*HEADER    CYTOSKELETON                            03-APR-02   1GXE
*TITLE     CENTRAL DOMAIN OF CARDIAC MYOSIN BINDING PROTEIN C
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: MYOSIN BINDING PROTEIN C, CARDIAC-TYPE;
*COMPND   3 SYNONYM: CARDIAC MYBP-C, C-PROTEIN -
*COMPND   4  CARDIAC MUSCLE ISOFORM;
*COMPND   5 CHAIN: A;
*COMPND   6 FRAGMENT: DOMAIN C5, RESIDUES 641-770;
*COMPND   7 ENGINEERED: YES;
*COMPND   8 OTHER_DETAILS: HIS-TAGGED PROTEIN
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 ORGAN: HEART;
*SOURCE   5 TISSUE: MUSCLE;
*SOURCE   6 CELL: MYOCYTE;
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21*;
*SOURCE   9 EXPRESSION_SYSTEM_VARIANT: DE3;
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET8C;
*SOURCE  11 OTHER_DETAILS: CARDIAC PROTEIN
*KEYWDS    MUSCLE, IGI, THICK FILAMENT, IMMUNOGLOBULIN DOMAIN,
*KEYWDS   2 CYTOSKELETON
*EXPDTA    NMR, 10 STRUCTURES
*AUTHOR    M.PFUHL
*REVDAT   1   12-JUN-03 1GXE    0




! complete set of NOEs for cC5 including hydrogen bond restraints for the beta strands
! 
! hydrogen bond constraints in the beta strands
!
assign (resid 125 and name O ) (resid 19 and name hn ) 2.70 2.50 0.15 !              
assign (resid 125 and name O ) (resid 19 and name N ) 3.70 2.50 0.15
assign (resid 19 and name O ) (resid 127 and name hn ) 2.70 2.50 0.15 !              
assign (resid 19 and name O ) (resid 127 and name N ) 3.70 2.50 0.15
assign (resid 127 and name O ) (resid 21 and name hn ) 2.70 2.50 0.15 !              
assign (resid 127 and name O ) (resid 21 and name N ) 3.70 2.50 0.15
assign (resid 21 and name O ) (resid 129 and name hn ) 2.70 2.50 0.15 !              
assign (resid 21 and name O ) (resid 129 and name N ) 3.70 2.50 0.15
assign (resid 129 and name O ) (resid 23 and name hn ) 2.70 2.50 0.15 !              
assign (resid 129 and name O ) (resid 23 and name N ) 3.70 2.50 0.15
assign (resid 27 and name O ) (resid 98 and name hn ) 2.70 2.50 0.15 !              
assign (resid 27 and name O ) (resid 98 and name N ) 3.70 2.50 0.15
assign (resid 98 and name O ) (resid 27 and name hn ) 2.70 2.50 0.15 !              
assign (resid 98 and name O ) (resid 27 and name N ) 3.70 2.50 0.15
assign (resid 29 and name O ) (resid 96 and name hn ) 2.70 2.50 0.15 !              
assign (resid 29 and name O ) (resid 96 and name N ) 3.70 2.50 0.15
assign (resid 96 and name O ) (resid 29 and name hn ) 2.70 2.50 0.15 !              
assign (resid 96 and name O ) (resid 29 and name N ) 3.70 2.50 0.15
assign (resid 31 and name O ) (resid 94 and name hn ) 2.70 2.50 0.15 !              
assign (resid 31 and name O ) (resid 94 and name N ) 3.70 2.50 0.15
assign (resid 94 and name O ) (resid 31 and name hn ) 2.70 2.50 0.15 !              
assign (resid 94 and name O ) (resid 31 and name N ) 3.70 2.50 0.15
assign (resid 40 and name O ) (resid 114 and name hn ) 2.70 2.50 0.15 !              
assign (resid 40 and name O ) (resid 114 and name N ) 3.70 2.50 0.15
assign (resid 114 and name O ) (resid 40 and name hn ) 2.70 2.50 0.15 !              
assign (resid 114 and name O ) (resid 40 and name N ) 3.70 2.50 0.15
assign (resid 42 and name O ) (resid 112 and name hn ) 2.70 2.50 0.15 !              
assign (resid 42 and name O ) (resid 112 and name N ) 3.70 2.50 0.15
assign (resid 112 and name O ) (resid 42 and name hn ) 2.70 2.50 0.15 !              
assign (resid 112 and name O ) (resid 42 and name N ) 3.70 2.50 0.15
assign (resid 44 and name O ) (resid 110 and name hn ) 2.70 2.50 0.15 !              
assign (resid 44 and name O ) (resid 110 and name N ) 3.70 2.50 0.15
assign (resid 110 and name O ) (resid 44 and name hn ) 2.70 2.50 0.15 !              
assign (resid 110 and name O ) (resid 44 and name N ) 3.70 2.50 0.15
assign (resid 46 and name O ) (resid 108 and name hn ) 2.70 2.50 0.15 !              
assign (resid 46 and name O ) (resid 108 and name N ) 3.70 2.50 0.15
assign (resid 108 and name O ) (resid 46 and name hn ) 2.70 2.50 0.15 !              
assign (resid 108 and name O ) (resid 46 and name N ) 3.70 2.50 0.15
assign (resid 86 and name O ) (resid  97 and name hn ) 2.70 2.50 0.15 !              
assign (resid 86 and name O ) (resid  97 and name N ) 3.70 2.50 0.15
assign (resid  97 and name O ) (resid 86 and name hn ) 2.70 2.50 0.15 !              
assign (resid  97 and name O ) (resid 86 and name N ) 3.70 2.50 0.15
assign (resid 88 and name O ) (resid  95 and name hn ) 2.70 2.50 0.15 !              
assign (resid 88 and name O ) (resid  95 and name N ) 3.70 2.50 0.15
assign (resid  95 and name O ) (resid 88 and name hn ) 2.70 2.50 0.15 !              
assign (resid  95 and name O ) (resid 88 and name N ) 3.70 2.50 0.15
assign (resid 90 and name O ) (resid  93 and name hn ) 2.70 2.50 0.15 !              
assign (resid 90 and name O ) (resid  93 and name N ) 3.70 2.50 0.15
assign (resid  93 and name O ) (resid 90 and name hn ) 2.70 2.50 0.15 !              
assign (resid  93 and name O ) (resid 90 and name N ) 3.70 2.50 0.15
assign (resid 109 and name O ) (resid 124 and name hn ) 2.70 2.50 0.15 !              
assign (resid 109 and name O ) (resid 124 and name N ) 3.70 2.50 0.15
assign (resid 124 and name O ) (resid 109 and name hn ) 2.70 2.50 0.15 !              
assign (resid 124 and name O ) (resid 109 and name N ) 3.70 2.50 0.15
assign (resid 111 and name O ) (resid 122 and name hn ) 2.70 2.50 0.15 !              
assign (resid 111 and name O ) (resid 122 and name N ) 3.70 2.50 0.15
assign (resid 122 and name O ) (resid 111 and name hn ) 2.70 2.50 0.15 !              
assign (resid 122 and name O ) (resid 111 and name N ) 3.70 2.50 0.15
assign (resid 113 and name O ) (resid 120 and name hn ) 2.70 2.50 0.15 !              
assign (resid 113 and name O ) (resid 120 and name N ) 3.70 2.50 0.15
assign (resid 120 and name O ) (resid 113 and name hn ) 2.70 2.50 0.15 !              
assign (resid 120 and name O ) (resid 113 and name N ) 3.70 2.50 0.15
assign (resid 115 and name O ) (resid 118 and name hn ) 2.70 2.50 0.15 !              
assign (resid 115 and name O ) (resid 118 and name N ) 3.70 2.50 0.15
assign (resid 118 and name O ) (resid 115 and name hn ) 2.70 2.50 0.15 !              
assign (resid 118 and name O ) (resid 115 and name N ) 3.70 2.50 0.15
!
! normal noes by residue
! 
