8.908
    6    HB2  ALA   1           1HB      ALA   1   4.843  -0.189  -9.615
    7    HB3  ALA   1           2HB      ALA   1   4.621  -0.191  -7.865
    8    H    GLN   2           H        GLN   2   7.196  -3.704  -8.898
    9    HA   GLN   2           HA       GLN   2   9.072  -3.846 -10.357
   10    HB2  GLN   2           2HB      GLN   2   6.509  -3.716 -11.837
   11    HB3  GLN   2           1HB      GLN   2   7.955  -3.467 -12.818
   12    HG2  GLN   2           2HG      GLN   2   8.465  -5.657 -12.722
   13    HG3  GLN   2           1HG      GLN   2   8.367  -5.647 -10.960
   14   HE21  GLN   2          1HE2      GLN   2   7.390  -7.935 -12.033
   15   HE22  GLN   2          2HE2      GLN   2   5.693  -7.949 -12.056
   16    H    GLN   3           H        GLN   3   9.235  -1.399  -9.223
   17    HA   GLN   3           HA       GLN   3  10.383   0.269 -11.336
   18    HB2  GLN   3           2HB      GLN   3   7.643   0.478 -10.781
   19    HB3  GLN   3           1HB      GLN   3   8.371   1.834  -9.918
   20    HG2  GLN   3           2HG      GLN   3   9.645   1.690 -12.452
   21    HG3  GLN   3           1HG      GLN   3   7.909   1.556 -12.739
   22   HE21  GLN   3          1HE2      GLN   3   9.802   3.903 -13.196
   23   HE22  GLN   3          2HE2      GLN   3   9.095   5.193 -12.351
   24    H    ARG   4           H        ARG   4  10.936   2.524 -10.212
   25    HA   ARG   4           HA       ARG   4  12.824   2.246  -8.228
   26    HB2  ARG   4           2HB      ARG   4  10.939   4.381  -9.101
   27    HB3  ARG   4           1HB      ARG   4  11.767   4.656  -7.568
   28    HG2  ARG   4           2HG      ARG   4  13.230   3.836 -10.087
   29    HG3  ARG   4           1HG      ARG   4  12.975   5.523  -9.638
   30    HD2  ARG   4           2HD      ARG   4  13.941   4.481  -7.284
   31    HD3  ARG   4           1HD      ARG   4  14.850   3.555  -8.494
   32    HE   ARG   4           HE       ARG   4  14.676   6.409  -9.105
   33   HH11  ARG   4          1HH1      ARG   4  16.063   4.728  -6.564
   34   HH12  ARG   4          2HH1      ARG   4  17.694   5.206  -6.899
   35   HH21  ARG   4          1HH2      ARG   4  16.907   6.685  -9.941
   36   HH22  ARG   4          2HH2      ARG   4  18.173   6.319  -8.816
   37    H    LYS   5           H        LYS   5  12.732   2.607  -5.835
   38    HA   LYS   5           HA       LYS   5  10.050   2.216  -4.613
   39    HB2  LYS   5           2HB      LYS   5  11.031   0.255  -3.330
   40    HB3  LYS   5           1HB      LYS   5  10.789  -0.025  -5.054
   41    HG2  LYS   5           2HG      LYS   5  13.312   0.989  -5.079
   42    HG3  LYS   5           1HG      LYS   5  13.308   0.181  -3.512
   43    HD2  LYS   5           2HD      LYS   5  13.855  -1.651  -4.764
   44    HD3  LYS   5           1HD      LYS   5  12.113  -1.725  -5.023
   45    HE2  LYS   5           2HE      LYS   5  12.306  -0.546  -7.134
   46    HE3  LYS   5           1HE      LYS   5  14.029  -0.234  -6.850
   47    HZ1  LYS   5           3HZ      LYS   5  14.018  -2.826  -6.473
   48    HZ2  LYS   5           1HZ      LYS   5  14.196  -2.164  -8.025
   49    HZ3  LYS   5           2HZ      LYS   5  12.681  -2.747  -7.519
   50    H    VAL   6           H        VAL   6  10.615   4.439  -3.844
   51    HA   VAL   6           HA       VAL   6  12.766   4.596  -1.792
   52    HB   VAL   6           HB       VAL   6  10.798   6.790  -2.382
   53   HG11  VAL   6          1HG1      VAL   6  13.138   7.998  -2.388
   54   HG12  VAL   6          2HG1      VAL   6  13.694   6.505  -1.630
   55   HG13  VAL   6          3HG1      VAL   6  12.432   7.466  -0.861
   56   HG21  VAL   6          3HG2      VAL   6  11.158   6.458  -4.629
   57   HG22  VAL   6          1HG2      VAL   6  12.634   5.528  -4.363
   58   HG23  VAL   6          2HG2      VAL   6  12.674   7.290  -4.282
   59    H    ILE   7           H        ILE   7  12.206   5.106   0.432
   60    HA   ILE   7           HA       ILE   7  10.785   4.064   2.212
   61    HB   ILE   7           HB       ILE   7  10.226   6.903   1.348
   62   HG12  ILE   7          2HG1      ILE   7  12.473   6.052   2.303
   63   HG13  ILE   7          1HG1      ILE   7  11.760   7.470   3.070
   64   HG21  ILE   7          1HG2      ILE   7   8.275   6.595   2.559
   65   HG22  ILE   7          2HG2      ILE   7   9.382   7.003   3.866
   66   HG23  ILE   7          3HG2      ILE   7   8.967   5.318   3.556
   67   HD11  ILE   7          3HD1      ILE   7  10.966   6.204   4.921
   68   HD12  ILE   7          1HD1      ILE   7  12.606   5.618   4.640
   69   HD13  ILE   7          2HD1      ILE   7  11.224   4.674   4.083
   70    H    ARG   8           H        ARG   8   9.600   2.500   0.650
   71    HA   ARG   8           HA       ARG   8   7.008   3.318  -0.397
   72    HB2  ARG   8           2HB      ARG   8   6.901   0.951  -1.024
   73    HB3  ARG   8           1HB      ARG   8   8.515   1.580  -1.357
   74    HG2  ARG   8           2HG      ARG   8   9.329  -0.105  -0.100
   75    HG3  ARG   8           1HG      ARG   8   8.632   0.707   1.302
   76    HD2  ARG   8           2HD      ARG   8   6.992  -0.856   1.506
   77    HD3  ARG   8           1HD      ARG   8   6.649  -0.826  -0.236
   78    HE   ARG   8           HE       ARG   8   8.489  -2.399  -0.576
   79   HH11  ARG   8          1HH1      ARG   8   9.400  -1.268   2.332
   80   HH12  ARG   8          2HH1      ARG   8   9.495  -2.791   3.149
   81   HH21  ARG   8          1HH2      ARG   8   7.868  -4.541   0.636
   82   HH22  ARG   8          2HH2      ARG   8   8.620  -4.643   2.192
   83    H    CYS   9           H        CYS   9   5.007   3.003   0.514
   84    HA   CYS   9           HA       CYS   9   4.911   2.241   3.376
   85    HB2  CYS   9           2HB      CYS   9   2.825   3.438   3.310
   86    HB3  CYS   9           1HB      CYS   9   3.958   4.366   2.330
   87    H    TRP  10           H        TRP  10   3.227   0.730   4.086
   88    HA   TRP  10           HA       TRP  10   2.827  -1.544   2.231
   89    HB2  TRP  10           2HB      TRP  10   2.230  -1.052   5.168
   90    HB3  TRP  10           1HB      TRP  10   1.938  -2.575   4.352
   91    HD1  TRP  10           HD       TRP  10   3.839  -4.201   4.179
   92    HE1  TRP  10           1HE      TRP  10   6.321  -4.206   4.819
   93    HE3  TRP  10           3HE      TRP  10   4.439   0.733   5.290
   94    HZ2  TRP  10           2HZ      TRP  10   8.316  -2.336   5.697
   95    HZ3  TRP  10           3HZ      TRP  10   6.629   1.597   6.032
   96    HH2  TRP  10           HH       TRP  10   8.560   0.074   6.239
   97    H    ASN  11           H        ASN  11   0.971   0.459   4.463
   98    HA   ASN  11           HA       ASN  11  -1.592  -0.242   4.213
   99    HB2  ASN  11           2HB      ASN  11  -0.921   1.698   5.439
  100    HB3  ASN  11           1HB      ASN  11  -0.359   2.502   3.971
  101   HD21  ASN  11          1HD2      ASN  11  -3.217   1.651   5.841
  102   HD22  ASN  11          2HD2      ASN  11  -4.320   2.537   4.910
  103    H    CYS  12           H        CYS  12   0.176   1.514   1.676
  104    HA   CYS  12           HA       CYS  12  -2.055   0.819  -0.209
  105    HB2  CYS  12           2HB      CYS  12  -1.913   3.030  -1.118
  106    HB3  CYS  12           1HB      CYS  12  -1.932   3.214   0.635
  107    H    GLY  13           H        GLY  13   1.366   0.940   0.392
  108    HA2  GLY  13           2HA      GLY  13   3.071  -0.152  -0.841
  109    HA3  GLY  13           1HA      GLY  13   1.871  -0.564  -2.063
  110    H    LYS  14           H        LYS  14   3.752   2.211  -0.818
  111    HA   LYS  14           HA       LYS  14   4.441   3.038  -3.523
  112    HB2  LYS  14           2HB      LYS  14   2.071   3.705  -3.416
  113    HB3  LYS  14           1HB      LYS  14   2.394   4.634  -1.953
  114    HG2  LYS  14           2HG      LYS  14   2.364   6.106  -3.931
  115    HG3  LYS  14           1HG      LYS  14   3.970   6.062  -3.205
  116    HD2  LYS  14           2HD      LYS  14   4.707   4.419  -4.869
  117    HD3  LYS  14           1HD      LYS  14   3.092   4.390  -5.580
  118    HE2  LYS  14           2HE      LYS  14   4.119   5.946  -6.983
  119    HE3  LYS  14           1HE      LYS  14   3.518   7.037  -5.719
  120    HZ1  LYS  14           3HZ      LYS  14   6.203   6.413  -6.381
  121    HZ2  LYS  14           1HZ      LYS  14   5.895   5.967  -4.776
  122    HZ3  LYS  14           2HZ      LYS  14   5.619   7.564  -5.277
  123    H    GLU  15           H        GLU  15   6.062   4.638  -3.503
  124    HA   GLU  15           HA       GLU  15   7.580   4.958  -1.077
  125    HB2  GLU  15           2HB      GLU  15   9.109   6.006  -2.517
  126    HB3  GLU  15           1HB      GLU  15   8.198   4.993  -3.634
  127    HG2  GLU  15           2HG      GLU  15   7.946   6.937  -4.803
  128    HG3  GLU  15           1HG      GLU  15   6.664   7.253  -3.632
  129    H    GLY  16           H        GLY  16   8.191   7.201  -0.239
  130    HA2  GLY  16           2HA      GLY  16   7.442   9.609  -0.180
  131    HA3  GLY  16           1HA      GLY  16   5.793   8.992  -0.254
  132    H    HIS  17           H        HIS  17   6.159   6.809   1.584
  133    HA   HIS  17           HA       HIS  17   7.169   7.934   4.105
  134    HB2  HIS  17           2HB      HIS  17   4.838   7.858   5.117
  135    HB3  HIS  17           1HB      HIS  17   5.085   9.137   3.927
  136    HD1  HIS  17           1HD      HIS  17   4.396   8.314   1.345
  137    HD2  HIS  17           2HD      HIS  17   2.618   6.327   4.551
  138    HE1  HIS  17           1HE      HIS  17   2.340   7.159   0.420
  139    H    SER  18           H        SER  18   5.738   6.341   5.876
  140    HA   SER  18           HA       SER  18   6.507   3.589   4.981
  141    HB2  SER  18           2HB      SER  18   6.499   3.324   7.583
  142    HB3  SER  18           1HB      SER  18   7.811   4.231   6.833
  143    HG   SER  18           HG       SER  18   5.433   5.519   7.624
  144    H    ALA  19           H        ALA  19   5.126   2.200   7.017
  145    HA   ALA  19           HA       ALA  19   2.385   2.273   5.944
  146    HB1  ALA  19           3HB      ALA  19   2.987   0.094   6.228
  147    HB2  ALA  19           1HB      ALA  19   2.468   0.350   7.887
  148    HB3  ALA  19           2HB      ALA  19   4.174   0.479   7.465
  149    H    ARG  20           H        ARG  20   4.050   3.630   8.620
  150    HA   ARG  20           HA       ARG  20   1.681   3.724  10.388
  151    HB2  ARG  20           2HB      ARG  20   3.247   4.710  11.939
  152    HB3  ARG  20           1HB      ARG  20   4.095   3.405  11.109
  153    HG2  ARG  20           2HG      ARG  20   5.216   4.952   9.649
  154    HG3  ARG  20           1HG      ARG  20   4.209   6.291  10.202
  155    HD2  ARG  20           2HD      ARG  20   6.461   6.331  11.276
  156    HD3  ARG  20           1HD      ARG  20   5.178   6.075  12.477
  157    HE   ARG  20           HE       ARG  20   5.680   3.609  12.280
  158   HH11  ARG  20          1HH2      ARG  20   8.020   5.170  13.489
  159   HH12  ARG  20          2HH2      ARG  20   9.355   4.470  12.635
  160   HH21  ARG  20          1HH1      ARG  20   7.372   3.035  10.178
  161   HH22  ARG  20          2HH1      ARG  20   8.988   3.261  10.759
  162    H    GLN  21           H        GLN  21   2.016   5.183   7.635
  163    HA   GLN  21           HA       GLN  21   1.146   7.868   8.651
  164    HB2  GLN  21           2HB      GLN  21   3.180   7.037   6.608
  165    HB3  GLN  21           1HB      GLN  21   2.303   8.547   6.355
  166    HG2  GLN  21           2HG      GLN  21   3.563   7.958   9.024
  167    HG3  GLN  21           1HG      GLN  21   4.539   8.608   7.705
  168   HE21  GLN  21          1HE2      GLN  21   4.503  10.855   7.478
  169   HE22  GLN  21          2HE2      GLN  21   3.322  11.882   8.156
  170    H    CYS  22           H        CYS  22   1.035   5.498   6.000
  171    HA   CYS  22           HA       CYS  22  -1.260   6.859   4.720
  172    HB2  CYS  22           2HB      CYS  22   0.839   5.010   4.045
  173    HB3  CYS  22           1HB      CYS  22  -0.718   4.296   3.624
  174    H    ARG  23           H        ARG  23  -3.312   6.410   5.244
  175    HA   ARG  23           HA       ARG  23  -3.928   3.759   6.492
  176    HB2  ARG  23           2HB      ARG  23  -4.138   6.335   7.581
  177    HB3  ARG  23           1HB      ARG  23  -5.787   5.918   7.112
  178    HG2  ARG  23           2HG      ARG  23  -3.943   4.416   8.978
  179    HG3  ARG  23           1HG      ARG  23  -5.544   5.070   9.322
  180    HD2  ARG  23           2HD      ARG  23  -5.885   3.310   7.122
  181    HD3  ARG  23           1HD      ARG  23  -4.868   2.453   8.299
  182    HE   ARG  23           HE       ARG  23  -6.954   3.794   9.714
  183   HH11  ARG  23          1HH2      ARG  23  -7.011   1.661   7.067
  184   HH12  ARG  23          2HH2      ARG  23  -8.096   0.529   7.803
  185   HH21  ARG  23          1HH1      ARG  23  -8.117   2.140  10.873
  186   HH22  ARG  23          2HH1      ARG  23  -8.725   0.802   9.956
  187    H    ALA  24           H        ALA  24  -3.942   4.609   3.666
  188    HA   ALA  24           HA       ALA  24  -6.280   5.347   2.439
  189    HB1  ALA  24           3HB      ALA  24  -5.123   2.747   1.548
  190    HB2  ALA  24           1HB      ALA  24  -4.001   4.101   1.697
  191    HB3  ALA  24           2HB      ALA  24  -5.396   4.225   0.626
  192    HA   PRO  25           HA       PRO  25  -9.516   2.664   3.671
  193    HB2  PRO  25           2HB      PRO  25 -10.938   2.354   1.354
  194    HB3  PRO  25           1HB      PRO  25 -10.936   3.853   2.306
  195    HG2  PRO  25           2HG      PRO  25  -9.439   3.187  -0.179