! Gln 2
assign ( resid 2 and name HN  ) ( resid 1 and name HA ) 3.0  3.0 0.25
assign ( resid 2 and name HN  ) ( resid 2 and name HA ) 3.0  3.0 0.25
assign ( resid 2 and name HN  ) ( resid 3 and name HN ) 4.3  3.0 0.25
assign ( resid 2 and name HN  ) ( resid 2 and name HG2 ) 4.5  3.0 0.25
assign ( resid 2 and name HN  ) ( resid 2 and name HG1 ) 3.0  3.0 0.25
assign ( resid 2 and name HA ) ( resid 36 and name HB1 ) 5.5   3.0 0.25
assign ( resid 2 and name HA ) ( resid 117 and name HG2# ) 5.5   3.0 0.25
assign ( resid 2 and name HA ) ( resid 2 and name HB1 ) 3.5   3.0 0.25
assign ( resid 2 and name HA ) ( resid 2 and name HB2 ) 2.6   3.0 0.25
assign ( resid 2 and name HA ) ( resid 2 and name HG2 ) 3.5   3.0 0.25
assign ( resid 2 and name HA ) ( resid 2 and name HG1 ) 4.3   3.0 0.25
assign ( resid 2 and name HB1 ) ( resid 117 and name HG2# ) 4.5   3.0 0.25
assign ( resid 2 and name HB2 ) ( resid 117 and name HG2# ) 4.7   3.0 0.25
assign ( resid 2 and name HG2 ) ( resid 117 and name HG2# ) 4.5   3.0 0.25
assign ( resid 2 and name HE22 ) ( resid 117 and name HB ) 5.0   3.0 0.25
assign ( resid 2 and name HE22 ) ( resid 117 and name HG2# ) 5.0   3.0 0.25
assign ( resid 2 and name HE22 ) ( resid 35 and name HN ) 5.0   3.0 0.25
assign ( resid 2 and name HE22 ) ( resid 36 and name HN ) 4.6   3.0 0.25
! Glu 3
assign ( resid 3 and name HN ) ( resid 2 and name HA ) 3.5  3.0 0.25
assign ( resid 3 and name HN ) ( resid 2 and name HB2 ) 4.0   3.0 0.25
assign ( resid 3 and name HN ) ( resid 36 and name HN ) 4.6   3.0 0.25
assign ( resid 3 and name HN ) ( resid 36 and name HB1 ) 4.5    3.0 0.25
assign ( resid 3 and name HN ) ( resid 36 and name HB2 ) 4.5    3.0 0.25
assign ( resid 3 and name HN ) ( resid 117 and name HG# ) 6.0    3.0 0.25
assign ( resid 3 and name HN ) ( resid 3 and name HA ) 3.5  3.0 0.25
assign ( resid 3 and name HN ) ( resid 3 and name HB1 ) 3.5  3.0 0.25
assign ( resid 3 and name HN ) ( resid 3 and name HB2 ) 3.5  3.0 0.25
assign ( resid 3 and name HA ) ( resid 4 and name HD# ) 4.0   3.0 0.25
assign ( resid 3 and name HA ) ( resid 3 and name HG# ) 5.5   3.0 0.25
assign ( resid 3 and name HA ) ( resid 3 and name HB1 ) 2.5   3.0 0.25
assign ( resid 3 and name HA ) ( resid 3 and name HB2 ) 4.5   3.0 0.25
assign ( resid 3 and name HG# ) ( resid 4 and name HD# ) 6.5   3.0 0.25
!Pro 4
assign ( resid 4 and name HA ) ( resid 117 and name HB ) 4.0   3.0 0.25
!Pro 5
!assign ( resid 5 and name HA ) ( resid 121 and name HA ) 4.5   3.0 0.25
assign ( resid 5 and name HA ) ( resid 35 and name HA1 ) 4.7   3.0 0.25
assign ( resid 5 and name HA ) ( resid 35 and name HA2 ) 4.5   3.0 0.25
assign ( resid 5 and name HB# ) ( resid 119 and name HN ) 5.3   3.0 0.25
assign ( resid 5 and name HB2 ) ( resid 118 and name HN ) 4.5   3.0 0.25
assign ( resid 5 and name HB1 ) ( resid 118 and name HN ) 5.0   3.0 0.25
assign ( resid 5 and name HD# ) ( resid 118 and name HN ) 5.1   3.0 0.25
!Lys 6
assign ( resid 6 and name HN ) ( resid 5 and name HA )  3.5  3.0 0.25
assign ( resid 6 and name HN ) ( resid 34 and name HN ) 4.5   3.0 0.25
assign ( resid 6 and name HN ) ( resid 113 and name HG1# ) 6.5    3.0 0.25
assign ( resid 6 and name HN ) ( resid 6 and name HA )  4.5  3.0 0.25
assign ( resid 6 and name HN ) ( resid 6 and name HB# )  3.5  3.0 0.25
assign ( resid 6 and name HN ) ( resid 6 and name HG# )  4.2  3.0 0.25
assign ( resid 6 and name HA ) ( resid 6 and name HG# ) 3.5   3.0 0.25
assign ( resid 6 and name HA ) ( resid 7 and name HG1# ) 5.0   3.0 0.25
assign ( resid 6 and name HA ) ( resid 34 and name HN ) 4.8   3.0 0.25
!Ile 7
assign ( resid 7 and name HN ) ( resid 6 and name HA ) 3.5   3.0 0.25
assign ( resid 7 and name HN ) ( resid 6 and name HG# ) 4.5   3.0 0.25
assign ( resid 7 and name HN ) ( resid 113 and name HG1# ) 5.5   3.0 0.25
assign ( resid 7 and name HN ) ( resid 7 and name HB ) 3.5   3.0 0.25
assign ( resid 7 and name HN ) ( resid 7 and name HG2# ) 5.5   3.0 0.25
assign ( resid 7 and name HN ) ( resid 7 and name HD1# ) 4.0   3.0 0.25
assign ( resid 7 and name HA ) ( resid 33 and name HA ) 4.5   3.0 0.25
assign ( resid 7 and name HA ) ( resid 33 and name HG1# ) 5.5   3.0 0.25
assign ( resid 7 and name HA ) ( resid 7 and name HB ) 3.5   3.0 0.25
assign ( resid 7 and name HA ) ( resid 7 and name HD1# ) 4.5   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 33 and name HG2# ) 5.0   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 34 and name HN ) 5.1   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 41 and name HB ) 5.6   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 111 and name HG1# ) 6.5    3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 113 and name HN )  4.0  3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 120 and name HA ) 5.3   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 121 and name HA ) 4.5   3.0 0.25
assign ( resid 7 and name HD1# ) ( resid 122 and name HB )  6.5  3.0 0.25
assign ( resid 7 and name HG2# ) ( resid 7 and name HA )  3.5  3.0 0.25
assign ( resid 7 and name HG2# ) ( resid 15 and name HG1# )  6.0  3.0 0.25
!His 8
assign ( resid 8 and name HN ) ( resid 7 and name HA ) 3.5   3.0 0.25
assign ( resid 8 and name HN ) ( resid 7 and name HD1# )  5.2  3.0 0.25
assign ( resid 8 and name HN ) ( resid 8 and name HD2 )  4.3  3.0 0.25
assign ( resid 8 and name HN ) ( resid 8 and name HA )  4.5  3.0 0.25
assign ( resid 8 and name HN ) ( resid 8 and name HB1 )  3.7  3.0 0.25
assign ( resid 8 and name HN ) ( resid 8 and name HB2 )  3.7  3.0 0.25
assign ( resid 8 and name HN ) ( resid 33 and name HG2# )  4.5  3.0 0.25
assign ( resid 8 and name HN ) ( resid 33 and name HA ) 4.2   3.0 0.25
assign ( resid 8 and name HD2 ) ( resid 34 and name HN )  5.3  3.0 0.25
!Leu 9
assign ( resid 9 and name HN ) ( resid 8 and name HA ) 3.5   3.0 0.25
assign ( resid 9 and name HN ) ( resid 8 and name HB1 ) 4.5    3.0 0.25
assign ( resid 9 and name HN ) ( resid 8 and name HB2 )  4.5   3.0 0.25
assign ( resid 9 and name HN ) ( resid 9 and name HA ) 3.0   3.0 0.25
assign ( resid 9 and name HN ) ( resid 9 and name HB1 ) 3.5    3.0 0.25
assign ( resid 9 and name HN ) ( resid 9 and name HB2 )  4.5   3.0 0.25
assign ( resid 9 and name HN ) ( resid 9 and name HD1# ) 5.0    3.0 0.25
assign ( resid 9 and name HN ) ( resid 9 and name HD2# )  4.2   3.0 0.25
assign ( resid 9 and name HA ) ( resid 9 and name HD2# )  4.7  3.0 0.25
!assign ( resid 9 and name HA ) ( resid 12 and name HG# )  5.5  3.0 0.25
assign ( resid 9 and name HB1 ) ( resid 9 and name HA )  3.0  3.0 0.25
assign ( resid 9 and name HB2 ) ( resid 9 and name HA )  4.5  3.0 0.25
assign ( resid 9 and name HD1# ) ( resid 8 and name HD2 ) 4.7    3.0 0.25
assign ( resid 9 and name HD1# ) ( resid 11 and name HB# ) 6.5   3.0 0.25
assign ( resid 9 and name HD1# ) ( resid 12 and name HB# ) 6.6   3.0 0.25
!Asp 10
assign ( resid 10 and name HN ) ( resid 9 and name HA ) 3.5  3.0 0.25
assign ( resid 10 and name HN ) ( resid 9 and name HN ) 4.0  3.0 0.25
assign ( resid 10 and name HN ) ( resid 9 and name HB1 ) 3.7  3.0 0.25
assign ( resid 10 and name HN ) ( resid 9 and name HD2# ) 3.8  3.0 0.25
assign ( resid 10 and name HN ) ( resid 10 and name HA ) 3.0  3.0 0.25
assign ( resid 10 and name HN ) ( resid 10 and name HB1 ) 3.2  3.0 0.25
assign ( resid 10 and name HN ) ( resid 10 and name HB2 ) 3.0  3.0 0.25
assign ( resid 10 and name HN ) ( resid 11 and name HN ) 3.5   3.0 0.25
assign ( resid 10 and name HN ) ( resid 11 and name HA ) 5.0   3.0 0.25
assign ( resid 10 and name HA ) ( resid 10 and name HB1 ) 3.0  3.0 0.25
assign ( resid 10 and name HA ) ( resid 10 and name HB2 ) 3.0  3.0 0.25
!Cys 11
assign ( resid 11 and name HN ) ( resid 9 and name HA  )  4.8  3.0 0.25
assign ( resid 11 and name HN ) ( resid 9 and name HB1  )  4.8  3.0 0.25
assign ( resid 11 and name HN ) ( resid 10 and name HA )  3.5  3.0 0.25
assign ( resid 11 and name HN ) ( resid 10 and name HB1 ) 4.0   3.0 0.25
assign ( resid 11 and name HN ) ( resid 10 and name HB2 ) 4.2   3.0 0.25
assign ( resid 11 and name HN ) ( resid 11 and name HA )  3.0  3.0 0.25
assign ( resid 11 and name HN ) ( resid 11 and name HB# )  4.0  3.0 0.25
assign ( resid 11 and name HN ) ( resid 12 and name HD# ) 4.0   3.0 0.25
assign ( resid 11 and name HN ) ( resid 12 and name HG# ) 5.5   3.0 0.25
assign ( resid 11 and name HA ) ( resid 12 and name HD# ) 4.5   3.0 0.25
assign ( resid 11 and name HB# ) ( resid 12 and name HD# ) 4.5   3.0 0.25
!Pro 12
assign ( resid 12 and name HA ) ( resid 9 and name HD1# )  5.0  3.0 0.25
!Gly 13
assign ( resid 13 and name HN ) ( resid 12 and name HA ) 3.5   3.0 0.25
assign ( resid 13 and name HN ) ( resid 14 and name HN ) 4.0   3.0 0.25
!Arg 14
assign ( resid 14 and name HN ) ( resid 13 and name HA# ) 3.5   3.0 0.25
assign ( resid 14 and name HN ) ( resid 14 and name HA ) 3.0   3.0 0.25
assign ( resid 14 and name HN ) ( resid 14 and name HB# ) 4.5   3.0 0.25
assign ( resid 14 and name HN ) ( resid 14 and name HG# ) 5.0   3.0 0.25
assign ( resid 14 and name HN ) ( resid 15 and name HN ) 4.0   3.0 0.25
assign ( resid 14 and name HG# ) ( resid 15 and name HN ) 5.0   3.0 0.25
!Ile 15
assign ( resid 15 and name HN ) ( resid 7 and name HG2# ) 5.5   3.0 0.25
assign ( resid 15 and name HN ) ( resid 14 and name HA ) 3.5   3.0 0.25
assign ( resid 15 and name HN ) ( resid 15 and name HA ) 3.5   3.0 0.25
assign ( resid 15 and name HN ) ( resid 15 and name HB ) 3.0   3.0 0.25
assign ( resid 15 and name HN ) ( resid 15 and name HG2# ) 4.0   3.0 0.25
assign ( resid 15 and name HN ) ( resid 16 and name HD# ) 5.5   3.0 0.25
assign ( resid 15 and name HA ) ( resid 15 and name HG2# ) 4.5   3.0 0.25
assign ( resid 15 and name HA ) ( resid 15 and name HB ) 3.0   3.0 0.25
assign ( resid 15 and name HA ) ( resid 16 and name HD# ) 4.5   3.0 0.25
assign ( resid 15 and name HA ) ( resid 32 and name HD# ) 3.5   3.0 0.25
assign ( resid 15 and name HG2# ) ( resid 16 and name HD# ) 5.5   3.0 0.25
assign ( resid 15 and name HG2# ) ( resid 111 and name HG1# ) 5.5   3.0 0.25
assign ( resid 15 and name HD1# ) ( resid 32 and name HA) 5.5   3.0 0.25
assign ( resid 15 and name HD1# ) ( resid 32 and name HD#) 6.5   3.0 0.25
assign ( resid 15 and name HD1# ) ( resid 113 and name HB) 6.3   3.0 0.25
assign ( resid 15 and name HD1# ) ( resid 122 and name HB) 5.5   3.0 0.25
!Pro 16
!Asp 17
assign ( resid 17 and name HN ) ( resid 16 and name HA ) 3.0  3.0 0.25
assign ( resid 17 and name HN ) ( resid 16 and name HB# ) 4.5    3.0 0.25
assign ( resid 17 and name HN ) ( resid 31 and name HB ) 4.6    3.0 0.25
assign ( resid 17 and name HN ) ( resid 17 and name HA ) 4.5  3.0 0.25
assign ( resid 17 and name HN ) ( resid 17 and name HB1 ) 4.0  3.0 0.25
assign ( resid 17 and name HN ) ( resid 17 and name HB2 ) 4.0  3.0 0.25
assign ( resid 17 and name HN ) ( resid 122 and name HG2# ) 4.5    3.0 0.25
assign ( resid 17 and name HB1 ) ( resid 111 and name HG1# ) 4.0  3.0 0.25
assign ( resid 17 and name HB2 ) ( resid 111 and name HG1# ) 4.5  3.0 0.25
assign ( resid 17 and name HB1 ) ( resid 124 and name HB2 ) 4.0  3.0 0.25
assign ( resid 17 and name HB2 ) ( resid 124 and name HB2 ) 3.5  3.0 0.25
!Thr 18
assign ( resid 18 and name HA ) ( resid 18 and name HB ) 3.5   3.0 0.25
assign ( resid 18 and name HA ) ( resid 18 and name HG2# ) 4.0   3.0 0.25
assign ( resid 18 and name HG2# ) ( resid 19 and name HA ) 5.5   3.0 0.25
assign ( resid 18 and name HG2# ) ( resid 124 and name HG ) 5.5   3.0 0.25
!Ile 19
assign ( resid 19 and name HN ) ( resid 18 and name HA ) 3.0  3.0 0.25
assign ( resid 19 and name HN ) ( resid 19 and name HA ) 3.5  3.0 0.25
assign ( resid 19 and name HN ) ( resid 19 and name HG2# ) 3.8  3.0 0.25
assign ( resid 19 and name HN ) ( resid 19 and name HD1# ) 4.8  3.0 0.25
assign ( resid 19 and name HN ) ( resid 126 and name HA ) 4.5  3.0 0.25
assign ( resid 19 and name HA ) ( resid 19 and name HB ) 3.5  3.0 0.25
assign ( resid 19 and name HD1# ) ( resid 20 and name HN ) 3.5  3.0 0.25
assign ( resid 19 and name HD1# ) ( resid 29 and name HD1# ) 5.5  3.0 0.25
assign ( resid 19 and name HD1# ) ( resid 29 and name HD2# ) 5.5  3.0 0.25
assign ( resid 19 and name HD1# ) ( resid 29 and name HG ) 4.5  3.0 0.25
assign ( resid 19 and name HD1# ) ( resid 27 and name HG ) 5.5  3.0 0.25
!Val 20
assign ( resid 20 and name HN ) ( resid 19 and name HA ) 2.5  3.0 0.25
assign ( resid 20 and name HN ) ( resid 19 and name HG2# ) 5.5  3.0 0.25
assign ( resid 20 and name HN ) ( resid 20 and name HA ) 3.5  3.0 0.25
assign ( resid 20 and name HN ) ( resid 20 and name HB ) 3.0  3.0 0.25
assign ( resid 20 and name HN ) ( resid 20 and name HG1# ) 4.2  3.0 0.25
assign ( resid 20 and name HN ) ( resid 20 and name HG2# ) 3.5  3.0 0.25
assign ( resid 20 and name HN ) ( resid 21 and name HN ) 4.2  3.0 0.25
assign ( resid 20 and name HN ) ( resid 27 and name HD2# ) 4.0  3.0 0.25
assign ( resid 20 and name HA ) ( resid 20 and name HB ) 4.5  3.0 0.25
assign ( resid 20 and name HA ) ( resid 20 and name HG1# ) 5.0  3.0 0.25
assign ( resid 20 and name HA ) ( resid 20 and name HG2# ) 4.0  3.0 0.25
assign ( resid 20 and name HG1# ) ( resid 128 and name HA ) 4.5  3.0 0.25
!Val 21
assign ( resid 21 and name HN ) ( resid 20 and name HA ) 2.5  3.0 0.25
assign ( resid 21 and name HN ) ( resid 21 and name HA ) 4.5  3.0 0.25