  196    HG3  PRO  25           1HG      PRO  25 -10.195   4.711   0.311
  197    HD2  PRO  25           2HD      PRO  25  -7.511   4.235   0.475
  198    HD3  PRO  25           1HD      PRO  25  -8.379   5.372   1.531
  199    H    ARG  26           H        ARG  26  -8.681   1.579   0.374
  200    HA   ARG  26           HA       ARG  26  -9.309  -1.059   0.515
  201    HB2  ARG  26           2HB      ARG  26  -7.350  -1.356  -1.091
  202    HB3  ARG  26           1HB      ARG  26  -8.498  -0.083  -1.502
  203    HG2  ARG  26           2HG      ARG  26  -6.659   1.239  -1.660
  204    HG3  ARG  26           1HG      ARG  26  -6.724   1.269   0.101
  205    HD2  ARG  26           2HD      ARG  26  -4.513   0.562  -0.276
  206    HD3  ARG  26           1HD      ARG  26  -5.353  -0.994  -0.122
  207    HE   ARG  26           HE       ARG  26  -5.638  -0.340  -2.808
  208   HH11  ARG  26          1HH2      ARG  26  -2.910   0.985  -2.061
  209   HH12  ARG  26          2HH2      ARG  26  -1.824  -0.246  -2.615
  210   HH21  ARG  26          1HH1      ARG  26  -4.293  -2.665  -2.903
  211   HH22  ARG  26          2HH1      ARG  26  -2.608  -2.314  -3.092
  212    H    ARG  27           H        ARG  27  -6.056   0.165   1.411
  213    HA   ARG  27           HA       ARG  27  -4.341  -0.871   2.654
  214    HB2  ARG  27           2HB      ARG  27  -6.907  -0.803   4.106
  215    HB3  ARG  27           1HB      ARG  27  -5.679  -1.858   4.811
  216    HG2  ARG  27           2HG      ARG  27  -4.072   0.157   4.400
  217    HG3  ARG  27           1HG      ARG  27  -5.554   1.100   4.307
  218    HD2  ARG  27           2HD      ARG  27  -5.261   1.246   6.593
  219    HD3  ARG  27           1HD      ARG  27  -6.039  -0.349   6.577
  220    HE   ARG  27           HE       ARG  27  -3.386  -0.934   6.082
  221   HH11  ARG  27          1HH2      ARG  27  -3.198   1.720   7.743
  222   HH12  ARG  27          2HH2      ARG  27  -2.877   1.058   9.311
  223   HH21  ARG  27          1HH1      ARG  27  -3.774  -2.172   8.425
  224   HH22  ARG  27          2HH1      ARG  27  -3.200  -1.144   9.695
  225    H    GLN  28           H        GLN  28  -3.920  -2.988   4.042
  226    HA   GLN  28           HA       GLN  28  -5.097  -5.388   2.721
  227    HB2  GLN  28           2HB      GLN  28  -2.231  -4.447   2.696
  228    HB3  GLN  28           1HB      GLN  28  -2.580  -6.173   2.634
  229    HG2  GLN  28           2HG      GLN  28  -2.459  -5.514   0.357
  230    HG3  GLN  28           1HG      GLN  28  -4.186  -5.607   0.700
  231   HE21  GLN  28          1HE2      GLN  28  -1.857  -3.007   1.584
  232   HE22  GLN  28          2HE2      GLN  28  -2.688  -1.778   0.744
  233    H    GLY  29           H        GLY  29  -5.757  -4.671   5.213
  234    HA2  GLY  29           2HA      GLY  29  -5.543  -5.182   7.523
  235    HA3  GLY  29           1HA      GLY  29  -5.306  -6.812   6.883
  236    H    CYS  30           H        CYS  30  -3.437  -7.738   7.535
  237    HA   CYS  30           HA       CYS  30  -1.229  -6.039   8.546
  238    HB2  CYS  30           2HB      CYS  30  -2.230  -8.154   9.636
  239    HB3  CYS  30           1HB      CYS  30  -1.377  -9.049   8.381
  240    H    TRP  31           H        TRP  31   0.699  -5.790   7.419
  241    HA   TRP  31           HA       TRP  31   0.871  -6.979   4.692
  242    HB2  TRP  31           2HB      TRP  31   3.159  -5.394   5.426
  243    HB3  TRP  31           1HB      TRP  31   1.940  -5.046   4.208
  244    HD1  TRP  31           HD       TRP  31  -0.445  -3.993   5.346
  245    HE1  TRP  31           1HE      TRP  31  -0.610  -2.143   7.135
  246    HE3  TRP  31           3HE      TRP  31   4.226  -4.291   7.306
  247    HZ2  TRP  31           2HZ      TRP  31   1.046  -0.954   9.139
  248    HZ3  TRP  31           3HZ      TRP  31   4.925  -2.800   9.165
  249    HH2  TRP  31           HH       TRP  31   3.336  -1.132  10.087
  250    H    LYS  32           H        LYS  32   2.205  -7.168   7.869
  251    HA   LYS  32           HA       LYS  32   4.483  -8.868   7.089
  252    HB2  LYS  32           2HB      LYS  32   4.758  -7.233   8.838
  253    HB3  LYS  32           1HB      LYS  32   3.312  -7.803   9.671
  254    HG2  LYS  32           2HG      LYS  32   4.372  -9.915  10.194
  255    HG3  LYS  32           1HG      LYS  32   5.781  -9.497   9.213
  256    HD2  LYS  32           2HD      LYS  32   5.280  -7.374  11.074
  257    HD3  LYS  32           1HD      LYS  32   5.341  -8.903  11.953
  258    HE2  LYS  32           2HE      LYS  32   7.469  -9.333  10.430
  259    HE3  LYS  32           1HE      LYS  32   7.486  -7.561  10.342
  260    HZ1  LYS  32           3HZ      LYS  32   8.486  -8.970  12.402
  261    HZ2  LYS  32           1HZ      LYS  32   6.918  -8.643  12.963
  262    HZ3  LYS  32           2HZ      LYS  32   7.942  -7.363  12.516
  263    H    CYS  33           H        CYS  33   1.251  -9.410   7.256
  264    HA   CYS  33           HA       CYS  33   1.661 -12.264   8.031
  265    HB2  CYS  33           2HB      CYS  33  -0.541 -10.489   9.136
  266    HB3  CYS  33           1HB      CYS  33  -0.217 -12.162   9.582
  267    H    GLY  34           H        GLY  34  -0.505  -9.789   6.640
  268    HA2  GLY  34           2HA      GLY  34  -1.464 -10.115   4.420
  269    HA3  GLY  34           1HA      GLY  34  -1.405 -11.854   4.692
  270    H    LYS  35           H        LYS  35  -2.562 -11.574   7.435
  271    HA   LYS  35           HA       LYS  35  -5.252 -12.105   6.971
  272    HB2  LYS  35           2HB      LYS  35  -3.594 -11.088   9.204
  273    HB3  LYS  35           1HB      LYS  35  -5.334 -10.885   9.395
  274    HG2  LYS  35           2HG      LYS  35  -4.510 -13.535   8.385
  275    HG3  LYS  35           1HG      LYS  35  -3.982 -13.177  10.030
  276    HD2  LYS  35           2HD      LYS  35  -6.102 -13.225  10.858
  277    HD3  LYS  35           1HD      LYS  35  -6.778 -12.426   9.439
  278    HE2  LYS  35           2HE      LYS  35  -7.506 -14.851   9.748
  279    HE3  LYS  35           1HE      LYS  35  -6.752 -14.504   8.179
  280    HZ1  LYS  35           3HZ      LYS  35  -5.117 -15.302  10.502
  281    HZ2  LYS  35           1HZ      LYS  35  -4.735 -15.398   8.854
  282    HZ3  LYS  35           2HZ      LYS  35  -5.859 -16.478   9.527
  283    H    THR  36           H        THR  36  -7.097 -10.576   7.894
  284    HA   THR  36           HA       THR  36  -6.841  -7.954   6.473
  285    HB   THR  36           HB       THR  36  -9.228  -8.160   6.134
  286    HG1  THR  36           1HG      THR  36 -10.108 -10.259   7.047
  287   HG21  THR  36          3HG2      THR  36  -8.998 -10.889   5.515
  288   HG22  THR  36          1HG2      THR  36  -7.360 -10.246   5.392
  289   HG23  THR  36          2HG2      THR  36  -8.662  -9.529   4.442
  290    H    GLY  37           H        GLY  37  -9.077  -9.078   9.001
  291    HA2  GLY  37           2HA      GLY  37  -9.367  -6.640  10.329
  292    HA3  GLY  37           1HA      GLY  37  -9.530  -8.199  11.138
  293    H    HIS  38           H        HIS  38  -7.054  -9.237  11.207
  294    HA   HIS  38           HA       HIS  38  -5.668  -7.502  13.104
  295    HB2  HIS  38           2HB      HIS  38  -4.983  -9.522  13.846
  296    HB3  HIS  38           1HB      HIS  38  -5.991 -10.234  12.597
  297    HD1  HIS  38           1HD      HIS  38  -4.560 -12.137  11.807
  298    HD2  HIS  38           2HD      HIS  38  -2.416  -8.569  11.998
  299    HE1  HIS  38           1HE      HIS  38  -2.284 -12.617  10.807
  300    H    VAL  39           H        VAL  39  -3.996  -6.149  12.655
  301    HA   VAL  39           HA       VAL  39  -2.664  -6.382   9.972
  302    HB   VAL  39           HB       VAL  39  -2.551  -3.913  10.067
  303   HG11  VAL  39          1HG1      VAL  39  -5.390  -4.451  10.785
  304   HG12  VAL  39          2HG1      VAL  39  -4.714  -5.392   9.455
  305   HG13  VAL  39          3HG1      VAL  39  -4.724  -3.629   9.374
  306   HG21  VAL  39          3HG2      VAL  39  -4.392  -3.720  12.367
  307   HG22  VAL  39          1HG2      VAL  39  -2.992  -2.724  11.961
  308   HG23  VAL  39          2HG2      VAL  39  -2.769  -4.267  12.786
  309    H    MET  40           H        MET  40  -0.620  -4.555  10.372
  310    HA   MET  40           HA       MET  40   1.366  -5.996  11.753
  311    HB2  MET  40           2HB      MET  40   2.710  -4.088  11.353
  312    HB3  MET  40           1HB      MET  40   1.482  -4.006  10.093
  313    HG2  MET  40           2HG      MET  40   1.159  -2.575  12.737
  314    HG3  MET  40           1HG      MET  40   1.974  -1.836  11.363
  315    HE1  MET  40           3HE      MET  40   0.262   0.165  10.591
  316    HE2  MET  40           1HE      MET  40   0.161  -0.228  12.313
  317    HE3  MET  40           2HE      MET  40  -1.310   0.041  11.379
  318    H    ALA  41           H        ALA  41  -0.843  -3.484  12.967
  319    HA   ALA  41           HA       ALA  41   0.290  -3.101  15.559
  320    HB1  ALA  41           3HB      ALA  41  -1.517  -1.746  14.515
  321    HB2  ALA  41           1HB      ALA  41  -2.019  -2.359  16.091
  322    HB3  ALA  41           2HB      ALA  41  -2.602  -3.134  14.618
  323    H    LYS  42           H        LYS  42  -1.437  -5.705  14.109
  324    HA   LYS  42           HA       LYS  42  -1.257  -7.301  16.601
  325    HB2  LYS  42           2HB      LYS  42  -3.618  -6.042  15.401
  326    HB3  LYS  42           1HB      LYS  42  -3.813  -7.786  15.656
  327    HG2  LYS  42           2HG      LYS  42  -2.600  -6.199  17.873
  328    HG3  LYS  42           1HG      LYS  42  -4.327  -5.992  17.589
  329    HD2  LYS  42           2HD      LYS  42  -4.827  -8.181  18.148
  330    HD3  LYS  42           1HD      LYS  42  -3.237  -8.776  17.669
  331    HE2  LYS  42           2HE      LYS  42  -2.840  -8.822  19.927
  332    HE3  LYS  42           1HE      LYS  42  -2.591  -7.076  19.738
  333    HZ1  LYS  42           3HZ      LYS  42  -5.183  -8.415  20.316
  334    HZ2  LYS  42           1HZ      LYS  42  -4.976  -6.749  20.074
  335    HZ3  LYS  42           2HZ      LYS  42  -4.268  -7.506  21.420
  336    H    CYS  43           H        CYS  43   0.366  -7.923  14.671
  337    HA   CYS  43           HA       CYS  43  -0.500  -9.301  12.366
  338    HB2  CYS  43           2HB      CYS  43   1.713  -8.342  13.289
  339    HB3  CYS  43           1HB      CYS  43   1.946  -9.934  13.971
  340    HA   PRO  44           HA       PRO  44  -1.183 -13.552  13.748
  341    HB2  PRO  44           2HB      PRO  44   0.806 -14.991  14.987
  342    HB3  PRO  44           1HB      PRO  44   0.689 -14.808  13.224
  343    HG2  PRO  44           2HG      PRO  44   2.368 -13.290  15.171
  344    HG3  PRO  44           1HG      PRO  44   2.810 -13.966  13.593
  345    HD2  PRO  44           2HD      PRO  44   2.290 -11.390  13.876
  346    HD3  PRO  44           1HD      PRO  44   1.775 -12.261  12.422
  347    H    GLU  45           H        GLU  45  -2.411 -12.200  15.297
  348    HA   GLU  45           HA       GLU  45  -2.249 -13.230  18.013
  349    HB2  GLU  45           2HB      GLU  45  -1.919 -10.709  18.805
  350    HB3  GLU  45           1HB      GLU  45  -0.525 -11.723  18.437
  351    HG2  GLU  45           2HG      GLU  45  -0.382 -10.782  16.186
  352    HG3  GLU  45           1HG      GLU  45  -1.850  -9.841  16.455
  353    H    ARG  46           H        ARG  46  -4.485 -13.633  17.840
  354    HA   ARG  46           HA       ARG  46  -6.780 -13.077  18.032
  355    HB2  ARG  46           2HB      ARG  46  -5.851 -10.206  18.197
  356    HB3  ARG  46           1HB      ARG  46  -7.233 -10.955  18.995
  357    HG2  ARG  46           2HG      ARG  46  -4.995 -12.436  19.845
  358    HG3  ARG  46           1HG      ARG  46  -4.492 -10.746  19.916
  359    HD2  ARG  46           2HD      ARG  46  -5.514 -10.965  22.003
  360    HD3  ARG  46           1HD      ARG  46  -6.908 -10.455  21.030
  361    HE   ARG  46           HE       ARG  46  -6.272 -13.333  21.565
  362   HH11  ARG  46          1HH2      ARG  46  -8.391 -10.890  22.363
  363   HH12  ARG  46          2HH2      ARG  46  -9.835 -11.747  21.938
  364   HH21  ARG  46          1HH1      ARG  46  -8.144 -14.378  20.439
  365   HH22  ARG  46          2HH1      ARG  46  -9.694 -13.725  20.849
  366    H    GLN  47           H        GLN  47  -7.859 -13.320  16.103
  367    HA   GLN  47           HA       GLN  47  -7.233 -11.445  13.862
  368    HB2  GLN  47           2HB      GLN  47  -8.111 -13.182  12.464
  369    HB3  GLN  47           1HB      GLN  47  -7.144 -14.001  13.690
  370    HG2  GLN  47           2HG      GLN  47  -9.290 -14.258  15.039
  371    HG3  GLN  47           1HG      GLN  47 -10.156 -13.725  13.598
  372   HE21  GLN  47          1HE2      GLN  47 -10.077 -15.135  11.681
  373   HE22  GLN  47          2HE2      GLN  47  -9.627 -16.766  11.823
  374    H    ALA  48           H        ALA  48  -9.561 -11.997  16.298
  375    HA   ALA  48           HA       ALA  48 -11.826 -10.888  14.742
  376    HB1  ALA  48           3HB      ALA  48 -11.431 -12.608  16.968
  377    HB2  ALA  48           1HB      ALA  48 -12.967 -12.128  16.245
  378    HB3  ALA  48           2HB      ALA  48 -12.285 -11.188  17.573
  379    H    GLY  49           H        GLY  49 -13.100  -9.096  15.987
  380    HA2  GLY  49           2HA      GLY  49 -11.246  -6.875  16.445
  381    HA3  GLY  49           1HA      GLY  49 -13.009  -6.768  16.436
  Start of MODEL    9
    1    H1   ALA   1           1HT      ALA   1  18.801  12.866  19.487
    2    H2   ALA   1           2HT      ALA   1  18.757  13.607  17.959
    3    H3   ALA   1           3HT      ALA   1  20.238  13.095  18.615
    4    HA   ALA   1           HA       ALA   1  19.886  10.905  18.119
    5    HB1  ALA   1           3HB      ALA   1  17.735   9.906  18.345
    6    HB2  ALA   1           1HB      ALA   1  16.911  11.441  18.070
    7    HB3  ALA   1           2HB      ALA   1  17.774  11.163  19.582
    8    H    GLN   2           H        GLN   2  18.972   9.740  16.096
    9    HA   GLN   2           HA       GLN   2  18.359  11.673  13.895
   10    HB2  GLN   2           2HB      GLN   2  20.005  10.037  12.595
   11    HB3  GLN   2           1HB      GLN   2  20.639  11.385  13.535
   12    HG2  GLN   2           2HG      GLN   2  21.825   9.217  13.975
   13    HG3  GLN   2           1HG      GLN   2  21.103   9.926  15.420
   14   HE21  GLN   2          1HE2      GLN   2  20.755   7.300  13.044
   15   HE22  GLN   2          2HE2      GLN   2  19.647   6.396  13.957
   16    H    GLN   3           H        GLN   3  17.390  10.594  11.994
   17    HA   GLN   3           HA       GLN   3  16.126   7.961  12.676
   18    HB2  GLN   3           2HB      GLN   3  14.070   8.801  11.851
   19    HB3  GLN   3           1HB      GLN   3  14.741  10.150  12.767
   20    HG2  GLN   3           2HG      GLN   3  15.860  10.694  10.399
   21    HG3  GLN   3           1HG      GLN   3  14.439   9.821   9.821
   22   HE21  GLN   3          1HE2      GLN   3  12.407  10.584  11.486
   23   HE22  GLN   3          2HE2      GLN   3  12.202  12.268  11.478
   24    H    ARG   4           H        ARG   4  15.250   6.909  10.568
   25    HA   ARG   4           HA       ARG   4  17.423   7.024   8.531
   26    HB2  ARG   4           2HB      ARG   4  15.317   5.042   9.391
   27    HB3  ARG   4           1HB      ARG   4  16.170   4.841   7.860
   28    HG2  ARG   4           2HG      ARG   4  17.966   4.009   8.926
   29    HG3  ARG   4           1HG      ARG   4  18.075   5.458   9.927
   30    HD2  ARG   4           2HD      ARG   4  15.896   4.105  11.009
   31    HD3  ARG   4           1HD      ARG   4  17.047   2.810  10.628
   32    HE   ARG   4           HE       ARG   4  17.527   5.047  12.501
   33   HH11  ARG   4          1HH1      ARG   4  18.068   2.114  13.042
   34   HH12  ARG   4          2HH1      ARG   4  19.795   2.057  12.927
   35   HH21  ARG   4          1HH2      ARG   4  20.051   5.115  11.311
   36   HH22  ARG   4          2HH2      ARG   4  20.919   3.758  11.948
   37    H    LYS   5           H        LYS   5  16.629   8.935   7.392
   38    HA   LYS   5           HA       LYS   5  15.349  10.021   5.725
   39    HB2  LYS   5           2HB      LYS   5  14.817   7.073   5.308
   40    HB3  LYS   5           1HB      LYS   5  14.161   8.295   4.219
   41    HG2  LYS   5           2HG      LYS   5  16.992   8.735   4.769
   42    HG3  LYS   5           1HG      LYS   5  16.698   7.149   4.053
   43    HD2  LYS   5           2HD      LYS   5  15.430   8.191   2.223
   44    HD3  LYS   5           1HD      LYS   5  15.680   9.782   2.943
   45    HE2  LYS   5           2HE      LYS   5  18.092   8.084   2.376
   46    HE3  LYS   5           1HE      LYS   5  17.309   8.938   1.031
   47    HZ1  LYS   5           3HZ      LYS   5  17.683  10.974   1.972
   48    HZ2  LYS   5           1HZ      LYS   5  19.065  10.156   2.516
   49    HZ3  LYS   5           2HZ      LYS   5  17.740  10.368   3.558
   50    H    VAL   6           H        VAL   6  12.996  10.389   5.029
   51    HA   VAL   6           HA       VAL   6  11.301  10.618   7.347
   52    HB   VAL   6           HB       VAL   6  10.479  10.740   4.437
   53   HG11  VAL   6          1HG1      VAL   6   8.992  11.080   6.668
   54   HG12  VAL   6          2HG1      VAL   6   8.697  11.978   5.178
   55   HG13  VAL   6          3HG1      VAL   6   9.624  12.716   6.486
   56   HG21  VAL   6          3HG2      VAL   6  11.158  13.253   4.834
   57   HG22  VAL   6          1HG2      VAL   6  12.395  12.083   4.375
   58   HG23  VAL   6          2HG2      VAL   6  12.225  12.570   6.062
   59    H    ILE   7           H        ILE   7  10.074   9.022   8.232
   60    HA   ILE   7           HA       ILE   7   9.864   6.408   7.597
   61    HB   ILE   7           HB       ILE   7   8.746   8.062   9.399
   62   HG12  ILE   7          2HG1      ILE   7   9.133   5.527   9.428
   63   HG13  ILE   7          1HG1      ILE   7   7.778   6.127  10.382
   64   HG21  ILE   7          1HG2      ILE   7   6.269   7.913   9.190
   65   HG22  ILE   7          2HG2      ILE   7   6.471   7.217   7.582
   66   HG23  ILE   7          3HG2      ILE   7   6.988   8.873   7.897
   67   HD11  ILE   7          3HD1      ILE   7   7.672   4.163   8.380
   68   HD12  ILE   7          1HD1      ILE   7   6.962   5.600   7.646
   69   HD13  ILE   7          2HD1      ILE   7   6.298   4.959   9.149
   70    H    ARG   8           H        ARG   8   9.142   5.256   5.846
   71    HA   ARG   8           HA       ARG   8   7.638   6.635   3.724
   72    HB2  ARG   8           2HB      ARG   8   9.622   4.900   3.632
   73    HB3  ARG   8           1HB      ARG   8   8.323   3.713   3.758
   74    HG2  ARG   8           2HG      ARG   8   7.433   4.256   1.699
   75    HG3  ARG   8           1HG      ARG   8   7.991   5.929   1.782
   76    HD2  ARG   8           2HD      ARG   8   9.978   5.428   0.780
   77    HD3  ARG   8           1HD      ARG   8  10.173   3.935   1.720
   78    HE   ARG   8           HE       ARG   8   8.068   3.326   0.063
   79   HH11  ARG   8          1HH1      ARG   8  10.145   5.525  -1.226
   80   HH12  ARG   8          2HH1      ARG   8  10.794   4.501  -2.462
   81   HH21  ARG   8          1HH2      ARG   8   9.358   1.612  -1.192
   82   HH22  ARG   8          2HH2      ARG   8  10.348   2.285  -2.442
   83    H    CYS   9           H        CYS   9   5.436   6.750   3.916
   84    HA   CYS   9           HA       CYS   9   3.751   5.400   5.677
   85    HB2  CYS   9           2HB      CYS   9   3.100   7.288   4.257
   86    HB3  CYS   9           1HB      CYS   9   3.266   6.284   2.813
   87    H    TRP  10           H        TRP  10   4.044   3.170   5.935
   88    HA   TRP  10           HA       TRP  10   4.490   1.312   3.777
   89    HB2  TRP  10           2HB      TRP  10   5.190   0.768   5.993
   90    HB3  TRP  10           1HB      TRP  10   3.607   1.123   6.668
   91    HD1  TRP  10           HD       TRP  10   5.674  -1.638   5.526
   92    HE1  TRP  10           1HE      TRP  10   4.298  -3.800   5.239
   93    HE3  TRP  10           3HE      TRP  10   0.948   0.278   5.708
   94    HZ2  TRP  10           2HZ      TRP  10   1.552  -4.586   5.116
   95    HZ3  TRP  10           3HZ      TRP  10  -1.010  -1.180   5.529
   96    HH2  TRP  10           HH       TRP  10  -0.715  -3.594   5.243
   97    H    ASN  11           H        ASN  11   1.618   2.748   5.125
   98    HA   ASN  11           HA       ASN  11  -0.252   0.691   4.341
   99    HB2  ASN  11           2HB      ASN  11  -0.792   2.275   6.057
  100    HB3  ASN  11           1HB      ASN  11  -0.441   3.637   4.994
  101   HD21  ASN  11          1HD2      ASN  11  -2.476   0.661   4.709
  102   HD22  ASN  11          2HD2      ASN  11  -3.851   1.487   4.156
  103    H    CYS  12           H        CYS  12   0.974   3.619   2.734
  104    HA   CYS  12           HA       CYS  12  -0.405   2.674   0.252
  105    HB2  CYS  12           2HB      CYS  12  -1.117   4.882  -0.165
  106    HB3  CYS  12           1HB      CYS  12  -1.347   4.681   1.568
  107    H    GLY  13           H        GLY  13   2.522   3.313   1.730
  108    HA2  GLY  13           2HA      GLY  13   4.701   3.261   0.853
  109    HA3  GLY  13           1HA      GLY  13   3.998   3.034  -0.747
  110    H    LYS  14           H        LYS  14   4.573   5.552   1.720
  111    HA   LYS  14           HA       LYS  14   5.499   7.410  -0.334
  112    HB2  LYS  14           2HB      LYS  14   2.800   7.222  -0.093
  113    HB3  LYS  14           1HB      LYS  14   3.134   8.468   1.110
  114    HG2  LYS  14           2HG      LYS  14   4.146   8.549  -1.746
  115    HG3  LYS  14           1HG      LYS  14   2.711   9.401  -1.178
  116    HD2  LYS  14           2HD      LYS  14   3.960  10.832   0.216
  117    HD3  LYS  14           1HD      LYS  14   5.368   9.772   0.197
  118    HE2  LYS  14           2HE      LYS  14   4.908  10.409  -2.507
  119    HE3  LYS  14           1HE      LYS  14   4.710  11.934  -1.621
  120    HZ1  LYS  14           3HZ      LYS  14   7.028  10.102  -1.639
  121    HZ2  LYS  14           1HZ      LYS  14   6.771  11.159  -0.337
  122    HZ3  LYS  14           2HZ      LYS  14   6.999  11.779  -1.903
  123    H    GLU  15           H        GLU  15   7.152   8.405   0.725
  124    HA   GLU  15           HA       GLU  15   7.666   8.432   3.490
  125    HB2  GLU  15           2HB      GLU  15   8.504   9.904   1.057
  126    HB3  GLU  15           1HB      GLU  15   8.876  10.697   2.589
  127    HG2  GLU  15           2HG      GLU  15  10.465   9.170   3.120
  128    HG3  GLU  15           1HG      GLU  15   9.465   7.818   2.588
  129    H    GLY  16           H        GLY  16   7.165   9.886   5.166
  130    HA2  GLY  16           2HA      GLY  16   6.348  12.349   5.486
  131    HA3  GLY  16           1HA      GLY  16   4.947  11.788   4.575
  132    H    HIS  17           H        HIS  17   4.828   9.154   5.732
  133    HA   HIS  17           HA       HIS  17   4.600   9.472   8.646
  134    HB2  HIS  17           2HB      HIS  17   2.096   9.117   8.529
  135    HB3  HIS  17           1HB      HIS  17   2.636  10.676   7.905
  136    HD1  HIS  17           1HD      HIS  17   2.680  10.967   5.287
  137    HD2  HIS  17           2HD      HIS  17   0.955   7.406   6.598
  138    HE1  HIS  17           1HE      HIS  17   1.457   9.990   3.298
  139    H    SER  18           H        SER  18   3.376   7.397   9.514
  140    HA   SER  18           HA       SER  18   4.610   5.067   8.181
  141    HB2  SER  18           2HB      SER  18   3.309   4.139  10.389
  142    HB3  SER  18           1HB      SER  18   4.925   4.850  10.434
  143    HG   SER  18           HG       SER  18   2.474   6.263  10.744
  144    H    ALA  19           H        ALA  19   2.865   3.027   8.831
  145    HA   ALA  19           HA       ALA  19   0.703   3.431   6.854
  146    HB1  ALA  19           3HB      ALA  19   0.444   0.898   7.412
  147    HB2  ALA  19           1HB      ALA  19   1.940   1.098   8.327
  148    HB3  ALA  19           2HB      ALA  19   1.913   1.422   6.596
  149    H    ARG  20           H        ARG  20   1.078   2.746  10.327
  150    HA   ARG  20           HA       ARG  20  -1.621   2.188  10.986
  151    HB2  ARG  20           2HB      ARG  20  -0.911   3.059  13.234
  152    HB3  ARG  20           1HB      ARG  20   0.262   1.944  12.532
  153    HG2  ARG  20           2HG      ARG  20   1.006   4.447  11.535
  154    HG3  ARG  20           1HG      ARG  20   0.582   4.752  13.219
  155    HD2  ARG  20           2HD      ARG  20   2.010   2.518  13.600
  156    HD3  ARG  20           1HD      ARG  20   2.787   3.070  12.103
  157    HE   ARG  20           HE       ARG  20   3.655   4.918  13.301
  158   HH11  ARG  20          1HH2      ARG  20   3.190   3.046  15.734
  159   HH12  ARG  20          2HH2      ARG  20   2.436   4.153  16.832
  160   HH21  ARG  20          1HH1      ARG  20   1.763   6.526  14.394
  161   HH22  ARG  20          2HH1      ARG  20   1.625   6.122  16.073
  162    H    GLN  21           H        GLN  21  -0.063   5.163  10.052
  163    HA   GLN  21           HA       GLN  21  -2.287   6.867  11.000
  164    HB2  GLN  21           2HB      GLN  21   0.094   7.565  11.110
  165    HB3  GLN  21           1HB      GLN  21   0.199   7.442   9.352
  166    HG2  GLN  21           2HG      GLN  21  -0.712   9.483   9.095
  167    HG3  GLN  21           1HG      GLN  21  -2.091   9.041  10.101
  168   HE21  GLN  21          1HE2      GLN  21  -2.132   9.808  12.267
  169   HE22  GLN  21          2HE2      GLN  21  -0.882  10.743  12.953
  170    H    CYS  22           H        CYS  22  -0.828   5.872   7.882
  171    HA   CYS  22           HA       CYS  22  -2.990   7.142   6.349
  172    HB2  CYS  22           2HB      CYS  22  -0.340   6.240   5.935
  173    HB3  CYS  22           1HB      CYS  22  -1.361   5.247   4.895
  174    H    ARG  23           H        ARG  23  -4.803   6.111   5.623
  175    HA   ARG  23           HA       ARG  23  -5.139   3.219   6.295
  176    HB2  ARG  23           2HB      ARG  23  -6.689   5.628   6.554
  177    HB3  ARG  23           1HB      ARG  23  -7.551   4.518   5.490
  178    HG2  ARG  23           2HG      ARG  23  -6.357   3.396   7.986
  179    HG3  ARG  23           1HG      ARG  23  -7.814   4.381   8.141
  180    HD2  ARG  23           2HD      ARG  23  -8.113   2.563   5.915
  181    HD3  ARG  23           1HD      ARG  23  -7.690   1.665   7.384
  182    HE   ARG  23           HE       ARG  23  -9.727   3.748   7.761
  183   HH11  ARG  23          1HH1      ARG  23 -10.040   1.097   5.903
  184   HH12  ARG  23          2HH1      ARG  23 -11.089   0.203   6.953
  185   HH21  ARG  23          1HH2      ARG  23 -10.618   2.325   9.659
  186   HH22  ARG  23          2HH2      ARG  23 -11.417   0.900   9.083
  187    H    ALA  24           H        ALA  24  -4.380   5.200   3.709
  188    HA   ALA  24           HA       ALA  24  -4.681   5.059   1.363
  189    HB1  ALA  24           3HB      ALA  24  -3.900   2.888   0.641
  190    HB2  ALA  24           1HB      ALA  24  -4.532   2.116   2.098
  191    HB3  ALA  24           2HB      ALA  24  -3.145   3.197   2.204
  192    HA   PRO  25           HA       PRO  25  -8.770   3.645   0.306
  193    HB2  PRO  25           2HB      PRO  25  -9.051   1.080  -0.628
  194    HB3  PRO  25           1HB      PRO  25  -8.412   2.406  -1.620