assign ( resid 21 and name HN ) ( resid 21 and name HB ) 3.5  3.0 0.25
assign ( resid 21 and name HA ) ( resid 21 and name HB ) 3.5  3.0 0.25
assign ( resid 21 and name HA ) ( resid 21 and name HG1# ) 4.5  3.0 0.25
assign ( resid 21 and name HA ) ( resid 21 and name HG2# ) 4.0  3.0 0.25
!Val 22
assign ( resid 22 and name HN ) ( resid 21 and name HA ) 2.5  3.0 0.25
assign ( resid 22 and name HN ) ( resid 21 and name HB ) 3.7  3.0 0.25
assign ( resid 22 and name HB ) ( resid 22 and name HA ) 3.0  3.0 0.25
!assign ( resid 22 and name HN ) ( resid 24 and name HA2 ) 5.5  3.0 0.25
!Ala 23
assign ( resid 23 and name HN ) ( resid 21 and name HG# ) 4.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 22 and name HA ) 2.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 23 and name HA ) 3.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 23 and name HB# ) 3.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 24 and name HN ) 5.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 129 and name HN ) 4.5  3.0 0.25
assign ( resid 23 and name HN ) ( resid 130 and name HA ) 4.5  3.0 0.25
assign ( resid 23 and name HB# ) ( resid 128 and name HG2# ) 6.0  3.0 0.25
assign ( resid 23 and name HB# ) ( resid 130 and name HB# ) 5.5  3.0 0.25
!Gly 24
assign ( resid 24 and name HN ) ( resid 23 and name HB# ) 4.2  3.0 0.25
assign ( resid 24 and name HN ) ( resid 24 and name HA1 ) 3.0  3.0 0.25
assign ( resid 24 and name HN ) ( resid 24 and name HA2 ) 3.0  3.0 0.25
assign ( resid 24 and name HN ) ( resid 101 and name HN ) 5.0  3.0 0.25
!assign ( resid 24 and name HN ) ( resid 105 and name HN ) 3.5  3.0 0.25
!Asn 25
assign ( resid 25 and name HN ) ( resid 21 and name HG# ) 6.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 23 and name HA ) 4.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 24 and name HN ) 3.0  3.0 0.25
assign ( resid 25 and name HN ) ( resid 24 and name HA1 ) 3.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 24 and name HA2 ) 4.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 25 and name HA ) 3.0  3.0 0.25
assign ( resid 25 and name HN ) ( resid 25 and name HB1 ) 3.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 25 and name HB2 ) 3.5  3.0 0.25
assign ( resid 25 and name HN ) ( resid 27 and name HB1 ) 5.0  3.0 0.25
assign ( resid 25 and name HA ) ( resid 25 and name HB1 ) 3.0  3.0 0.25
assign ( resid 25 and name HA ) ( resid 25 and name HB2 ) 3.0  3.0 0.25
!Lys 26
assign ( resid 26 and name HN ) ( resid 25 and name HA ) 3.5  3.0 0.25
assign ( resid 26 and name HN ) ( resid 25 and name HB1 ) 3.5  3.0 0.25
assign ( resid 26 and name HN ) ( resid 25 and name HB2 ) 3.8  3.0 0.25 
assign ( resid 26 and name HN ) ( resid 26 and name HB# ) 4.0  3.0 0.25 
assign ( resid 26 and name HN ) ( resid 26 and name HG# ) 4.5  3.0 0.25 
!Leu 27
assign ( resid 27 and name HN ) ( resid 26 and name HA ) 3.0  3.0 0.25
assign ( resid 27 and name HN ) ( resid 27 and name HA ) 3.5  3.0 0.25
assign ( resid 27 and name HN ) ( resid 27 and name HB1 ) 3.5  3.0 0.25
assign ( resid 27 and name HN ) ( resid 27 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 27 and name HN ) ( resid 98 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 27 and name HA ) ( resid 26 and name HB# ) 4.5  3.0 0.25 
assign ( resid 27 and name HA ) ( resid 27 and name HB1 ) 3.5  3.0 0.25
assign ( resid 27 and name HA ) ( resid 27 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 27 and name HA ) ( resid 27 and name HD1# ) 4.5  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 28 and name HN ) 4.5  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 28 and name HA ) 4.5  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 21 and name HB ) 5.2  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 29 and name HB# ) 5.0  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 98 and name HN ) 4.7  3.0 0.25 
assign ( resid 27 and name HD1# ) ( resid 96 and name HE# ) 8.0  3.0 0.25 
assign ( resid 27 and name HD2# ) ( resid 27 and name HA ) 4.5  3.0 0.25 
assign ( resid 27 and name HD2# ) ( resid 98 and name HB ) 6.0  3.0 0.25 
assign ( resid 27 and name HD2# ) ( resid 29 and name HB# ) 5.5  3.0 0.25 
!Arg 28
assign ( resid 28 and name HN ) ( resid 27 and name HA ) 3.0  3.0 0.25
assign ( resid 28 and name HN ) ( resid 28 and name HA ) 4.5  3.0 0.25
assign ( resid 28 and name HN ) ( resid 29 and name HN ) 4.5  3.0 0.25
assign ( resid 28 and name HN ) ( resid 28 and name HB# ) 4.0  3.0 0.25
assign ( resid 28 and name HN ) ( resid 28 and name HG# ) 4.5  3.0 0.25
assign ( resid 28 and name HA ) ( resid 27 and name HB2 ) 5.5  3.0 0.25
assign ( resid 28 and name HA ) ( resid 97 and name HG2# ) 5.0  3.0 0.25
!Leu 29
assign ( resid 29 and name HN ) ( resid 28 and name HA ) 2.5  3.0 0.25
assign ( resid 29 and name HN ) ( resid 29 and name HB2 ) 3.0  3.0 0.25
assign ( resid 29 and name HN ) ( resid 29 and name HB1 ) 4.5  3.0 0.25
assign ( resid 29 and name HN ) ( resid 29 and name HD1# ) 5.5  3.0 0.25
assign ( resid 29 and name HN ) ( resid 95 and name HG2# ) 4.5  3.0 0.25
assign ( resid 29 and name HA ) ( resid 29 and name HB1 ) 3.5  3.0 0.25
assign ( resid 29 and name HA ) ( resid 29 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 29 and name HA ) ( resid 29 and name HD1# ) 4.0  3.0 0.25
assign ( resid 29 and name HA ) ( resid 29 and name HD2# ) 6.5  3.0 0.25
assign ( resid 29 and name HD1# ) ( resid 30 and name HN ) 4.5  3.0 0.25
assign ( resid 29 and name HD2# ) ( resid 30 and name HN ) 5.5  3.0 0.25
assign ( resid 29 and name HD2# ) ( resid 124 and name HG ) 5.0  3.0 0.25
!Asp 30
assign ( resid 30 and name HN ) ( resid 29 and name HA ) 2.5  3.0 0.25
assign ( resid 30 and name HN ) ( resid 29 and name HB2 ) 4.0  3.0 0.25
assign ( resid 30 and name HN ) ( resid 30 and name HA ) 4.5  3.0 0.25
assign ( resid 30 and name HN ) ( resid 30 and name HB2 ) 2.5  3.0 0.25
assign ( resid 30 and name HN ) ( resid 30 and name HB1 ) 3.5  3.0 0.25
assign ( resid 30 and name HA ) ( resid 30 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 30 and name HA ) ( resid 30 and name HB1 ) 3.5  3.0 0.25 
!Val 31
assign ( resid 31 and name HN ) ( resid 30 and name HA ) 2.5  3.0 0.25
assign ( resid 31 and name HN ) ( resid 31 and name HA ) 4.5  3.0 0.25
assign ( resid 31 and name HN ) ( resid 31 and name HB ) 3.5  3.0 0.25
assign ( resid 31 and name HN ) ( resid 31 and name HG1# ) 4.0  3.0 0.25
assign ( resid 31 and name HN ) ( resid 31 and name HG2# ) 5.5  3.0 0.25
assign ( resid 31 and name HN ) ( resid 95 and name HG1# ) 4.5  3.0 0.25
assign ( resid 31 and name HA ) ( resid 32 and name HD# ) 3.5  3.0 0.25
assign ( resid 31 and name HA ) ( resid 16 and name HD# ) 5.5  3.0 0.25
assign ( resid 31 and name HA ) ( resid 31 and name HG1# ) 5.5  3.0 0.25
assign ( resid 31 and name HA ) ( resid 31 and name HG2# ) 5.5  3.0 0.25
assign ( resid 31 and name HG1# ) ( resid 43 and name HH2 ) 5.5  3.0 0.25
assign ( resid 31 and name HG1# ) ( resid 43 and name HZ2 ) 5.5  3.0 0.25
assign ( resid 31 and name HG2# ) ( resid 94 and name HB# ) 5.5  3.0 0.25
!Pro 32
assign ( resid 32 and name HA ) ( resid 93 and name HA ) 3.0  3.0 0.25
!Ile 33
assign ( resid 33 and name HN ) ( resid 32 and name HA ) 2.5  3.0 0.25
assign ( resid 33 and name HN ) ( resid 33 and name HA ) 4.5  3.0 0.25
assign ( resid 33 and name HN ) ( resid 33 and name HB ) 4.5  3.0 0.25
assign ( resid 33 and name HN ) ( resid 33 and name HG1# ) 4.0  3.0 0.25
assign ( resid 33 and name HN ) ( resid 33 and name HG2# ) 4.5  3.0 0.25
assign ( resid 33 and name HN ) ( resid 33 and name HD1# ) 4.5  3.0 0.25
assign ( resid 33 and name HN ) ( resid 93 and name HA ) 3.5  3.0 0.25
assign ( resid 33 and name HA ) ( resid 8 and name HD2 ) 5.5  3.0 0.25
assign ( resid 33 and name HA ) ( resid 15 and name HD1# ) 5.5  3.0 0.25
assign ( resid 33 and name HA ) ( resid 33 and name HB ) 3.5  3.0 0.25
assign ( resid 33 and name HA ) ( resid 33 and name HG2# ) 3.5  3.0 0.25
assign ( resid 33 and name HG2# ) ( resid 7 and name HN ) 4.5  3.0 0.25
assign ( resid 33 and name HG2# ) ( resid 111 and name HG1# ) 6.5  3.0 0.25
!Ser 34
assign ( resid 34 and name HN ) ( resid 7 and name HA ) 4.5  3.0 0.25 
assign ( resid 34 and name HN ) ( resid 33 and name HA ) 2.5  3.0 0.25
assign ( resid 34 and name HN ) ( resid 33 and name HB ) 3.0  3.0 0.25
assign ( resid 34 and name HN ) ( resid 33 and name HG1# ) 5.5  3.0 0.25
assign ( resid 34 and name HN ) ( resid 33 and name HG2# ) 3.5  3.0 0.25
assign ( resid 34 and name HN ) ( resid 34 and name HA ) 3.5  3.0 0.25 
assign ( resid 34 and name HN ) ( resid 34 and name HB1 ) 3.1  3.0 0.25 
assign ( resid 34 and name HN ) ( resid 34 and name HB2 ) 3.0  3.0 0.25 
!Gly 35
assign ( resid 35 and name HN ) ( resid 34 and name HA ) 3.0  3.0 0.25 
assign ( resid 35 and name HN ) ( resid 34 and name HB2 ) 3.2  3.0 0.25 
assign ( resid 35 and name HN ) ( resid 34 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 35 and name HN ) ( resid 35 and name HA1 ) 3.0  3.0 0.25 
assign ( resid 35 and name HN ) ( resid 35 and name HA2 ) 3.0  3.0 0.25 
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 4.5  3.0 0.25 
!Asp 36
assign ( resid 36 and name HN ) ( resid 5 and name HB# ) 5.6  3.0 0.25 
assign ( resid 36 and name HN ) ( resid 35 and name HA1 ) 3.2  3.0 0.25 
assign ( resid 36 and name HN ) ( resid 35 and name HA2 ) 3.0  3.0 0.25 
assign ( resid 36 and name HN ) ( resid 36 and name HA ) 3.0  3.0 0.25 
assign ( resid 36 and name HN ) ( resid 36 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 36 and name HN ) ( resid 36 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 36 and name HA ) ( resid 36 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 36 and name HA ) ( resid 36 and name HB2 ) 2.5  3.0 0.25 
assign ( resid 36 and name HA ) ( resid 37 and name HA ) 2.5  3.0 0.25 
assign ( resid 36 and name HB1 ) ( resid 3 and name HA ) 4.7  3.0 0.25 
assign ( resid 36 and name HB2 ) ( resid 3 and name HA ) 4.7  3.0 0.25 
!Pro 37
!Ala 38
assign ( resid 38 and name HN ) ( resid 37 and name HA ) 4.0  3.0 0.25 
assign ( resid 38 and name HN ) ( resid 37 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 38 and name HN ) ( resid 37 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 38 and name HN ) ( resid 38 and name HB# ) 4.0  3.0 0.25 
assign ( resid 38 and name HA ) ( resid 39 and name HD2 ) 3.0  3.0 0.25 
assign ( resid 38 and name HA ) ( resid 39 and name HD1 ) 3.0  3.0 0.25 
!assign ( resid 38 and name HA ) ( resid 91 and name HG# ) 5.0  3.0 0.25 
assign ( resid 38 and name HB# ) ( resid 39 and name HD2 ) 4.5  3.0 0.25 
assign ( resid 38 and name HB# ) ( resid 39 and name HD1 ) 4.0  3.0 0.25 
!assign ( resid 38 and name HB# ) ( resid 91 and name HG# ) 5.5  3.0 0.25 
!Pro 39
!Thr 40
assign ( resid 40 and name HN ) ( resid 39 and name HA ) 2.5  3.0 0.25 
assign ( resid 40 and name HN ) ( resid 40 and name HA ) 3.5  3.0 0.25 
assign ( resid 40 and name HN ) ( resid 40 and name HB ) 3.0  3.0 0.25 
assign ( resid 40 and name HN ) ( resid 40 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 40 and name HN ) ( resid 41 and name HN ) 3.5  3.0 0.25 
assign ( resid 40 and name HN ) ( resid 113 and name HB ) 5.3  3.0 0.25 
assign ( resid 40 and name HB ) ( resid 40 and name HA ) 3.0  3.0 0.25 
assign ( resid 40 and name HB ) ( resid 42 and name HN ) 4.5  3.0 0.25 
assign ( resid 40 and name HG2# ) ( resid 40 and name HA ) 4.5  3.0 0.25 
!Val 41
assign ( resid 41 and name HN ) ( resid 40 and name HA ) 3.5  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 40 and name HB ) 4.3  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 40 and name HG2# ) 4.8  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 41 and name HA ) 4.5  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 41 and name HB ) 3.2  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 41 and name HG1# ) 3.7  3.0 0.25 
assign ( resid 41 and name HN ) ( resid 41 and name HG2# ) 4.2  3.0 0.25 
assign ( resid 41 and name HA ) ( resid 113 and name HA ) 3.5  3.0 0.25 
assign ( resid 41 and name HB ) ( resid 39 and name HB2 ) 4.0  3.0 0.25 
assign ( resid 41 and name HB ) ( resid 113 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 41 and name HG1# ) ( resid 43 and name HE1 ) 4.0  3.0 0.25 
assign ( resid 41 and name HG2# ) ( resid 94 and name HB# ) 3.5  3.0 0.25 
assign ( resid 41 and name HG2# ) ( resid 41 and name HA ) 3.5  3.0 0.25 
assign ( resid 41 and name HG2# ) ( resid 43 and name HE1 ) 4.5  3.0 0.25 
!Ile 42
assign ( resid 42 and name HN ) ( resid 41 and name HA ) 2.5  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 42 and name HA ) 3.5  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 42 and name HB ) 3.0  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 42 and name HG11 ) 3.5  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 42 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 42 and name HD1# ) 4.0  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 112 and name HN ) 3.5  3.0 0.25 
assign ( resid 42 and name HN ) ( resid 113 and name HA ) 4.5  3.0 0.25 
assign ( resid 42 and name HA ) ( resid 42 and name HG11 ) 4.5  3.0 0.25 
assign ( resid 42 and name HA ) ( resid 42 and name HG12 ) 4.5  3.0 0.25 
assign ( resid 42 and name HA ) ( resid 42 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 42 and name HA ) ( resid 42 and name HD1# ) 4.5  3.0 0.25 