  195    HG2  PRO  25           2HG      PRO  25  -6.965   0.234  -0.203
  196    HG3  PRO  25           1HG      PRO  25  -6.626   0.983  -1.770
  197    HD2  PRO  25           2HD      PRO  25  -5.265   1.554   0.511
  198    HD3  PRO  25           1HD      PRO  25  -5.433   2.698  -0.836
  199    H    ARG  26           H        ARG  26  -8.514   0.237   1.002
  200    HA   ARG  26           HA       ARG  26 -10.066   0.634   3.423
  201    HB2  ARG  26           2HB      ARG  26 -11.088  -1.209   2.626
  202    HB3  ARG  26           1HB      ARG  26  -9.969  -1.191   1.268
  203    HG2  ARG  26           2HG      ARG  26  -9.770  -3.352   2.284
  204    HG3  ARG  26           1HG      ARG  26  -8.330  -2.446   2.754
  205    HD2  ARG  26           2HD      ARG  26  -8.919  -3.128   4.871
  206    HD3  ARG  26           1HD      ARG  26 -10.056  -1.768   4.776
  207    HE   ARG  26           HE       ARG  26 -11.822  -3.316   4.258
  208   HH11  ARG  26          1HH2      ARG  26 -10.440  -5.206   2.467
  209   HH12  ARG  26          2HH2      ARG  26 -10.287  -6.629   3.444
  210   HH21  ARG  26          1HH1      ARG  26 -10.895  -4.966   6.426
  211   HH22  ARG  26          2HH1      ARG  26 -10.548  -6.493   5.687
  212    H    ARG  27           H        ARG  27  -6.896  -0.353   2.406
  213    HA   ARG  27           HA       ARG  27  -5.015  -0.118   4.105
  214    HB2  ARG  27           2HB      ARG  27  -7.059  -1.717   5.657
  215    HB3  ARG  27           1HB      ARG  27  -5.355  -1.763   6.065
  216    HG2  ARG  27           2HG      ARG  27  -6.679   0.904   5.723
  217    HG3  ARG  27           1HG      ARG  27  -6.897   0.009   7.229
  218    HD2  ARG  27           2HD      ARG  27  -4.151   0.488   6.041
  219    HD3  ARG  27           1HD      ARG  27  -4.898   1.610   7.196
  220    HE   ARG  27           HE       ARG  27  -4.215  -1.236   7.777
  221   HH11  ARG  27          1HH2      ARG  27  -6.620  -0.333   9.289
  222   HH12  ARG  27          2HH2      ARG  27  -5.928   0.325  10.732
  223   HH21  ARG  27          1HH1      ARG  27  -2.733   0.569   9.405
  224   HH22  ARG  27          2HH1      ARG  27  -3.726   0.836  10.799
  225    H    GLN  28           H        GLN  28  -3.899  -2.334   5.043
  226    HA   GLN  28           HA       GLN  28  -4.159  -4.371   2.855
  227    HB2  GLN  28           2HB      GLN  28  -1.845  -2.838   3.956
  228    HB3  GLN  28           1HB      GLN  28  -1.550  -4.515   3.494
  229    HG2  GLN  28           2HG      GLN  28  -1.133  -2.941   1.613
  230    HG3  GLN  28           1HG      GLN  28  -2.432  -4.079   1.250
  231   HE21  GLN  28          1HE2      GLN  28  -2.364  -0.997   3.136
  232   HE22  GLN  28          2HE2      GLN  28  -3.641  -0.271   2.267
  233    H    GLY  29           H        GLY  29  -5.233  -5.964   4.043
  234    HA2  GLY  29           2HA      GLY  29  -5.177  -6.637   6.697
  235    HA3  GLY  29           1HA      GLY  29  -5.241  -7.874   5.444
  236    H    CYS  30           H        CYS  30  -3.009  -8.427   4.474
  237    HA   CYS  30           HA       CYS  30  -1.267  -9.385   6.506
  238    HB2  CYS  30           2HB      CYS  30  -1.586  -9.982   3.989
  239    HB3  CYS  30           1HB      CYS  30  -0.410  -8.701   3.697
  240    H    TRP  31           H        TRP  31   0.838  -8.605   7.168
  241    HA   TRP  31           HA       TRP  31   1.402  -5.766   6.433
  242    HB2  TRP  31           2HB      TRP  31   0.538  -6.816   8.927
  243    HB3  TRP  31           1HB      TRP  31   2.223  -6.318   9.120
  244    HD1  TRP  31           HD       TRP  31  -1.169  -4.944   7.969
  245    HE1  TRP  31           1HE      TRP  31  -1.136  -2.371   8.173
  246    HE3  TRP  31           3HE      TRP  31   3.689  -4.258   9.303
  247    HZ2  TRP  31           2HZ      TRP  31   0.739  -0.300   8.822
  248    HZ3  TRP  31           3HZ      TRP  31   4.586  -1.982   9.707
  249    HH2  TRP  31           HH       TRP  31   3.114  -0.001   9.468
  250    H    LYS  32           H        LYS  32   2.503  -8.613   5.829
  251    HA   LYS  32           HA       LYS  32   5.367  -7.916   6.367
  252    HB2  LYS  32           2HB      LYS  32   4.220  -9.875   7.647
  253    HB3  LYS  32           1HB      LYS  32   4.290 -10.726   6.102
  254    HG2  LYS  32           2HG      LYS  32   6.796  -9.380   6.932
  255    HG3  LYS  32           1HG      LYS  32   6.309 -10.758   7.923
  256    HD2  LYS  32           2HD      LYS  32   5.882 -11.526   5.234
  257    HD3  LYS  32           1HD      LYS  32   7.470 -10.759   5.283
  258    HE2  LYS  32           2HE      LYS  32   7.961 -12.219   7.331
  259    HE3  LYS  32           1HE      LYS  32   6.502 -13.132   6.898
  260    HZ1  LYS  32           3HZ      LYS  32   9.036 -12.899   5.465
  261    HZ2  LYS  32           1HZ      LYS  32   7.627 -12.933   4.521
  262    HZ3  LYS  32           2HZ      LYS  32   7.970 -14.219   5.578
  263    H    CYS  33           H        CYS  33   2.986  -8.271   4.054
  264    HA   CYS  33           HA       CYS  33   5.014  -8.634   1.901
  265    HB2  CYS  33           2HB      CYS  33   2.364 -10.106   1.987
  266    HB3  CYS  33           1HB      CYS  33   3.697 -10.364   0.861
  267    H    GLY  34           H        GLY  34   1.493  -8.150   2.455
  268    HA2  GLY  34           2HA      GLY  34   0.384  -6.052   1.889
  269    HA3  GLY  34           1HA      GLY  34   1.652  -5.748   0.704
  270    H    LYS  35           H        LYS  35  -1.049  -7.998   1.375
  271    HA   LYS  35           HA       LYS  35  -1.691  -7.936  -1.523
  272    HB2  LYS  35           2HB      LYS  35  -0.278 -10.022  -0.195
  273    HB3  LYS  35           1HB      LYS  35  -1.875 -10.643  -0.617
  274    HG2  LYS  35           2HG      LYS  35  -0.904  -9.100  -2.824
  275    HG3  LYS  35           1HG      LYS  35   0.360 -10.234  -2.344
  276    HD2  LYS  35           2HD      LYS  35  -1.154 -11.262  -3.994
  277    HD3  LYS  35           1HD      LYS  35  -1.270 -12.088  -2.440
  278    HE2  LYS  35           2HE      LYS  35  -3.515 -11.583  -3.519
  279    HE3  LYS  35           1HE      LYS  35  -3.325 -10.886  -1.898
  280    HZ1  LYS  35           3HZ      LYS  35  -2.938  -8.796  -2.734
  281    HZ2  LYS  35           1HZ      LYS  35  -4.067  -9.373  -3.859
  282    HZ3  LYS  35           2HZ      LYS  35  -2.414  -9.369  -4.246
  283    H    THR  36           H        THR  36  -2.806  -7.653   1.548
  284    HA   THR  36           HA       THR  36  -4.946  -7.765   2.499
  285    HB   THR  36           HB       THR  36  -6.605  -6.940   1.039
  286    HG1  THR  36           1HG      THR  36  -5.257  -8.046  -1.175
  287   HG21  THR  36          3HG2      THR  36  -5.494  -5.160   0.185
  288   HG22  THR  36          1HG2      THR  36  -4.479  -6.176  -0.839
  289   HG23  THR  36          2HG2      THR  36  -4.053  -5.927   0.854
  290    H    GLY  37           H        GLY  37  -7.035  -9.121   2.522
  291    HA2  GLY  37           2HA      GLY  37  -8.108 -11.213   2.496
  292    HA3  GLY  37           1HA      GLY  37  -7.173 -11.591   1.048
  293    H    HIS  38           H        HIS  38  -4.714 -11.911   1.601
  294    HA   HIS  38           HA       HIS  38  -4.583 -14.069   3.592
  295    HB2  HIS  38           2HB      HIS  38  -2.906 -14.758   2.220
  296    HB3  HIS  38           1HB      HIS  38  -3.456 -13.488   1.134
  297    HD1  HIS  38           1HD      HIS  38  -1.472 -12.223   0.312
  298    HD2  HIS  38           2HD      HIS  38  -1.083 -13.287   4.316
  299    HE1  HIS  38           1HE      HIS  38   0.743 -11.265   1.088
  300    H    VAL  39           H        VAL  39  -3.234 -14.012   5.479
  301    HA   VAL  39           HA       VAL  39  -2.578 -11.234   6.383
  302    HB   VAL  39           HB       VAL  39  -2.954 -12.162   8.633
  303   HG11  VAL  39          1HG1      VAL  39  -4.900 -12.008   6.516
  304   HG12  VAL  39          2HG1      VAL  39  -5.104 -11.636   8.228
  305   HG13  VAL  39          3HG1      VAL  39  -5.367 -13.280   7.646
  306   HG21  VAL  39          3HG2      VAL  39  -3.667 -14.483   8.916
  307   HG22  VAL  39          1HG2      VAL  39  -2.099 -14.453   8.109
  308   HG23  VAL  39          2HG2      VAL  39  -3.565 -14.755   7.177
  309    H    MET  40           H        MET  40  -0.654 -10.982   7.727
  310    HA   MET  40           HA       MET  40   1.759 -11.860   6.735
  311    HB2  MET  40           2HB      MET  40   2.381 -10.469   8.402
  312    HB3  MET  40           1HB      MET  40   0.728 -10.501   9.004
  313    HG2  MET  40           2HG      MET  40   1.392 -12.687  10.201
  314    HG3  MET  40           1HG      MET  40   3.059 -12.230   9.846
  315    HE1  MET  40           3HE      MET  40   4.375 -10.167  11.383
  316    HE2  MET  40           1HE      MET  40   4.128 -11.909  11.566
  317    HE3  MET  40           2HE      MET  40   3.894 -10.835  12.942
  318    H    ALA  41           H        ALA  41  -0.384 -13.652   8.881
  319    HA   ALA  41           HA       ALA  41   1.493 -15.696   9.684
  320    HB1  ALA  41           3HB      ALA  41  -1.145 -16.708   9.646
  321    HB2  ALA  41           1HB      ALA  41  -1.294 -14.980   9.961
  322    HB3  ALA  41           2HB      ALA  41  -0.304 -15.985  11.019
  323    H    LYS  42           H        LYS  42   0.079 -15.080   6.647
  324    HA   LYS  42           HA       LYS  42   0.885 -17.767   5.701
  325    HB2  LYS  42           2HB      LYS  42  -1.772 -16.976   6.501
  326    HB3  LYS  42           1HB      LYS  42  -1.727 -17.397   4.777
  327    HG2  LYS  42           2HG      LYS  42  -0.366 -19.173   6.790
  328    HG3  LYS  42           1HG      LYS  42  -2.112 -19.293   6.570
  329    HD2  LYS  42           2HD      LYS  42  -1.858 -19.810   4.228
  330    HD3  LYS  42           1HD      LYS  42  -0.132 -19.448   4.282
  331    HE2  LYS  42           2HE      LYS  42   0.371 -21.522   5.067
  332    HE3  LYS  42           1HE      LYS  42  -0.940 -21.470   6.260
  333    HZ1  LYS  42           3HZ      LYS  42  -1.113 -22.148   3.384
  334    HZ2  LYS  42           1HZ      LYS  42  -2.479 -21.691   4.278
  335    HZ3  LYS  42           2HZ      LYS  42  -1.606 -23.081   4.715
  336    H    CYS  43           H        CYS  43   2.127 -15.623   4.715
  337    HA   CYS  43           HA       CYS  43   0.633 -14.539   2.406
  338    HB2  CYS  43           2HB      CYS  43   3.474 -14.179   3.356
  339    HB3  CYS  43           1HB      CYS  43   2.616 -13.156   2.206
  340    HA   PRO  44           HA       PRO  44   2.450 -17.590  -0.241
  341    HB2  PRO  44           2HB      PRO  44   1.552 -16.571  -2.610
  342    HB3  PRO  44           1HB      PRO  44   0.498 -17.423  -1.466
  343    HG2  PRO  44           2HG      PRO  44   0.682 -14.547  -2.065
  344    HG3  PRO  44           1HG      PRO  44  -0.680 -15.491  -1.451
  345    HD2  PRO  44           2HD      PRO  44   1.039 -13.816   0.040
  346    HD3  PRO  44           1HD      PRO  44  -0.186 -14.932   0.679
  347    H    GLU  45           H        GLU  45   4.007 -15.076   0.551
  348    HA   GLU  45           HA       GLU  45   5.942 -13.928  -0.148
  349    HB2  GLU  45           2HB      GLU  45   5.951 -16.685  -1.052
  350    HB3  GLU  45           1HB      GLU  45   6.885 -15.668  -2.151
  351    HG2  GLU  45           2HG      GLU  45   7.726 -14.688   0.238
  352    HG3  GLU  45           1HG      GLU  45   7.408 -16.366   0.682
  353    H    ARG  46           H        ARG  46   3.438 -13.290  -1.506
  354    HA   ARG  46           HA       ARG  46   2.599 -12.552  -3.641
  355    HB2  ARG  46           2HB      ARG  46   4.523 -10.526  -3.987
  356    HB3  ARG  46           1HB      ARG  46   3.014 -10.409  -3.093
  357    HG2  ARG  46           2HG      ARG  46   4.057 -10.694  -1.033
  358    HG3  ARG  46           1HG      ARG  46   5.402 -11.600  -1.718
  359    HD2  ARG  46           2HD      ARG  46   5.494  -9.050  -2.937
  360    HD3  ARG  46           1HD      ARG  46   5.260  -8.776  -1.198
  361    HE   ARG  46           HE       ARG  46   7.339  -9.875  -0.779
  362   HH11  ARG  46          1HH1      ARG  46   6.203 -11.305  -3.593
  363   HH12  ARG  46          2HH1      ARG  46   7.745 -11.433  -4.364
  364   HH21  ARG  46          1HH2      ARG  46   9.399  -9.550  -1.969
  365   HH22  ARG  46          2HH2      ARG  46   9.554 -10.443  -3.445
  366    H    GLN  47           H        GLN  47   3.005 -14.181  -5.212
  367    HA   GLN  47           HA       GLN  47   5.638 -14.274  -6.544
  368    HB2  GLN  47           2HB      GLN  47   4.614 -16.154  -7.729
  369    HB3  GLN  47           1HB      GLN  47   4.246 -16.286  -6.009
  370    HG2  GLN  47           2HG      GLN  47   2.034 -15.319  -6.369
  371    HG3  GLN  47           1HG      GLN  47   2.397 -15.057  -8.071
  372   HE21  GLN  47          1HE2      GLN  47   0.982 -16.553  -9.080
  373   HE22  GLN  47          2HE2      GLN  47   0.983 -18.219  -8.754
  374    H    ALA  48           H        ALA  48   2.393 -13.039  -7.122
  375    HA   ALA  48           HA       ALA  48   1.484 -11.875  -8.989
  376    HB1  ALA  48           3HB      ALA  48   3.096 -10.386  -7.658
  377    HB2  ALA  48           1HB      ALA  48   2.736  -9.863  -9.303
  378    HB3  ALA  48           2HB      ALA  48   4.261 -10.675  -8.949
  379    H    GLY  49           H        GLY  49   2.871 -14.404  -9.705
  380    HA2  GLY  49           2HA      GLY  49   2.767 -14.974 -12.194
  381    HA3  GLY  49           1HA      GLY  49   3.924 -13.658 -12.399
  Start of MODEL   10
    1    H1   ALA   1           1HT      ALA   1  22.820   6.348   1.437
    2    H2   ALA   1           2HT      ALA   1  23.121   6.930  -0.131
    3    H3   ALA   1           3HT      ALA   1  23.842   5.484   0.396
    4    HA   ALA   1           HA       ALA   1  21.820   4.306   0.339
    5    HB1  ALA   1           3HB      ALA   1  20.847   7.107   0.589
    6    HB2  ALA   1           1HB      ALA   1  20.268   5.644   1.386
    7    HB3  ALA   1           2HB      ALA   1  19.794   5.988  -0.277
    8    H    GLN   2           H        GLN   2  21.450   3.325  -1.625
    9    HA   GLN   2           HA       GLN   2  22.396   4.648  -4.073
   10    HB2  GLN   2           2HB      GLN   2  22.497   2.135  -3.144
   11    HB3  GLN   2           1HB      GLN   2  20.988   2.014  -4.050
   12    HG2  GLN   2           2HG      GLN   2  22.050   2.643  -6.092
   13    HG3  GLN   2           1HG      GLN   2  23.511   3.166  -5.252
   14   HE21  GLN   2          1HE2      GLN   2  25.107   1.670  -5.857
   15   HE22  GLN   2          2HE2      GLN   2  24.922  -0.015  -5.784
   16    H    GLN   3           H        GLN   3  21.027   5.945  -5.231
   17    HA   GLN   3           HA       GLN   3  19.055   6.695  -6.297
   18    HB2  GLN   3           2HB      GLN   3  19.068   3.831  -6.203
   19    HB3  GLN   3           1HB      GLN   3  17.412   4.385  -5.950
   20    HG2  GLN   3           2HG      GLN   3  18.789   5.882  -8.054
   21    HG3  GLN   3           1HG      GLN   3  18.673   4.158  -8.410
   22   HE21  GLN   3          1HE2      GLN   3  17.115   6.607  -9.489
   23   HE22  GLN   3          2HE2      GLN   3  15.487   6.159  -9.306
   24    H    ARG   4           H        ARG   4  17.703   8.113  -5.277
   25    HA   ARG   4           HA       ARG   4  16.787   7.628  -2.528
   26    HB2  ARG   4           2HB      ARG   4  17.587   9.820  -3.444
   27    HB3  ARG   4           1HB      ARG   4  16.180   9.852  -4.506
   28    HG2  ARG   4           2HG      ARG   4  14.669  10.012  -2.673
   29    HG3  ARG   4           1HG      ARG   4  15.916   9.568  -1.509
   30    HD2  ARG   4           2HD      ARG   4  16.910  11.678  -1.561
   31    HD3  ARG   4           1HD      ARG   4  16.311  12.028  -3.195
   32    HE   ARG   4           HE       ARG   4  14.513  11.906  -0.798
   33   HH11  ARG   4          1HH1      ARG   4  15.913  14.121  -2.811
   34   HH12  ARG   4          2HH1      ARG   4  14.442  14.830  -3.387
   35   HH21  ARG   4          1HH2      ARG   4  12.409  12.393  -1.991
   36   HH22  ARG   4          2HH2      ARG   4  12.458  13.852  -2.922
   37    H    LYS   5           H        LYS   5  15.517   5.632  -3.322
   38    HA   LYS   5           HA       LYS   5  13.276   5.715  -5.028
   39    HB2  LYS   5           2HB      LYS   5  12.513   3.807  -3.539
   40    HB3  LYS   5           1HB      LYS   5  14.174   3.664  -4.118
   41    HG2  LYS   5           2HG      LYS   5  14.969   3.693  -2.011
   42    HG3  LYS   5           1HG      LYS   5  14.114   5.199  -1.670
   43    HD2  LYS   5           2HD      LYS   5  12.635   4.081  -0.397
   44    HD3  LYS   5           1HD      LYS   5  12.188   3.083  -1.782
   45    HE2  LYS   5           2HE      LYS   5  13.091   1.818   0.262
   46    HE3  LYS   5           1HE      LYS   5  13.911   1.469  -1.273
   47    HZ1  LYS   5           3HZ      LYS   5  15.745   2.611  -0.667
   48    HZ2  LYS   5           1HZ      LYS   5  15.210   2.269   0.905
   49    HZ3  LYS   5           2HZ      LYS   5  14.873   3.780   0.207
   50    H    VAL   6           H        VAL   6  11.282   6.674  -4.846
   51    HA   VAL   6           HA       VAL   6  10.639   8.476  -2.699
   52    HB   VAL   6           HB       VAL   6   8.764   7.131  -4.667
   53   HG11  VAL   6          1HG1      VAL   6   8.191   8.894  -2.682
   54   HG12  VAL   6          2HG1      VAL   6   7.300   8.824  -4.203
   55   HG13  VAL   6          3HG1      VAL   6   8.585  10.012  -3.988
   56   HG21  VAL   6          3HG2      VAL   6   9.392   9.256  -6.045
   57   HG22  VAL   6          1HG2      VAL   6  10.493   7.880  -6.072
   58   HG23  VAL   6          2HG2      VAL   6  10.847   9.272  -5.047
   59    H    ILE   7           H        ILE   7  10.556   7.492  -0.680
   60    HA   ILE   7           HA       ILE   7  10.000   5.130   0.340
   61    HB   ILE   7           HB       ILE   7   9.961   7.658   1.267
   62   HG12  ILE   7          2HG1      ILE   7  10.478   5.461   2.445
   63   HG13  ILE   7          1HG1      ILE   7   9.754   6.713   3.456
   64   HG21  ILE   7          1HG2      ILE   7   7.596   8.019   0.638
   65   HG22  ILE   7          2HG2      ILE   7   7.817   8.102   2.386
   66   HG23  ILE   7          3HG2      ILE   7   7.128   6.654   1.651
   67   HD11  ILE   7          3HD1      ILE   7   8.800   4.214   3.425
   68   HD12  ILE   7          1HD1      ILE   7   7.904   4.847   2.045
   69   HD13  ILE   7          2HD1      ILE   7   7.739   5.609   3.627
   70    H    ARG   8           H        ARG   8   8.527   3.517   0.041
   71    HA   ARG   8           HA       ARG   8   5.933   4.115  -1.287
   72    HB2  ARG   8           2HB      ARG   8   7.905   2.137  -1.462
   73    HB3  ARG   8           1HB      ARG   8   6.556   1.336  -0.658
   74    HG2  ARG   8           2HG      ARG   8   5.071   2.358  -2.493
   75    HG3  ARG   8           1HG      ARG   8   6.573   2.705  -3.350
   76    HD2  ARG   8           2HD      ARG   8   5.599   0.515  -4.051
   77    HD3  ARG   8           1HD      ARG   8   7.175   0.298  -3.266
   78    HE   ARG   8           HE       ARG   8   4.978   0.251  -1.358
   79   HH11  ARG   8          1HH2      ARG   8   6.458  -1.590  -3.861
   80   HH12  ARG   8          2HH2      ARG   8   6.300  -3.101  -3.028
   81   HH21  ARG   8          1HH1      ARG   8   4.912  -1.692  -0.181
   82   HH22  ARG   8          2HH1      ARG   8   5.427  -3.158  -0.946
   83    H    CYS   9           H        CYS   9   4.048   4.151  -0.110
   84    HA   CYS   9           HA       CYS   9   4.088   3.534   2.759
   85    HB2  CYS   9           2HB      CYS   9   1.873   4.509   2.674
   86    HB3  CYS   9           1HB      CYS   9   2.911   5.467   1.617
   87    H    TRP  10           H        TRP  10   3.189   1.693   3.700
   88    HA   TRP  10           HA       TRP  10   2.673  -0.604   2.018
   89    HB2  TRP  10           2HB      TRP  10   3.348  -1.546   3.951
   90    HB3  TRP  10           1HB      TRP  10   3.276   0.022   4.740
   91    HD1  TRP  10           HD       TRP  10   0.465  -2.380   3.560
   92    HE1  TRP  10           1HE      TRP  10  -1.151  -2.736   5.534
   93    HE3  TRP  10           3HE      TRP  10   2.841   0.382   7.078
   94    HZ2  TRP  10           2HZ      TRP  10  -1.379  -1.944   8.292
   95    HZ3  TRP  10           3HZ      TRP  10   1.928   0.578   9.382
   96    HH2  TRP  10           HH       TRP  10  -0.180  -0.583   9.991
   97    H    ASN  11           H        ASN  11   0.577   1.161   4.322
   98    HA   ASN  11           HA       ASN  11  -1.846  -0.020   4.092
   99    HB2  ASN  11           2HB      ASN  11  -2.679   2.006   4.823
  100    HB3  ASN  11           1HB      ASN  11  -0.959   2.326   5.023
  101   HD21  ASN  11          1HD2      ASN  11  -3.685   2.822   2.756
  102   HD22  ASN  11          2HD2      ASN  11  -3.019   4.189   2.002
  103    H    CYS  12           H        CYS  12  -0.431   2.003   1.519
  104    HA   CYS  12           HA       CYS  12  -2.630   1.057  -0.287
  105    HB2  CYS  12           2HB      CYS  12  -2.463   3.187  -1.382
  106    HB3  CYS  12           1HB      CYS  12  -2.467   3.515   0.351
  107    H    GLY  13           H        GLY  13   0.771   1.153   0.299
  108    HA2  GLY  13           2HA      GLY  13   2.567   0.214  -0.884
  109    HA3  GLY  13           1HA      GLY  13   1.367  -0.683  -1.813
  110    H    LYS  14           H        LYS  14   2.904   2.526  -1.576
  111    HA   LYS  14           HA       LYS  14   3.179   2.672  -4.473
  112    HB2  LYS  14           2HB      LYS  14   0.712   3.314  -3.477
  113    HB3  LYS  14           1HB      LYS  14   1.505   4.890  -3.468
  114    HG2  LYS  14           2HG      LYS  14   1.375   3.026  -5.857
  115    HG3  LYS  14           1HG      LYS  14   0.354   4.445  -5.625
  116    HD2  LYS  14           2HD      LYS  14   2.052   5.914  -6.080
  117    HD3  LYS  14           1HD      LYS  14   3.284   4.875  -5.365
  118    HE2  LYS  14           2HE      LYS  14   2.327   3.435  -7.591
  119    HE3  LYS  14           1HE      LYS  14   2.521   5.108  -8.152
  120    HZ1  LYS  14           3HZ      LYS  14   4.668   4.354  -8.316
  121    HZ2  LYS  14           1HZ      LYS  14   4.527   3.295  -7.001
  122    HZ3  LYS  14           2HZ      LYS  14   4.687   4.964  -6.732
  123    H    GLU  15           H        GLU  15   5.089   3.742  -4.712
  124    HA   GLU  15           HA       GLU  15   6.573   5.034  -2.729
  125    HB2  GLU  15           2HB      GLU  15   8.006   5.465  -4.493
  126    HB3  GLU  15           1HB      GLU  15   6.946   4.301  -5.280
  127    HG2  GLU  15           2HG      GLU  15   5.527   6.413  -5.915
  128    HG3  GLU  15           1HG      GLU  15   7.020   7.293  -5.587
  129    H    GLY  16           H        GLY  16   6.684   7.171  -1.960
  130    HA2  GLY  16           2HA      GLY  16   6.011   9.584  -2.779
  131    HA3  GLY  16           1HA      GLY  16   4.385   8.908  -2.702
  132    H    HIS  17           H        HIS  17   4.710   7.316  -0.355
  133    HA   HIS  17           HA       HIS  17   5.663   9.090   1.800
  134    HB2  HIS  17           2HB      HIS  17   3.300   9.160   2.757
  135    HB3  HIS  17           1HB      HIS  17   3.548  10.120   1.298
  136    HD1  HIS  17           1HD      HIS  17   2.667   9.059  -0.976
  137    HD2  HIS  17           2HD      HIS  17   1.466   7.061   2.479
  138    HE1  HIS  17           1HE      HIS  17   0.774   7.521  -1.660
  139    H    SER  18           H        SER  18   4.687   8.005   4.001
  140    HA   SER  18           HA       SER  18   5.286   5.085   3.737
  141    HB2  SER  18           2HB      SER  18   5.403   5.728   6.406
  142    HB3  SER  18           1HB      SER  18   6.780   5.800   5.304
  143    HG   SER  18           HG       SER  18   5.231   7.833   6.395
  144    H    ALA  19           H        ALA  19   4.074   3.685   5.380
  145    HA   ALA  19           HA       ALA  19   1.221   4.049   5.086
  146    HB1  ALA  19           3HB      ALA  19   1.166   1.896   5.923
  147    HB2  ALA  19           1HB      ALA  19   2.371   2.239   7.162
  148    HB3  ALA  19           2HB      ALA  19   2.874   1.961   5.496
  149    H    ARG  20           H        ARG  20   3.560   4.898   7.563
  150    HA   ARG  20           HA       ARG  20   1.841   5.241   9.809
  151    HB2  ARG  20           2HB      ARG  20   4.195   5.309  10.119
  152    HB3  ARG  20           1HB      ARG  20   4.411   6.502   8.838
  153    HG2  ARG  20           2HG      ARG  20   3.493   8.251  10.168
  154    HG3  ARG  20           1HG      ARG  20   2.834   7.114  11.344
  155    HD2  ARG  20           2HD      ARG  20   4.790   7.047  12.499
  156    HD3  ARG  20           1HD      ARG  20   5.735   6.819  11.013
  157    HE   ARG  20           HE       ARG  20   4.682   9.506  11.821
  158   HH11  ARG  20          1HH1      ARG  20   7.518   8.025  12.280
  159   HH12  ARG  20          2HH1      ARG  20   8.472   8.996  11.209
  160   HH21  ARG  20          1HH2      ARG  20   5.732  10.506   9.710
  161   HH22  ARG  20          2HH2      ARG  20   7.461  10.403   9.754
  162    H    GLN  21           H        GLN  21   2.055   7.001   6.851
  163    HA   GLN  21           HA       GLN  21   0.573   9.322   8.032
  164    HB2  GLN  21           2HB      GLN  21   2.513  10.093   6.946
  165    HB3  GLN  21           1HB      GLN  21   2.398   8.876   5.676
  166    HG2  GLN  21           2HG      GLN  21   0.722  10.042   4.526
  167    HG3  GLN  21           1HG      GLN  21   0.244  10.957   5.957
  168   HE21  GLN  21          1HE2      GLN  21   0.568  13.031   4.869
  169   HE22  GLN  21          2HE2      GLN  21   2.134  13.609   4.516
  170    H    CYS  22           H        CYS  22   0.629   7.191   5.151
  171    HA   CYS  22           HA       CYS  22  -2.156   7.961   4.476
  172    HB2  CYS  22           2HB      CYS  22  -0.315   7.761   2.795
  173    HB3  CYS  22           1HB      CYS  22  -0.206   6.040   3.165
  174    H    ARG  23           H        ARG  23  -3.835   6.863   5.079
  175    HA   ARG  23           HA       ARG  23  -3.540   4.014   5.932
  176    HB2  ARG  23           2HB      ARG  23  -3.804   5.253   7.913
  177    HB3  ARG  23           1HB      ARG  23  -4.830   6.453   7.135
  178    HG2  ARG  23           2HG      ARG  23  -5.991   4.869   8.734
  179    HG3  ARG  23           1HG      ARG  23  -6.700   4.990   7.128
  180    HD2  ARG  23           2HD      ARG  23  -6.520   2.718   6.997
  181    HD3  ARG  23           1HD      ARG  23  -4.760   2.937   6.934
  182    HE   ARG  23           HE       ARG  23  -4.648   2.359   9.229
  183   HH11  ARG  23          1HH1      ARG  23  -7.306   0.900   8.515
  184   HH12  ARG  23          2HH1      ARG  23  -8.272   1.353   9.879
  185   HH21  ARG  23          1HH2      ARG  23  -6.132   3.882  10.895
  186   HH22  ARG  23          2HH2      ARG  23  -7.608   3.038  11.223
  187    H    ALA  24           H        ALA  24  -4.237   5.236   3.342
  188    HA   ALA  24           HA       ALA  24  -6.789   5.562   2.502
  189    HB1  ALA  24           3HB      ALA  24  -6.125   4.239   0.493
  190    HB2  ALA  24           1HB      ALA  24  -4.751   3.607   1.401
  191    HB3  ALA  24           2HB      ALA  24  -4.850   5.329   1.037
  192    HA   PRO  25           HA       PRO  25  -9.400   2.280   3.680