assign ( resid 42 and name HG2# ) ( resid 42 and name HB ) 3.0  3.0 0.25 
assign ( resid 42 and name HG2# ) ( resid 43 and name HN ) 4.0  3.0 0.25 
assign ( resid 42 and name HG2# ) ( resid 112 and name HB ) 4.0  3.0 0.25 
assign ( resid 42 and name HD1# ) ( resid 40 and name HB ) 5.5  3.0 0.25 
assign ( resid 42 and name HD1# ) ( resid 40 and name HG2# ) 6.5  3.0 0.25 
!Trp 43
assign ( resid 43 and name HN ) ( resid 42 and name HA ) 3.0  3.0 0.25 
assign ( resid 43 and name HN ) ( resid 43 and name HA ) 4.5  3.0 0.25 
assign ( resid 43 and name HN ) ( resid 43 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 43 and name HN ) ( resid 43 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 43 and name HA ) ( resid 111 and name HA ) 3.5  3.0 0.25 
assign ( resid 43 and name HA ) ( resid 43 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 43 and name HA ) ( resid 43 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 43 and name HE1 ) ( resid 94 and name HA ) 3.7  3.0 0.25 
assign ( resid 43 and name HE1 ) ( resid 94 and name HB# ) 3.5  3.0 0.25 
assign ( resid 43 and name HE3 ) ( resid 41 and name HG2# ) 5.5  3.0 0.25 
assign ( resid 43 and name HE3 ) ( resid 124 and name HD2# ) 3.5  3.0 0.25 
assign ( resid 43 and name HE3 ) ( resid 124 and name HD1# ) 3.7  3.0 0.25 
assign ( resid 43 and name HE3 ) ( resid 111 and name HB ) 3.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 94 and name HA ) 4.2  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 94 and name HB# ) 3.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 95 and name HA ) 3.8  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 96 and name HD# ) 5.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 31 and name HB ) 4.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 41 and name HG1# ) 5.2  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 29 and name HG ) 5.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 111 and name HG1# ) 5.5  3.0 0.25 
assign ( resid 43 and name HZ2 ) ( resid 111 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 43 and name HZ3 ) ( resid 110 and name HA ) 5.5  3.0 0.25 
assign ( resid 43 and name HZ3 ) ( resid 43 and name HB2 ) 6.5  3.0 0.25 
assign ( resid 43 and name HZ3 ) ( resid 43 and name HB1 ) 5.5  3.0 0.25 
assign ( resid 43 and name HZ3 ) ( resid 109 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 43 and name HZ3 ) ( resid 122 and name HG# ) 5.2  3.0 0.25 
assign ( resid 43 and name HH2 ) ( resid 96 and name HB# ) 5.5  3.0 0.25 
!Gln 44
assign ( resid 44 and name HN ) ( resid 43 and name HA ) 2.5  3.0 0.25 
assign ( resid 44 and name HN ) ( resid 44 and name HA ) 5.5  3.0 0.25 
assign ( resid 44 and name HN ) ( resid 44 and name HB# ) 4.5  3.0 0.25 
assign ( resid 44 and name HN ) ( resid 44 and name HG# ) 4.5  3.0 0.25 
assign ( resid 44 and name HN ) ( resid 110 and name HN ) 3.0  3.0 0.25 
assign ( resid 44 and name HE21 ) ( resid 42 and name HG2# ) 5.5  3.0 0.25 
!Lys 45
assign ( resid 45 and name HN ) ( resid 44 and name HA ) 2.5  3.0 0.25 
assign ( resid 45 and name HN ) ( resid 45 and name HA ) 4.5  3.0 0.25 
assign ( resid 45 and name HN ) ( resid 45 and name HB# ) 4.5  3.0 0.25 
assign ( resid 45 and name HA ) ( resid 109 and name HA ) 3.5  3.0 0.25 
!Ala 46
assign ( resid 46 and name HN ) ( resid 45 and name HA ) 2.5  3.0 0.25 
assign ( resid 46 and name HN ) ( resid 46 and name HA ) 3.5  3.0 0.25 
assign ( resid 46 and name HN ) ( resid 48 and name HG2# ) 6.5  3.0 0.25 
assign ( resid 46 and name HN ) ( resid 109 and name HA ) 3.5  3.0 0.25 
!Ile 47
assign ( resid 47 and name HN ) ( resid 46 and name HA ) 3.0  3.0 0.25 
assign ( resid 47 and name HN ) ( resid 46 and name HB# ) 4.0  3.0 0.25 
assign ( resid 47 and name HN ) ( resid 47 and name HA ) 3.0  3.0 0.25 
assign ( resid 47 and name HN ) ( resid 47 and name HB ) 3.1  3.0 0.25 
assign ( resid 47 and name HN ) ( resid 47 and name HG1# ) 4.1  3.0 0.25 
assign ( resid 47 and name HN ) ( resid 47 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 47 and name HA ) ( resid 47 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 47 and name HA ) ( resid 47 and name HD1# ) 4.4  3.0 0.25 
!Thr 48
assign ( resid 48 and name HN ) ( resid 47 and name HA ) 3.2  3.0 0.25 
assign ( resid 48 and name HN ) ( resid 47 and name HB ) 3.7  3.0 0.25 
assign ( resid 48 and name HN ) ( resid 48 and name HA ) 3.5  3.0 0.25 
assign ( resid 48 and name HN ) ( resid 48 and name HB ) 3.7  3.0 0.25 
assign ( resid 48 and name HN ) ( resid 48 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 48 and name HA ) ( resid 48 and name HB ) 3.0  3.0 0.25 
assign ( resid 48 and name HA ) ( resid 48 and name HG2# ) 4.0  3.0 0.25 
!Gln 49
assign ( resid 49 and name HN ) ( resid 47 and name HN ) 4.5  3.0 0.25 
assign ( resid 49 and name HN ) ( resid 48 and name HA ) 4.5  3.0 0.25 
assign ( resid 49 and name HN ) ( resid 49 and name HA ) 3.0  3.0 0.25 
!Gly 50
!Asn 51
assign ( resid 51 and name HN ) ( resid 51 and name HA ) 3.5  3.0 0.25 
assign ( resid 51 and name HN ) ( resid 51 and name HB1 ) 5.5  3.0 0.25 
assign ( resid 51 and name HN ) ( resid 51 and name HB2 ) 5.5  3.0 0.25 
assign ( resid 51 and name HA ) ( resid 51 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 51 and name HA ) ( resid 51 and name HB2 ) 4.5  3.0 0.25 
!Lys 52
!Ala 53
assign ( resid 53 and name HN ) ( resid 52 and name HA ) 2.5  3.0 0.25 
assign ( resid 53 and name HN ) ( resid 52 and name HB# ) 2.5  3.0 0.25 
assign ( resid 53 and name HN ) ( resid 52 and name HG# ) 2.5  3.0 0.25 
assign ( resid 53 and name HN ) ( resid 53 and name HA ) 3.5  3.0 0.25 
assign ( resid 53 and name HN ) ( resid 53 and name HB# ) 3.5  3.0 0.25 
assign ( resid 53 and name HA ) ( resid 54 and name HD1 ) 3.0  3.0 0.25 
assign ( resid 53 and name HA ) ( resid 54 and name HD2 ) 3.0  3.0 0.25 
assign ( resid 53 and name HA ) ( resid 53 and name HB# ) 3.5  3.0 0.25 
assign ( resid 53 and name HB# ) ( resid 54 and name HD1 ) 3.5  3.0 0.25 
assign ( resid 53 and name HB# ) ( resid 54 and name HD2 ) 3.5  3.0 0.25 
!Pro 54
!Ala 55
assign ( resid 55 and name HN ) ( resid 54 and name HA ) 2.5  3.0 0.25 
assign ( resid 55 and name HN ) ( resid 54 and name HB# ) 4.5  3.0 0.25 
assign ( resid 55 and name HN ) ( resid 54 and name HG# ) 4.5  3.0 0.25 
assign ( resid 55 and name HN ) ( resid 55 and name HA ) 3.0  3.0 0.25 
assign ( resid 55 and name HN ) ( resid 55 and name HB# ) 4.0  3.0 0.25 
assign ( resid 55 and name HB# ) ( resid 57 and name HG# ) 6.0  3.0 0.25 
!Arg 56
assign ( resid 56 and name HN ) ( resid 55 and name HA ) 2.5  3.0 0.25 