  193    HB2  PRO  25           2HB      PRO  25 -11.018   2.049   1.486
  194    HB3  PRO  25           1HB      PRO  25 -11.120   3.395   2.640
  195    HG2  PRO  25           2HG      PRO  25  -9.777   3.281  -0.022
  196    HG3  PRO  25           1HG      PRO  25 -10.750   4.577   0.695
  197    HD2  PRO  25           2HD      PRO  25  -8.049   4.655   0.639
  198    HD3  PRO  25           1HD      PRO  25  -8.998   5.378   1.960
  199    H    ARG  26           H        ARG  26  -7.970   1.864   0.435
  200    HA   ARG  26           HA       ARG  26  -8.597  -0.821   0.059
  201    HB2  ARG  26           2HB      ARG  26  -6.940  -0.748  -1.629
  202    HB3  ARG  26           1HB      ARG  26  -7.508   0.914  -1.486
  203    HG2  ARG  26           2HG      ARG  26  -5.115  -0.093   0.059
  204    HG3  ARG  26           1HG      ARG  26  -4.972   0.572  -1.566
  205    HD2  ARG  26           2HD      ARG  26  -6.146   2.010   0.837
  206    HD3  ARG  26           1HD      ARG  26  -4.593   2.361   0.053
  207    HE   ARG  26           HE       ARG  26  -7.268   2.753  -1.217
  208   HH11  ARG  26          1HH2      ARG  26  -4.254   2.169  -2.372
  209   HH12  ARG  26          2HH2      ARG  26  -4.011   3.708  -3.127
  210   HH21  ARG  26          1HH1      ARG  26  -6.796   5.163  -1.656
  211   HH22  ARG  26          2HH1      ARG  26  -5.451   5.405  -2.720
  212    H    ARG  27           H        ARG  27  -6.569   0.550   2.448
  213    HA   ARG  27           HA       ARG  27  -4.447  -0.953   3.035
  214    HB2  ARG  27           2HB      ARG  27  -6.629   0.251   4.541
  215    HB3  ARG  27           1HB      ARG  27  -5.916  -1.107   5.409
  216    HG2  ARG  27           2HG      ARG  27  -3.686   0.194   4.452
  217    HG3  ARG  27           1HG      ARG  27  -4.775   1.536   4.798
  218    HD2  ARG  27           2HD      ARG  27  -3.312   0.813   6.763
  219    HD3  ARG  27           1HD      ARG  27  -5.055   0.802   7.100
  220    HE   ARG  27           HE       ARG  27  -3.782  -1.703   6.115
  221   HH11  ARG  27          1HH2      ARG  27  -4.737   0.134   8.840
  222   HH12  ARG  27          2HH2      ARG  27  -5.375  -1.220   9.712
  223   HH21  ARG  27          1HH1      ARG  27  -4.872  -3.467   7.120
  224   HH22  ARG  27          2HH1      ARG  27  -5.450  -3.256   8.740
  225    H    GLN  28           H        GLN  28  -3.932  -3.084   3.558
  226    HA   GLN  28           HA       GLN  28  -6.196  -5.029   3.828
  227    HB2  GLN  28           2HB      GLN  28  -4.666  -6.528   2.387
  228    HB3  GLN  28           1HB      GLN  28  -5.483  -5.202   1.562
  229    HG2  GLN  28           2HG      GLN  28  -2.834  -4.568   2.751
  230    HG3  GLN  28           1HG      GLN  28  -2.825  -5.636   1.347
  231   HE21  GLN  28          1HE2      GLN  28  -2.550  -2.437   2.090
  232   HE22  GLN  28          2HE2      GLN  28  -3.228  -1.749   0.683
  233    H    GLY  29           H        GLY  29  -5.936  -5.844   5.855
  234    HA2  GLY  29           2HA      GLY  29  -4.046  -5.784   7.730
  235    HA3  GLY  29           1HA      GLY  29  -4.855  -7.317   7.417
  236    H    CYS  30           H        CYS  30  -3.788  -8.825   5.891
  237    HA   CYS  30           HA       CYS  30  -0.836  -8.618   6.120
  238    HB2  CYS  30           2HB      CYS  30  -0.888 -10.967   5.663
  239    HB3  CYS  30           1HB      CYS  30  -2.281 -10.658   6.695
  240    H    TRP  31           H        TRP  31   0.414  -7.966   4.394
  241    HA   TRP  31           HA       TRP  31  -0.929  -7.518   1.787
  242    HB2  TRP  31           2HB      TRP  31   1.924  -6.852   2.085
  243    HB3  TRP  31           1HB      TRP  31   0.597  -5.857   1.503
  244    HD1  TRP  31           HD       TRP  31  -1.232  -5.420   3.817
  245    HE1  TRP  31           1HE      TRP  31  -0.474  -4.324   6.027
  246    HE3  TRP  31           3HE      TRP  31   3.743  -6.276   3.499
  247    HZ2  TRP  31           2HZ      TRP  31   1.979  -3.853   7.455
  248    HZ3  TRP  31           3HZ      TRP  31   5.296  -5.507   5.283
  249    HH2  TRP  31           HH       TRP  31   4.413  -4.301   7.264
  250    H    LYS  32           H        LYS  32   1.436  -9.588   3.292
  251    HA   LYS  32           HA       LYS  32   2.837 -10.530   0.996
  252    HB2  LYS  32           2HB      LYS  32   2.795 -10.909   3.746
  253    HB3  LYS  32           1HB      LYS  32   2.355 -12.494   3.111
  254    HG2  LYS  32           2HG      LYS  32   4.685 -10.956   1.973
  255    HG3  LYS  32           1HG      LYS  32   4.874 -11.975   3.401
  256    HD2  LYS  32           2HD      LYS  32   4.199 -13.935   2.204
  257    HD3  LYS  32           1HD      LYS  32   3.649 -12.982   0.825
  258    HE2  LYS  32           2HE      LYS  32   5.931 -12.322   0.294
  259    HE3  LYS  32           1HE      LYS  32   6.538 -13.107   1.765
  260    HZ1  LYS  32           3HZ      LYS  32   4.958 -14.982   0.483
  261    HZ2  LYS  32           1HZ      LYS  32   6.651 -14.989   0.611
  262    HZ3  LYS  32           2HZ      LYS  32   5.904 -14.279  -0.741
  263    H    CYS  33           H        CYS  33  -0.459 -10.943   1.767
  264    HA   CYS  33           HA       CYS  33  -0.575 -13.301  -0.078
  265    HB2  CYS  33           2HB      CYS  33  -2.506 -14.027   1.443
  266    HB3  CYS  33           1HB      CYS  33  -0.884 -14.145   2.127
  267    H    GLY  34           H        GLY  34  -2.468 -10.613   1.366
  268    HA2  GLY  34           2HA      GLY  34  -3.635  -9.093  -0.219
  269    HA3  GLY  34           1HA      GLY  34  -3.986 -10.511  -1.209
  270    H    LYS  35           H        LYS  35  -4.353  -9.828   2.283
  271    HA   LYS  35           HA       LYS  35  -7.283 -10.339   1.994
  272    HB2  LYS  35           2HB      LYS  35  -5.219 -11.770   3.647
  273    HB3  LYS  35           1HB      LYS  35  -6.872 -11.663   4.246
  274    HG2  LYS  35           2HG      LYS  35  -7.233 -12.378   1.602
  275    HG3  LYS  35           1HG      LYS  35  -5.784 -13.278   2.052
  276    HD2  LYS  35           2HD      LYS  35  -6.886 -14.475   3.728
  277    HD3  LYS  35           1HD      LYS  35  -8.154 -13.261   3.899
  278    HE2  LYS  35           2HE      LYS  35  -7.876 -14.723   1.284
  279    HE3  LYS  35           1HE      LYS  35  -8.708 -15.505   2.642
  280    HZ1  LYS  35           3HZ      LYS  35 -10.074 -13.978   1.117
  281    HZ2  LYS  35           1HZ      LYS  35  -9.292 -12.703   1.918
  282    HZ3  LYS  35           2HZ      LYS  35 -10.249 -13.798   2.798
  283    H    THR  36           H        THR  36  -7.785 -10.159   4.829
  284    HA   THR  36           HA       THR  36  -6.719  -7.439   5.485
  285    HB   THR  36           HB       THR  36  -8.987  -7.475   4.346
  286    HG1  THR  36           1HG      THR  36  -9.938  -6.187   6.124
  287   HG21  THR  36          3HG2      THR  36 -10.787  -8.554   5.301
  288   HG22  THR  36          1HG2      THR  36 -10.136  -8.413   6.935
  289   HG23  THR  36          2HG2      THR  36  -9.496  -9.631   5.832
  290    H    GLY  37           H        GLY  37  -7.528  -6.863   7.831
  291    HA2  GLY  37           2HA      GLY  37  -7.447  -7.351  10.120
  292    HA3  GLY  37           1HA      GLY  37  -8.132  -8.923   9.708
  293    H    HIS  38           H        HIS  38  -6.781 -10.699   9.652
  294    HA   HIS  38           HA       HIS  38  -4.424 -10.849  11.090
  295    HB2  HIS  38           2HB      HIS  38  -4.789 -12.995  10.476
  296    HB3  HIS  38           1HB      HIS  38  -5.973 -12.438   9.301
  297    HD1  HIS  38           1HD      HIS  38  -5.449 -13.210   6.996
  298    HD2  HIS  38           2HD      HIS  38  -1.984 -12.629   9.240
  299    HE1  HIS  38           1HE      HIS  38  -3.509 -13.774   5.471
  300    H    VAL  39           H        VAL  39  -2.159 -10.837  10.490
  301    HA   VAL  39           HA       VAL  39  -1.494  -9.526   7.886
  302    HB   VAL  39           HB       VAL  39  -1.775  -7.893   9.775
  303   HG11  VAL  39          1HG1      VAL  39  -0.856  -8.296  11.781
  304   HG12  VAL  39          2HG1      VAL  39   0.745  -8.417  11.050
  305   HG13  VAL  39          3HG1      VAL  39  -0.283  -9.845  11.163
  306   HG21  VAL  39          3HG2      VAL  39  -0.020  -7.815   7.779
  307   HG22  VAL  39          1HG2      VAL  39   1.127  -7.877   9.117
  308   HG23  VAL  39          2HG2      VAL  39  -0.052  -6.568   9.026
  309    H    MET  40           H        MET  40   1.107  -9.408   7.897
  310    HA   MET  40           HA       MET  40   2.164 -11.998   7.654
  311    HB2  MET  40           2HB      MET  40   3.203  -9.916   6.818
  312    HB3  MET  40           1HB      MET  40   3.533  -9.407   8.474
  313    HG2  MET  40           2HG      MET  40   4.544 -12.085   8.005
  314    HG3  MET  40           1HG      MET  40   5.208 -10.949   6.830
  315    HE1  MET  40           3HE      MET  40   5.980  -8.897   7.193
  316    HE2  MET  40           1HE      MET  40   7.313  -8.632   8.326
  317    HE3  MET  40           2HE      MET  40   5.702  -8.024   8.698
  318    H    ALA  41           H        ALA  41   1.616 -10.069  10.486
  319    HA   ALA  41           HA       ALA  41   3.307 -11.130  12.482
  320    HB1  ALA  41           3HB      ALA  41   1.438  -9.335  12.553
  321    HB2  ALA  41           1HB      ALA  41   1.570 -10.387  13.963
  322    HB3  ALA  41           2HB      ALA  41   0.325 -10.688  12.752
  323    H    LYS  42           H        LYS  42   0.407 -12.384  11.029
  324    HA   LYS  42           HA       LYS  42   0.649 -14.863  12.666
  325    HB2  LYS  42           2HB      LYS  42  -0.862 -13.805  13.995
  326    HB3  LYS  42           1HB      LYS  42  -0.859 -12.451  12.898
  327    HG2  LYS  42           2HG      LYS  42  -3.083 -13.055  12.932
  328    HG3  LYS  42           1HG      LYS  42  -2.477 -13.788  11.451
  329    HD2  LYS  42           2HD      LYS  42  -3.134 -15.818  12.190
  330    HD3  LYS  42           1HD      LYS  42  -2.069 -15.649  13.586
  331    HE2  LYS  42           2HE      LYS  42  -3.870 -14.320  14.735
  332    HE3  LYS  42           1HE      LYS  42  -4.945 -14.697  13.373
  333    HZ1  LYS  42           3HZ      LYS  42  -4.730 -16.289  15.468
  334    HZ2  LYS  42           1HZ      LYS  42  -3.451 -16.913  14.544
  335    HZ3  LYS  42           2HZ      LYS  42  -5.025 -16.883  13.904
  336    H    CYS  43           H        CYS  43   0.726 -13.957   9.668
  337    HA   CYS  43           HA       CYS  43  -1.520 -14.961   8.263
  338    HB2  CYS  43           2HB      CYS  43   1.062 -13.928   7.843
  339    HB3  CYS  43           1HB      CYS  43   1.045 -15.479   7.008
  340    HA   PRO  44           HA       PRO  44  -1.034 -19.342   8.370
  341    HB2  PRO  44           2HB      PRO  44  -0.494 -20.268   5.854
  342    HB3  PRO  44           1HB      PRO  44  -2.077 -19.625   6.332
  343    HG2  PRO  44           2HG      PRO  44   0.082 -18.347   4.756
  344    HG3  PRO  44           1HG      PRO  44  -1.673 -18.184   4.613
  345    HD2  PRO  44           2HD      PRO  44  -0.009 -16.345   5.806
  346    HD3  PRO  44           1HD      PRO  44  -1.753 -16.475   6.113
  347    H    GLU  45           H        GLU  45   1.673 -17.600   7.134
  348    HA   GLU  45           HA       GLU  45   3.549 -19.870   7.263
  349    HB2  GLU  45           2HB      GLU  45   3.964 -16.878   6.941
  350    HB3  GLU  45           1HB      GLU  45   5.159 -18.132   6.601
  351    HG2  GLU  45           2HG      GLU  45   2.501 -18.343   5.255
  352    HG3  GLU  45           1HG      GLU  45   3.626 -17.118   4.666
  353    H    ARG  46           H        ARG  46   2.007 -18.078   9.566
  354    HA   ARG  46           HA       ARG  46   2.580 -17.285  11.735
  355    HB2  ARG  46           2HB      ARG  46   4.020 -19.365  12.754
  356    HB3  ARG  46           1HB      ARG  46   2.277 -19.413  12.512
  357    HG2  ARG  46           2HG      ARG  46   2.610 -20.449  10.294
  358    HG3  ARG  46           1HG      ARG  46   4.357 -20.395  10.532
  359    HD2  ARG  46           2HD      ARG  46   3.110 -22.621  11.096
  360    HD3  ARG  46           1HD      ARG  46   4.279 -22.008  12.280
  361    HE   ARG  46           HE       ARG  46   2.472 -21.525  13.730
  362   HH11  ARG  46          1HH2      ARG  46   1.189 -23.445  11.451
  363   HH12  ARG  46          2HH2      ARG  46  -0.390 -22.733  11.411
  364   HH21  ARG  46          1HH1      ARG  46   0.529 -19.951  13.267
  365   HH22  ARG  46          2HH1      ARG  46  -0.763 -20.753  12.438
  366    H    GLN  47           H        GLN  47   4.070 -15.586  10.773
  367    HA   GLN  47           HA       GLN  47   6.960 -16.212  11.246
  368    HB2  GLN  47           2HB      GLN  47   5.462 -14.151   9.611
  369    HB3  GLN  47           1HB      GLN  47   7.202 -14.058   9.878
  370    HG2  GLN  47           2HG      GLN  47   7.562 -16.178   8.799
  371    HG3  GLN  47           1HG      GLN  47   5.830 -16.505   8.740
  372   HE21  GLN  47          1HE2      GLN  47   8.086 -15.931   6.588
  373   HE22  GLN  47          2HE2      GLN  47   7.320 -14.830   5.548
  374    H    ALA  48           H        ALA  48   5.695 -15.876  13.615
  375    HA   ALA  48           HA       ALA  48   6.357 -13.054  14.391
  376    HB1  ALA  48           3HB      ALA  48   4.000 -13.214  14.480
  377    HB2  ALA  48           1HB      ALA  48   4.493 -13.525  16.144
  378    HB3  ALA  48           2HB      ALA  48   4.049 -14.868  15.089
  379    H    GLY  49           H        GLY  49   5.741 -16.278  15.863
  380    HA2  GLY  49           2HA      GLY  49   8.122 -15.776  17.605
  381    HA3  GLY  49           1HA      GLY  49   6.685 -16.624  18.177
  Start of MODEL   11
    1    H1   ALA   1           1HT      ALA   1  18.593  15.015  -0.845