assign ( resid 56 and name HN ) ( resid 56 and name HA ) 3.0  3.0 0.25 
assign ( resid 56 and name HN ) ( resid 56 and name HB# ) 4.0  3.0 0.25 
assign ( resid 56 and name HN ) ( resid 56 and name HG# ) 4.0  3.0 0.25 
assign ( resid 56 and name HN ) ( resid 56 and name HD# ) 5.0  3.0 0.25 
assign ( resid 56 and name HA ) ( resid 56 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 56 and name HA ) ( resid 56 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 56 and name HA ) ( resid 57 and name HD1 ) 3.5  3.0 0.25 
assign ( resid 56 and name HA ) ( resid 57 and name HD2 ) 3.5  3.0 0.25 
assign ( resid 56 and name HB1 ) ( resid 57 and name HD1 ) 4.5  3.0 0.25 
assign ( resid 56 and name HB2 ) ( resid 57 and name HD2 ) 4.3  3.0 0.25 
!Pro 57
!assign ( resid 57 and name HB2 ) ( resid 55 and name HB# ) 5.5  3.0 0.25 
!Ala 58
assign ( resid 58 and name HN ) ( resid 57 and name HA ) 2.5  3.0 0.25 
assign ( resid 58 and name HN ) ( resid 57 and name HB# ) 4.0  3.0 0.25 
assign ( resid 58 and name HN ) ( resid 57 and name HG# ) 5.0  3.0 0.25 
assign ( resid 58 and name HN ) ( resid 58 and name HA ) 3.0  3.0 0.25 
assign ( resid 58 and name HN ) ( resid 58 and name HB# ) 4.0  3.0 0.25 
assign ( resid 58 and name HA ) ( resid 59 and name HD1 ) 3.0  3.0 0.25 
assign ( resid 58 and name HA ) ( resid 59 and name HD2 ) 3.0  3.0 0.25 
!Pro 59
!Asp 60
assign ( resid 60 and name HN ) ( resid 59 and name HA ) 2.5  3.0 0.25 
assign ( resid 60 and name HN ) ( resid 59 and name HB# ) 4.0  3.0 0.25 
assign ( resid 60 and name HN ) ( resid 60 and name HA ) 3.0  3.0 0.25 
assign ( resid 60 and name HN ) ( resid 60 and name HB# ) 4.0  3.0 0.25 
assign ( resid 60 and name HN ) ( resid 61 and name HN ) 3.0  3.0 0.25 
assign ( resid 60 and name HN ) ( resid 61 and name HB# ) 5.5  3.0 0.25 
assign ( resid 60 and name HA ) ( resid 60 and name HB# ) 4.0  3.0 0.25 
!Ala 61
assign ( resid 61 and name HN ) ( resid 59 and name HA ) 4.5  3.0 0.25 
assign ( resid 61 and name HN ) ( resid 60 and name HA ) 2.5  3.0 0.25 
assign ( resid 61 and name HN ) ( resid 60 and name HB# ) 4.5  3.0 0.25 
assign ( resid 61 and name HN ) ( resid 61 and name HA ) 3.0  3.0 0.25 
assign ( resid 61 and name HN ) ( resid 61 and name HB# ) 3.5  3.0 0.25 
assign ( resid 61 and name HA ) ( resid 62 and name HD1 ) 3.0  3.0 0.25 
assign ( resid 61 and name HA ) ( resid 62 and name HD2 ) 3.0  3.0 0.25 
assign ( resid 61 and name HB# ) ( resid 62 and name HD1 ) 5.0  3.0 0.25 
assign ( resid 61 and name HB# ) ( resid 62 and name HD2 ) 5.5  3.0 0.25 
!Pro 62
assign ( resid 62 and name HA ) ( resid 60 and name HB# ) 5.5  3.0 0.25 
assign ( resid 62 and name HB1 ) ( resid 60 and name HB# ) 4.2  3.0 0.25 
assign ( resid 62 and name HB2 ) ( resid 60 and name HB# ) 5.8  3.0 0.25 
assign ( resid 62 and name HG# ) ( resid 61 and name HA ) 4.5  3.0 0.25 
!Glu 63
assign ( resid 63 and name HN ) ( resid 62 and name HA ) 3.0  3.0 0.25 
assign ( resid 63 and name HN ) ( resid 63 and name HA ) 3.5  3.0 0.25 
assign ( resid 63 and name HN ) ( resid 63 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 63 and name HN ) ( resid 63 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 63 and name HN ) ( resid 63 and name HG# ) 3.5  3.0 0.25 
assign ( resid 63 and name HA ) ( resid 63 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 63 and name HA ) ( resid 63 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 63 and name HA ) ( resid 63 and name HG# ) 4.5  3.0 0.25 
!Asp 64
assign ( resid 64 and name HN ) ( resid 63 and name HA ) 2.5  3.0 0.25 
assign ( resid 64 and name HN ) ( resid 64 and name HA ) 3.0  3.0 0.25 
assign ( resid 64 and name HN ) ( resid 64 and name HB# ) 4.0  3.0 0.25 
!Thr 65
assign ( resid 65 and name HN ) ( resid 64 and name HA ) 2.5  3.0 0.25 
assign ( resid 65 and name HN ) ( resid 65 and name HA ) 3.0  3.0 0.25 
assign ( resid 65 and name HN ) ( resid 65 and name HB ) 3.7  3.0 0.25 
assign ( resid 65 and name HN ) ( resid 65 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 65 and name HN ) ( resid 66 and name HN ) 3.0  3.0 0.25 
assign ( resid 65 and name HA ) ( resid 65 and name HG2# ) 4.0  3.0 0.25 
!Gly 66
assign ( resid 66 and name HN ) ( resid 65 and name HA ) 3.5  3.0 0.25 
!Asp 67
assign ( resid 67 and name HN ) ( resid 66 and name HA# ) 4.5  3.0 0.25 
assign ( resid 67 and name HN ) ( resid 67 and name HA ) 3.5  3.0 0.25 
assign ( resid 67 and name HN ) ( resid 67 and name HB# ) 3.0  3.0 0.25 
!Ser 68
assign ( resid 68 and name HN ) ( resid 67 and name HA ) 3.0  3.0 0.25 
assign ( resid 68 and name HN ) ( resid 68 and name HA ) 3.5  3.0 0.25 
assign ( resid 68 and name HN ) ( resid 68 and name HB# ) 3.5  3.0 0.25 
!Asp 69
assign ( resid 69 and name HN ) ( resid 67 and name HN ) 4.5  3.0 0.25 
assign ( resid 69 and name HN ) ( resid 68 and name HA ) 3.5  3.0 0.25 
assign ( resid 69 and name HN ) ( resid 69 and name HA ) 3.0  3.0 0.25 
assign ( resid 69 and name HN ) ( resid 69 and name HB# ) 4.5  3.0 0.25 
!Glu 70
assign ( resid 70 and name HN ) ( resid 69 and name HA ) 3.5  3.0 0.25 
assign ( resid 70 and name HN ) ( resid 70 and name HA ) 3.5  3.0 0.25 
!Trp 71
assign ( resid 71 and name HN ) ( resid 70 and name HA ) 2.5  3.0 0.25 
assign ( resid 71 and name HN ) ( resid 70 and name HB# ) 2.5  3.0 0.25 
assign ( resid 71 and name HN ) ( resid 71 and name HA ) 3.0  3.0 0.25 
assign ( resid 71 and name HN ) ( resid 71 and name HD1 ) 4.6  3.0 0.25 
assign ( resid 71 and name HN ) ( resid 72 and name HN ) 4.5  3.0 0.25 
!assign ( resid 71 and name HN ) ( resid 108 and name HG2# ) 5.5  3.0 0.25 
assign ( resid 71 and name HA ) ( resid 71 and name HD1 ) 4.0  3.0 0.25 
assign ( resid 71 and name HA ) ( resid 71 and name HZ3 ) 4.5  3.0 0.25 
assign ( resid 71 and name HA ) ( resid 71 and name HZ2 ) 6.0  3.0 0.25 
assign ( resid 71 and name HA ) ( resid 71 and name HE3 ) 4.5  3.0 0.25 
assign ( resid 71 and name HB# ) ( resid 71 and name HD1 ) 4.5  3.0 0.25 
assign ( resid 71 and name HB# ) ( resid 71 and name HZ2 ) 6.0  3.0 0.25 
assign ( resid 71 and name HE1 ) ( resid 73 and name HA ) 4.5  3.0 0.25 
!Val 72
assign ( resid 72 and name HN ) ( resid 71 and name HA ) 3.0  3.0 0.25 
assign ( resid 72 and name HN ) ( resid 71 and name HB# ) 4.5  3.0 0.25 
assign ( resid 72 and name HN ) ( resid 72 and name HA ) 3.5  3.0 0.25 
assign ( resid 72 and name HN ) ( resid 72 and name HB ) 3.0  3.0 0.25 
assign ( resid 72 and name HN ) ( resid 72 and name HG# ) 6.0  3.0 0.25 
assign ( resid 72 and name HA ) ( resid 72 and name HB ) 3.0  3.0 0.25 
!Phe 73