    2    H2   ALA   1           2HT      ALA   1  19.956  15.471  -1.753
    3    H3   ALA   1           3HT      ALA   1  18.430  15.377  -2.495
    4    HA   ALA   1           HA       ALA   1  19.520  17.465  -0.743
    5    HB1  ALA   1           3HB      ALA   1  18.876  17.109  -3.418
    6    HB2  ALA   1           1HB      ALA   1  19.109  18.667  -2.629
    7    HB3  ALA   1           2HB      ALA   1  17.487  17.996  -2.793
    8    H    GLN   2           H        GLN   2  18.270  18.394   0.856
    9    HA   GLN   2           HA       GLN   2  16.439  18.695   2.324
   10    HB2  GLN   2           2HB      GLN   2  15.759  19.382  -0.208
   11    HB3  GLN   2           1HB      GLN   2  14.560  18.124   0.090
   12    HG2  GLN   2           2HG      GLN   2  13.435  19.964   0.941
   13    HG3  GLN   2           1HG      GLN   2  14.272  19.410   2.393
   14   HE21  GLN   2          1HE2      GLN   2  15.851  20.799   3.310
   15   HE22  GLN   2          2HE2      GLN   2  16.290  22.295   2.635
   16    H    GLN   3           H        GLN   3  17.432  16.133   2.541
   17    HA   GLN   3           HA       GLN   3  16.815  13.976   3.286
   18    HB2  GLN   3           2HB      GLN   3  14.497  15.785   3.668
   19    HB3  GLN   3           1HB      GLN   3  14.120  14.062   3.706
   20    HG2  GLN   3           2HG      GLN   3  16.299  14.018   5.262
   21    HG3  GLN   3           1HG      GLN   3  15.792  15.679   5.572
   22   HE21  GLN   3          1HE2      GLN   3  15.232  12.427   6.472
   23   HE22  GLN   3          2HE2      GLN   3  13.776  12.665   7.311
   24    H    ARG   4           H        ARG   4  16.311  12.069   2.201
   25    HA   ARG   4           HA       ARG   4  15.172  12.320  -0.522
   26    HB2  ARG   4           2HB      ARG   4  16.832  10.419   1.060
   27    HB3  ARG   4           1HB      ARG   4  15.847   9.718  -0.225
   28    HG2  ARG   4           2HG      ARG   4  17.471  12.173  -0.808
   29    HG3  ARG   4           1HG      ARG   4  18.272  10.602  -0.765
   30    HD2  ARG   4           2HD      ARG   4  16.197   9.903  -2.299
   31    HD3  ARG   4           1HD      ARG   4  16.236  11.632  -2.698
   32    HE   ARG   4           HE       ARG   4  18.760  11.231  -3.105
   33   HH11  ARG   4          1HH2      ARG   4  18.751   8.323  -2.475
   34   HH12  ARG   4          2HH2      ARG   4  18.572   7.599  -4.038
   35   HH21  ARG   4          1HH1      ARG   4  17.487  10.523  -5.556
   36   HH22  ARG   4          2HH1      ARG   4  17.861   8.847  -5.784
   37    H    LYS   5           H        LYS   5  12.909  12.451  -0.302
   38    HA   LYS   5           HA       LYS   5  10.716  11.659   0.095
   39    HB2  LYS   5           2HB      LYS   5  12.145   9.026   0.561
   40    HB3  LYS   5           1HB      LYS   5  10.506   9.263  -0.045
   41    HG2  LYS   5           2HG      LYS   5  12.334  10.731  -1.707
   42    HG3  LYS   5           1HG      LYS   5  12.898   9.066  -1.562
   43    HD2  LYS   5           2HD      LYS   5  11.119   8.228  -2.711
   44    HD3  LYS   5           1HD      LYS   5   9.985   9.355  -1.965
   45    HE2  LYS   5           2HE      LYS   5   9.995  10.508  -3.920
   46    HE3  LYS   5           1HE      LYS   5  11.679  10.950  -3.569
   47    HZ1  LYS   5           3HZ      LYS   5  12.459   8.993  -4.622
   48    HZ2  LYS   5           1HZ      LYS   5  11.352   9.697  -5.698
   49    HZ3  LYS   5           2HZ      LYS   5  10.891   8.351  -4.768
   50    H    VAL   6           H        VAL   6   9.315  11.078   1.909
   51    HA   VAL   6           HA       VAL   6  10.747  10.822   4.526
   52    HB   VAL   6           HB       VAL   6   8.567  12.249   5.198
   53   HG11  VAL   6          1HG1      VAL   6  11.310  12.983   4.316
   54   HG12  VAL   6          2HG1      VAL   6  10.515  13.253   5.869
   55   HG13  VAL   6          3HG1      VAL   6  10.158  14.308   4.500
   56   HG21  VAL   6          3HG2      VAL   6   9.193  13.078   2.348
   57   HG22  VAL   6          1HG2      VAL   6   8.151  13.968   3.459
   58   HG23  VAL   6          2HG2      VAL   6   7.682  12.360   2.908
   59    H    ILE   7           H        ILE   7  10.232   8.761   5.152
   60    HA   ILE   7           HA       ILE   7   8.930   6.839   5.626
   61    HB   ILE   7           HB       ILE   7   6.891   8.974   6.248
   62   HG12  ILE   7          2HG1      ILE   7   9.634   8.779   7.123
   63   HG13  ILE   7          1HG1      ILE   7   8.424   9.977   7.570
   64   HG21  ILE   7          1HG2      ILE   7   6.464   6.432   6.507
   65   HG22  ILE   7          2HG2      ILE   7   6.108   7.466   7.889
   66   HG23  ILE   7          3HG2      ILE   7   7.594   6.517   7.856
   67   HD11  ILE   7          3HD1      ILE   7   8.684   7.250   8.869
   68   HD12  ILE   7          1HD1      ILE   7   7.620   8.561   9.373
   69   HD13  ILE   7          2HD1      ILE   7   9.367   8.736   9.530
   70    H    ARG   8           H        ARG   8   8.618   6.078   3.391
   71    HA   ARG   8           HA       ARG   8   6.290   6.990   1.846
   72    HB2  ARG   8           2HB      ARG   8   7.062   5.069   0.376
   73    HB3  ARG   8           1HB      ARG   8   8.301   6.278   0.709
   74    HG2  ARG   8           2HG      ARG   8   9.451   4.885   2.194
   75    HG3  ARG   8           1HG      ARG   8   8.034   3.882   2.504
   76    HD2  ARG   8           2HD      ARG   8   9.585   3.978  -0.111
   77    HD3  ARG   8           1HD      ARG   8   9.613   2.651   1.068
   78    HE   ARG   8           HE       ARG   8   6.896   3.163   0.478
   79   HH11  ARG   8          1HH2      ARG   8   9.200   0.920  -0.153
   80   HH12  ARG   8          2HH2      ARG   8   8.631   0.463  -1.724
   81   HH21  ARG   8          1HH1      ARG   8   6.396   3.101  -1.975
   82   HH22  ARG   8          2HH1      ARG   8   7.045   1.698  -2.756
   83    H    CYS   9           H        CYS   9   4.240   6.122   2.019
   84    HA   CYS   9           HA       CYS   9   3.723   4.010   3.975
   85    HB2  CYS   9           2HB      CYS   9   1.488   4.696   3.703
   86    HB3  CYS   9           1HB      CYS   9   2.398   6.163   3.355
   87    H    TRP  10           H        TRP  10   2.801   1.937   3.486
   88    HA   TRP  10           HA       TRP  10   3.691   0.817   0.907
   89    HB2  TRP  10           2HB      TRP  10   4.030  -1.002   2.214
   90    HB3  TRP  10           1HB      TRP  10   3.601   0.017   3.579
   91    HD1  TRP  10           HD       TRP  10   2.488  -2.945   1.640
   92    HE1  TRP  10           1HE      TRP  10   0.219  -3.797   2.514
   93    HE3  TRP  10           3HE      TRP  10   1.166   0.966   4.646
   94    HZ2  TRP  10           2HZ      TRP  10  -1.868  -2.940   4.268
   95    HZ3  TRP  10           3HZ      TRP  10  -0.956   0.915   5.913
   96    HH2  TRP  10           HH       TRP  10  -2.470  -1.028   5.725
   97    H    ASN  11           H        ASN  11   0.598   1.242   2.639
   98    HA   ASN  11           HA       ASN  11  -0.919  -0.257   0.653
   99    HB2  ASN  11           2HB      ASN  11  -2.833   0.568   2.016
  100    HB3  ASN  11           1HB      ASN  11  -1.566  -0.151   3.007
  101   HD21  ASN  11          1HD2      ASN  11  -3.636   2.166   3.448
  102   HD22  ASN  11          2HD2      ASN  11  -2.681   3.406   4.106
  103    H    CYS  12           H        CYS  12  -0.036   3.093   1.155
  104    HA   CYS  12           HA       CYS  12  -1.778   3.817  -1.184
  105    HB2  CYS  12           2HB      CYS  12  -1.954   5.997  -0.198
  106    HB3  CYS  12           1HB      CYS  12  -2.202   4.836   1.107
  107    H    GLY  13           H        GLY  13   1.343   3.071  -0.458
  108    HA2  GLY  13           2HA      GLY  13   3.444   3.727  -1.320
  109    HA3  GLY  13           1HA      GLY  13   2.536   3.838  -2.831
  110    H    LYS  14           H        LYS  14   3.513   5.696   0.036
  111    HA   LYS  14           HA       LYS  14   3.926   8.099  -1.527
  112    HB2  LYS  14           2HB      LYS  14   1.560   8.170  -1.686
  113    HB3  LYS  14           1HB      LYS  14   1.353   7.645  -0.015
  114    HG2  LYS  14           2HG      LYS  14   0.894  10.020  -0.123
  115    HG3  LYS  14           1HG      LYS  14   2.428   9.794   0.721
  116    HD2  LYS  14           2HD      LYS  14   3.642  10.218  -1.391
  117    HD3  LYS  14           1HD      LYS  14   2.102  10.492  -2.209
  118    HE2  LYS  14           2HE      LYS  14   2.843  12.681  -1.626
  119    HE3  LYS  14           1HE      LYS  14   1.685  12.274  -0.344
  120    HZ1  LYS  14           3HZ      LYS  14   4.425  12.794  -0.084
  121    HZ2  LYS  14           1HZ      LYS  14   4.172  11.163   0.315
  122    HZ3  LYS  14           2HZ      LYS  14   3.320  12.378   1.137
  123    H    GLU  15           H        GLU  15   5.141   9.558  -0.319
  124    HA   GLU  15           HA       GLU  15   6.080   8.758   2.305
  125    HB2  GLU  15           2HB      GLU  15   7.535  10.640   2.047
  126    HB3  GLU  15           1HB      GLU  15   7.337   9.946   0.441
  127    HG2  GLU  15           2HG      GLU  15   5.870  11.662  -0.241
  128    HG3  GLU  15           1HG      GLU  15   5.591  12.201   1.415
  129    H    GLY  16           H        GLY  16   6.029  10.335   4.174
  130    HA2  GLY  16           2HA      GLY  16   4.786  12.355   5.085
  131    HA3  GLY  16           1HA      GLY  16   3.348  11.653   4.337
  132    H    HIS  17           H        HIS  17   3.925   8.918   5.002
  133    HA   HIS  17           HA       HIS  17   4.198   8.777   7.934
  134    HB2  HIS  17           2HB      HIS  17   1.843   7.599   7.910
  135    HB3  HIS  17           1HB      HIS  17   1.927   9.357   7.957
  136    HD1  HIS  17           1HD      HIS  17   0.703  10.560   6.149
  137    HD2  HIS  17           2HD      HIS  17   1.483   6.601   5.103
  138    HE1  HIS  17           1HE      HIS  17  -0.460  10.164   3.936
  139    H    SER  18           H        SER  18   3.462   6.287   8.495
  140    HA   SER  18           HA       SER  18   4.873   4.616   6.444
  141    HB2  SER  18           2HB      SER  18   4.978   3.194   8.754
  142    HB3  SER  18           1HB      SER  18   6.186   4.403   8.309
  143    HG   SER  18           HG       SER  18   4.013   4.586  10.091
  144    H    ALA  19           H        ALA  19   4.183   2.148   6.932
  145    HA   ALA  19           HA       ALA  19   1.352   1.983   6.255
  146    HB1  ALA  19           3HB      ALA  19   2.891   0.502   5.194
  147    HB2  ALA  19           1HB      ALA  19   1.962  -0.501   6.305
  148    HB3  ALA  19           2HB      ALA  19   3.595   0.012   6.733
  149    H    ARG  20           H        ARG  20   2.836   2.452   9.167
  150    HA   ARG  20           HA       ARG  20   1.274   0.540  10.771
  151    HB2  ARG  20           2HB      ARG  20   3.657   1.622  11.135
  152    HB3  ARG  20           1HB      ARG  20   2.728   2.954  11.824
  153    HG2  ARG  20           2HG      ARG  20   1.546   1.224  13.270
  154    HG3  ARG  20           1HG      ARG  20   2.763   0.067  12.727
  155    HD2  ARG  20           2HD      ARG  20   4.517   1.781  13.520
  156    HD3  ARG  20           1HD      ARG  20   3.177   2.574  14.371
  157    HE   ARG  20           HE       ARG  20   4.384   0.058  15.139
  158   HH11  ARG  20          1HH2      ARG  20   1.579   2.049  15.172
  159   HH12  ARG  20          2HH2      ARG  20   0.739   1.082  16.336
  160   HH21  ARG  20          1HH1      ARG  20   3.233  -1.315  16.544
  161   HH22  ARG  20          2HH1      ARG  20   1.673  -0.821  17.112
  162    H    GLN  21           H        GLN  21   0.952   3.757   9.513
  163    HA   GLN  21           HA       GLN  21  -1.545   4.126  11.129
  164    HB2  GLN  21           2HB      GLN  21  -0.984   6.540  11.109
  165    HB3  GLN  21           1HB      GLN  21   0.303   5.591  11.854
  166    HG2  GLN  21           2HG      GLN  21   1.507   5.574   9.671
  167    HG3  GLN  21           1HG      GLN  21   0.252   6.620   9.002
  168   HE21  GLN  21          1HE2      GLN  21  -0.099   8.747  10.303
  169   HE22  GLN  21          2HE2      GLN  21   1.292   9.485  10.957
  170    H    CYS  22           H        CYS  22   0.063   4.393   8.013
  171    HA   CYS  22           HA       CYS  22  -1.943   5.889   6.614
  172    HB2  CYS  22           2HB      CYS  22   0.499   5.202   6.016
  173    HB3  CYS  22           1HB      CYS  22  -0.230   3.711   5.418
  174    H    ARG  23           H        ARG  23  -4.011   5.268   6.308
  175    HA   ARG  23           HA       ARG  23  -4.677   2.365   6.224
  176    HB2  ARG  23           2HB      ARG  23  -6.056   3.167   7.859
  177    HB3  ARG  23           1HB      ARG  23  -5.807   4.835   7.359
  178    HG2  ARG  23           2HG      ARG  23  -8.135   4.350   7.037
  179    HG3  ARG  23           1HG      ARG  23  -7.401   4.388   5.435
  180    HD2  ARG  23           2HD      ARG  23  -7.897   2.199   5.065
  181    HD3  ARG  23           1HD      ARG  23  -7.289   1.722   6.664
  182    HE   ARG  23           HE       ARG  23 -10.049   2.674   6.088
  183   HH11  ARG  23          1HH2      ARG  23  -8.626   3.500   8.745
  184   HH12  ARG  23          2HH2      ARG  23  -9.287   2.309   9.815
  185   HH21  ARG  23          1HH1      ARG  23 -10.486   0.294   7.258
  186   HH22  ARG  23          2HH1      ARG  23 -10.343   0.495   8.973
  187    H    ALA  24           H        ALA  24  -4.604   5.315   4.374
  188    HA   ALA  24           HA       ALA  24  -5.449   5.836   2.207
  189    HB1  ALA  24           3HB      ALA  24  -4.960   2.905   1.699
  190    HB2  ALA  24           1HB      ALA  24  -3.614   3.949   2.155
  191    HB3  ALA  24           2HB      ALA  24  -4.531   4.288   0.690
  192    HA   PRO  25           HA       PRO  25  -9.487   4.145   1.540
  193    HB2  PRO  25           2HB      PRO  25  -9.671   2.558  -0.688
  194    HB3  PRO  25           1HB      PRO  25  -9.504   4.321  -0.768
  195    HG2  PRO  25           2HG      PRO  25  -7.471   2.213  -1.202
  196    HG3  PRO  25           1HG      PRO  25  -7.651   3.790  -1.982
  197    HD2  PRO  25           2HD      PRO  25  -5.839   3.204  -0.004
  198    HD3  PRO  25           1HD      PRO  25  -6.397   4.843  -0.400
  199    H    ARG  26           H        ARG  26  -8.851   1.081   0.023
  200    HA   ARG  26           HA       ARG  26  -9.467  -0.225   2.526
  201    HB2  ARG  26           2HB      ARG  26 -10.880  -1.091   0.976
  202    HB3  ARG  26           1HB      ARG  26  -9.837  -0.608  -0.356
  203    HG2  ARG  26           2HG      ARG  26 -10.144  -3.086  -0.048
  204    HG3  ARG  26           1HG      ARG  26  -8.478  -2.534  -0.110
  205    HD2  ARG  26           2HD      ARG  26  -8.148  -3.571   1.900
  206    HD3  ARG  26           1HD      ARG  26  -9.245  -2.378   2.622
  207    HE   ARG  26           HE       ARG  26  -9.929  -5.123   2.071
  208   HH11  ARG  26          1HH1      ARG  26 -11.260  -2.977   3.892
  209   HH12  ARG  26          2HH1      ARG  26 -12.846  -2.936   3.198
  210   HH21  ARG  26          1HH2      ARG  26 -11.915  -4.617   0.310
  211   HH22  ARG  26          2HH2      ARG  26 -13.218  -3.869   1.171
  212    H    ARG  27           H        ARG  27  -7.295  -0.028   3.518
  213    HA   ARG  27           HA       ARG  27  -4.963  -1.018   2.186
  214    HB2  ARG  27           2HB      ARG  27  -4.046  -0.876   4.552
  215    HB3  ARG  27           1HB      ARG  27  -4.747   0.619   3.925
  216    HG2  ARG  27           2HG      ARG  27  -6.348   0.617   5.492
  217    HG3  ARG  27           1HG      ARG  27  -6.770  -1.059   5.136
  218    HD2  ARG  27           2HD      ARG  27  -5.936  -0.691   7.506
  219    HD3  ARG  27           1HD      ARG  27  -4.982  -1.872   6.586
  220    HE   ARG  27           HE       ARG  27  -3.679   0.443   5.981
  221   HH11  ARG  27          1HH2      ARG  27  -3.161  -1.702   8.287
  222   HH12  ARG  27          2HH2      ARG  27  -2.671  -0.616   9.545
  223   HH21  ARG  27          1HH1      ARG  27  -3.773   2.224   7.882
  224   HH22  ARG  27          2HH1      ARG  27  -3.019   1.610   9.315
  225    H    GLN  28           H        GLN  28  -3.732  -2.981   3.104
  226    HA   GLN  28           HA       GLN  28  -5.696  -5.140   3.813
  227    HB2  GLN  28           2HB      GLN  28  -2.993  -5.594   2.554
  228    HB3  GLN  28           1HB      GLN  28  -4.438  -6.597   2.448
  229    HG2  GLN  28           2HG      GLN  28  -4.085  -3.861   1.193
  230    HG3  GLN  28           1HG      GLN  28  -4.039  -5.399   0.333
  231   HE21  GLN  28          1HE2      GLN  28  -6.290  -6.267   2.390
  232   HE22  GLN  28          2HE2      GLN  28  -7.699  -5.625   1.676
  233    H    GLY  29           H        GLY  29  -5.385  -6.034   5.820
  234    HA2  GLY  29           2HA      GLY  29  -3.452  -5.159   7.663
  235    HA3  GLY  29           1HA      GLY  29  -4.273  -6.720   7.778
  236    H    CYS  30           H        CYS  30  -3.193  -8.580   7.077
  237    HA   CYS  30           HA       CYS  30  -0.276  -8.318   6.743
  238    HB2  CYS  30           2HB      CYS  30  -1.745 -10.053   8.087
  239    HB3  CYS  30           1HB      CYS  30  -1.859 -10.867   6.526
  240    H    TRP  31           H        TRP  31   0.530  -7.986   4.706
  241    HA   TRP  31           HA       TRP  31  -1.098  -8.809   2.356
  242    HB2  TRP  31           2HB      TRP  31   1.453  -7.505   1.807
  243    HB3  TRP  31           1HB      TRP  31  -0.169  -7.003   1.353
  244    HD1  TRP  31           HD       TRP  31  -1.592  -5.944   3.622
  245    HE1  TRP  31           1HE      TRP  31  -0.716  -4.147   5.244
  246    HE3  TRP  31           3HE      TRP  31   3.385  -6.490   2.841
  247    HZ2  TRP  31           2HZ      TRP  31   1.823  -3.078   6.097
  248    HZ3  TRP  31           3HZ      TRP  31   5.032  -5.086   4.065
  249    HH2  TRP  31           HH       TRP  31   4.253  -3.385   5.694
  250    H    LYS  32           H        LYS  32   1.725  -9.717   4.133
  251    HA   LYS  32           HA       LYS  32   2.741 -11.396   1.901
  252    HB2  LYS  32           2HB      LYS  32   3.735 -10.218   4.443
  253    HB3  LYS  32           1HB      LYS  32   4.442 -11.766   3.976
  254    HG2  LYS  32           2HG      LYS  32   4.182  -9.621   1.901
  255    HG3  LYS  32           1HG      LYS  32   5.482  -9.501   3.086
  256    HD2  LYS  32           2HD      LYS  32   6.487 -11.496   2.379
  257    HD3  LYS  32           1HD      LYS  32   5.006 -12.088   1.628
  258    HE2  LYS  32           2HE      LYS  32   5.607 -11.170  -0.351
  259    HE3  LYS  32           1HE      LYS  32   5.790  -9.578   0.412
  260    HZ1  LYS  32           3HZ      LYS  32   7.785 -11.704   0.058
  261    HZ2  LYS  32           1HZ      LYS  32   7.902 -10.701   1.421
  262    HZ3  LYS  32           2HZ      LYS  32   7.954 -10.024  -0.137
  263    H    CYS  33           H        CYS  33   0.218 -11.908   3.660
  264    HA   CYS  33           HA       CYS  33   0.902 -14.760   4.222
  265    HB2  CYS  33           2HB      CYS  33   1.240 -13.325   6.263
  266    HB3  CYS  33           1HB      CYS  33  -0.473 -12.912   6.192
  267    H    GLY  34           H        GLY  34  -1.846 -12.510   4.763
  268    HA2  GLY  34           2HA      GLY  34  -3.702 -12.800   2.984
  269    HA3  GLY  34           1HA      GLY  34  -3.586 -14.513   3.387
  270    H    LYS  35           H        LYS  35  -3.366 -11.809   5.667
  271    HA   LYS  35           HA       LYS  35  -5.991 -12.666   6.838
  272    HB2  LYS  35           2HB      LYS  35  -3.379 -12.046   8.258
  273    HB3  LYS  35           1HB      LYS  35  -4.898 -12.457   9.055
  274    HG2  LYS  35           2HG      LYS  35  -4.527 -14.481   7.156
  275    HG3  LYS  35           1HG      LYS  35  -2.927 -14.220   7.850
  276    HD2  LYS  35           2HD      LYS  35  -3.538 -15.266   9.745
  277    HD3  LYS  35           1HD      LYS  35  -4.893 -14.155   9.951
  278    HE2  LYS  35           2HE      LYS  35  -5.847 -15.750   7.941
  279    HE3  LYS  35           1HE      LYS  35  -4.881 -16.909   8.876
  280    HZ1  LYS  35           3HZ      LYS  35  -7.139 -15.240   9.764
  281    HZ2  LYS  35           1HZ      LYS  35  -5.956 -15.708  10.884
  282    HZ3  LYS  35           2HZ      LYS  35  -6.847 -16.889  10.051
  283    H    THR  36           H        THR  36  -6.251 -10.848   8.832
  284    HA   THR  36           HA       THR  36  -5.835  -8.172   7.545
  285    HB   THR  36           HB       THR  36  -8.118  -7.617   8.174
  286    HG1  THR  36           1HG      THR  36  -8.354 -10.249   9.176
  287   HG21  THR  36          3HG2      THR  36  -9.331  -9.127   6.735
  288   HG22  THR  36          1HG2      THR  36  -8.130 -10.396   6.974
  289   HG23  THR  36          2HG2      THR  36  -7.707  -8.943   6.068
  290    H    GLY  37           H        GLY  37  -7.312  -9.268  10.595
  291    HA2  GLY  37           2HA      GLY  37  -6.492  -7.243  12.272
  292    HA3  GLY  37           1HA      GLY  37  -6.611  -8.915  12.826
  293    H    HIS  38           H        HIS  38  -4.554 -10.121  11.421
  294    HA   HIS  38           HA       HIS  38  -2.197  -8.981  12.797
  295    HB2  HIS  38           2HB      HIS  38  -1.784 -11.188  13.050
  296    HB3  HIS  38           1HB      HIS  38  -3.250 -11.542  12.141
  297    HD1  HIS  38           1HD      HIS  38  -2.843 -12.927  10.114
  298    HD2  HIS  38           2HD      HIS  38   0.486 -10.613  11.091
  299    HE1  HIS  38           1HE      HIS  38  -1.070 -13.475   8.395
  300    H    VAL  39           H        VAL  39  -0.120  -8.832  11.555
  301    HA   VAL  39           HA       VAL  39  -0.348  -8.498   8.621
  302    HB   VAL  39           HB       VAL  39  -1.103  -6.367   9.313
  303   HG11  VAL  39          1HG1      VAL  39  -0.608  -6.637  11.710
  304   HG12  VAL  39          2HG1      VAL  39  -0.028  -5.078  11.127
  305   HG13  VAL  39          3HG1      VAL  39   1.108  -6.401  11.384
  306   HG21  VAL  39          3HG2      VAL  39   0.704  -4.824   8.744
  307   HG22  VAL  39          1HG2      VAL  39   0.780  -6.243   7.701
  308   HG23  VAL  39          2HG2      VAL  39   1.900  -6.081   9.054
  309    H    MET  40           H        MET  40   1.915  -7.727   7.789
  310    HA   MET  40           HA       MET  40   3.940  -9.524   8.242
  311    HB2  MET  40           2HB      MET  40   3.618  -7.035   6.997
  312    HB3  MET  40           1HB      MET  40   5.008  -6.813   8.060
  313    HG2  MET  40           2HG      MET  40   5.377  -9.344   6.901
  314    HG3  MET  40           1HG      MET  40   4.827  -8.310   5.582
  315    HE1  MET  40           3HE      MET  40   7.191  -9.753   7.401
  316    HE2  MET  40           1HE      MET  40   8.542  -8.693   7.827
  317    HE3  MET  40           2HE      MET  40   8.440  -9.390   6.211
  318    H    ALA  41           H        ALA  41   3.066  -6.824  10.290
  319    HA   ALA  41           HA       ALA  41   5.106  -6.340  12.065
  320    HB1  ALA  41           3HB      ALA  41   2.664  -5.647  12.196
  321    HB2  ALA  41           1HB      ALA  41   3.346  -6.143  13.745
  322    HB3  ALA  41           2HB      ALA  41   2.317  -7.251  12.841
  323    H    LYS  42           H        LYS  42   3.033  -9.123  11.920
  324    HA   LYS  42           HA       LYS  42   4.764 -10.597  13.849
  325    HB2  LYS  42           2HB      LYS  42   3.238  -9.713  15.303
  326    HB3  LYS  42           1HB      LYS  42   2.227  -9.177  13.984
  327    HG2  LYS  42           2HG      LYS  42   0.912 -10.670  15.214
  328    HG3  LYS  42           1HG      LYS  42   1.396 -11.516  13.746
  329    HD2  LYS  42           2HD      LYS  42   3.339 -12.484  15.122
  330    HD3  LYS  42           1HD      LYS  42   2.496 -11.873  16.544
  331    HE2  LYS  42           2HE      LYS  42   0.524 -13.222  16.011
  332    HE3  LYS  42           1HE      LYS  42   1.289 -13.784  14.511
  333    HZ1  LYS  42           3HZ      LYS  42   3.172 -14.572  15.903
  334    HZ2  LYS  42           1HZ      LYS  42   1.723 -15.404  16.190
  335    HZ3  LYS  42           2HZ      LYS  42   2.252 -14.219  17.287
  336    H    CYS  43           H        CYS  43   3.460 -10.643  10.885
  337    HA   CYS  43           HA       CYS  43   1.824 -12.841  10.501
  338    HB2  CYS  43           2HB      CYS  43   3.836 -11.283   9.086
  339    HB3  CYS  43           1HB      CYS  43   3.729 -12.934   8.474
  340    HA   PRO  44           HA       PRO  44   4.572 -15.944  12.270
  341    HB2  PRO  44           2HB      PRO  44   2.607 -17.801  12.664
  342    HB3  PRO  44           1HB      PRO  44   2.890 -16.446  13.774
  343    HG2  PRO  44           2HG      PRO  44   0.785 -16.800  11.722
  344    HG3  PRO  44           1HG      PRO  44   0.718 -15.970  13.283
  345    HD2  PRO  44           2HD      PRO  44   0.965 -14.727  10.816
  346    HD3  PRO  44           1HD      PRO  44   1.372 -13.993  12.382
  347    H    GLU  45           H        GLU  45   2.459 -16.070   9.514
  348    HA   GLU  45           HA       GLU  45   2.299 -17.624   7.712
  349    HB2  GLU  45           2HB      GLU  45   4.636 -17.772   6.690
  350    HB3  GLU  45           1HB      GLU  45   4.069 -16.145   7.062
  351    HG2  GLU  45           2HG      GLU  45   5.357 -16.095   9.110
  352    HG3  GLU  45           1HG      GLU  45   5.804 -17.791   8.920
  353    H    ARG  46           H        ARG  46   1.790 -19.281   9.687
  354    HA   ARG  46           HA       ARG  46   2.004 -21.513  10.432
  355    HB2  ARG  46           2HB      ARG  46   3.183 -21.317   7.706
  356    HB3  ARG  46           1HB      ARG  46   3.532 -22.794   8.607
  357    HG2  ARG  46           2HG      ARG  46   1.300 -23.434   8.691
  358    HG3  ARG  46           1HG      ARG  46   0.713 -21.777   8.545
  359    HD2  ARG  46           2HD      ARG  46   1.939 -21.977   6.157
  360    HD3  ARG  46           1HD      ARG  46   1.527 -23.685   6.403
  361    HE   ARG  46           HE       ARG  46  -0.795 -23.095   6.409
  362   HH11  ARG  46          1HH1      ARG  46  -0.796 -20.668   8.063
  363   HH12  ARG  46          2HH1      ARG  46  -1.120 -19.409   6.919
  364   HH21  ARG  46          1HH2      ARG  46  -0.303 -21.341   4.160
  365   HH22  ARG  46          2HH2      ARG  46  -0.838 -19.789   4.711
  366    H    GLN  47           H        GLN  47   3.265 -21.132  12.327
  367    HA   GLN  47           HA       GLN  47   6.234 -21.432  11.988
  368    HB2  GLN  47           2HB      GLN  47   5.195 -19.273  12.913
  369    HB3  GLN  47           1HB      GLN  47   4.733 -20.224  14.325
  370    HG2  GLN  47           2HG      GLN  47   6.908 -19.050  14.642
  371    HG3  GLN  47           1HG      GLN  47   7.069 -20.804  14.744
  372   HE21  GLN  47          1HE2      GLN  47   6.626 -19.069  11.668
  373   HE22  GLN  47          2HE2      GLN  47   8.172 -19.414  11.058
  374    H    ALA  48           H        ALA  48   7.275 -22.966  13.368
  375    HA   ALA  48           HA       ALA  48   5.475 -24.629  15.097
  376    HB1  ALA  48           3HB      ALA  48   5.956 -26.487  13.870
  377    HB2  ALA  48           1HB      ALA  48   7.651 -26.033  13.689
  378    HB3  ALA  48           2HB      ALA  48   6.433 -25.343  12.614
  379    H    GLY  49           H        GLY  49   8.825 -23.709  14.296
  380    HA2  GLY  49           2HA      GLY  49   9.870 -22.979  16.655
  381    HA3  GLY  49           1HA      GLY  49   9.763 -24.722  16.912