assign ( resid 73 and name HN ) ( resid 72 and name HN ) 4.5  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 72 and name HA ) 3.2  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 72 and name HB ) 3.5  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 72 and name HG# ) 5.0  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 73 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 73 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 73 and name HN ) ( resid 73 and name HD# ) 5.5  3.0 0.25 
assign ( resid 73 and name HA ) ( resid 73 and name HD# ) 5.5  3.0 0.25 
assign ( resid 73 and name HA ) ( resid 73 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 73 and name HA ) ( resid 73 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 73 and name HB1 ) ( resid 73 and name HD# ) 4.5  3.0 0.25 
assign ( resid 73 and name HB2 ) ( resid 73 and name HD# ) 4.5  3.0 0.25 
!Asp 74
assign ( resid 74 and name HN ) ( resid 73 and name HN ) 4.5  3.0 0.25 
assign ( resid 74 and name HN ) ( resid 73 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 74 and name HN ) ( resid 73 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 74 and name HN ) ( resid 74 and name HA ) 3.0  3.0 0.25 
assign ( resid 74 and name HN ) ( resid 74 and name HB# ) 4.0  3.0 0.25 
!Lys 75
assign ( resid 75 and name HN ) ( resid 74 and name HA ) 3.5  3.0 0.25 
assign ( resid 75 and name HN ) ( resid 75 and name HA ) 3.5  3.0 0.25 
assign ( resid 75 and name HN ) ( resid 75 and name HB# ) 4.5  3.0 0.25 
!Lys 76
!Leu 77
assign ( resid 77 and name HN ) ( resid 76 and name HA ) 3.0  3.0 0.25 
assign ( resid 77 and name HN ) ( resid 77 and name HA ) 3.5  3.0 0.25 
!Leu 78
assign ( resid 78 and name HD# ) ( resid 78 and name HA ) 4.5  3.0 0.25 
assign ( resid 78 and name HD# ) ( resid 78 and name HB# ) 4.5  3.0 0.25 
!Cys 79
assign ( resid 79 and name HN ) ( resid 79 and name HA ) 3.5  3.0 0.25 
assign ( resid 79 and name HN ) ( resid 79 and name HB# ) 4.5  3.0 0.25 
!Glu 80
!Thr 81
assign ( resid 81 and name HN ) ( resid 80 and name HA ) 3.5  3.0 0.25 
assign ( resid 81 and name HN ) ( resid 81 and name HA ) 3.0  3.0 0.25 
assign ( resid 81 and name HN ) ( resid 81 and name HB ) 4.5  3.0 0.25 
assign ( resid 81 and name HN ) ( resid 81 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 81 and name HB ) ( resid 81 and name HA ) 3.5  3.0 0.25 
!Glu 82
assign ( resid 82 and name HN ) ( resid 81 and name HA ) 3.5  3.0 0.25 
assign ( resid 82 and name HN ) ( resid 82 and name HA ) 3.5  3.0 0.25 
!Gly 83
assign ( resid 83 and name HN ) ( resid 82 and name HA ) 3.3  3.0 0.25 
assign ( resid 83 and name HN ) ( resid 82 and name HG# ) 4.5  3.0 0.25 
assign ( resid 83 and name HN ) ( resid 83 and name HA# ) 3.0  3.0 0.25 
!Arg 84
assign ( resid 84 and name HN ) ( resid 81 and name HN ) 3.5  3.0 0.25 
assign ( resid 84 and name HN ) ( resid 83 and name HA# ) 3.5  3.0 0.25 
assign ( resid 84 and name HN ) ( resid 84 and name HA ) 3.5  3.0 0.25 
assign ( resid 84 and name HN ) ( resid 84 and name HB# ) 4.5  3.0 0.25 
assign ( resid 84 and name HN ) ( resid 84 and name HG# ) 4.5  3.0 0.25 
!Val 85
assign ( resid 85 and name HN ) ( resid 81 and name HB ) 3.5  3.0 0.25 
assign ( resid 85 and name HN ) ( resid 84 and name HA ) 3.5  3.0 0.25 
assign ( resid 85 and name HN ) ( resid 85 and name HA ) 4.5  3.0 0.25 
assign ( resid 85 and name HN ) ( resid 85 and name HB ) 4.5  3.0 0.25 
assign ( resid 85 and name HN ) ( resid 85 and name HG# ) 4.5  3.0 0.25 
assign ( resid 85 and name HB ) ( resid 85 and name HA ) 3.0  3.0 0.25 
assign ( resid 85 and name HG# ) ( resid 79 and name HB# ) 6.5  3.0 0.25 
assign ( resid 85 and name HG# ) ( resid 87 and name HB ) 5.0  3.0 0.25 
!Arg 86
assign ( resid 86 and name HN ) ( resid 85 and name HA ) 3.0  3.0 0.25 
assign ( resid 86 and name HN ) ( resid 86 and name HA ) 4.5  3.0 0.25 
assign ( resid 86 and name HN ) ( resid 86 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 86 and name HN ) ( resid 86 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 86 and name HN ) ( resid 98 and name HN ) 4.5  3.0 0.25 
assign ( resid 86 and name HN ) ( resid 98 and name HG2# ) 4.5  3.0 0.25 
!Val 87
assign ( resid 87 and name HN ) ( resid 86 and name HA ) 3.0  3.0 0.25 
assign ( resid 87 and name HN ) ( resid 87 and name HA ) 4.5  3.0 0.25 
assign ( resid 87 and name HN ) ( resid 87 and name HB ) 3.5  3.0 0.25 
!Glu 88
assign ( resid 88 and name HN ) ( resid 87 and name HA ) 3.0  3.0 0.25 
assign ( resid 88 and name HN ) ( resid 88 and name HA ) 4.5  3.0 0.25 
assign ( resid 88 and name HN ) ( resid 88 and name HB# ) 4.5  3.0 0.25 
!Thr 89
assign ( resid 89 and name HN ) ( resid 88 and name HA ) 2.5  3.0 0.25 
assign ( resid 89 and name HN ) ( resid 89 and name HA ) 4.5  3.0 0.25 
assign ( resid 89 and name HN ) ( resid 89 and name HB ) 3.5  3.0 0.25 
assign ( resid 89 and name HN ) ( resid 89 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 89 and name HA ) ( resid 89 and name HB ) 4.5  3.0 0.25 
assign ( resid 89 and name HA ) ( resid 89 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 89 and name HA ) ( resid 94 and name HA ) 3.5  3.0 0.25 
assign ( resid 89 and name HA ) ( resid 94 and name HB# ) 5.5  3.0 0.25 
assign ( resid 89 and name HG2# ) ( resid 94 and name HA ) 4.5  3.0 0.25 
!Thr 90
assign ( resid 90 and name HN ) ( resid 89 and name HA ) 3.0  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 89 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 90 and name HA ) 3.5  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 90 and name HB ) 3.5  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 90 and name HG2# ) 3.5  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 92 and name HN ) 6.0  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 93 and name HN ) 3.5  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 94 and name HA ) 4.0  3.0 0.25 
assign ( resid 90 and name HN ) ( resid 95 and name HN ) 4.5  3.0 0.25 
assign ( resid 90 and name HA ) ( resid 90 and name HB ) 3.0  3.0 0.25 
assign ( resid 90 and name HA ) ( resid 90 and name HG2# ) 3.5  3.0 0.25 
!Lys 91
!assign ( resid 91 and name HN ) ( resid 39 and name HG# ) 6.2  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 90 and name HA ) 3.0  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 90 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 91 and name HA ) 3.5  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 91 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 91 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 91 and name HN ) ( resid 92 and name HN ) 3.5  3.0 0.25 
!Asp 92
!assign ( resid 92 and name HN ) ( resid 38 and name HB# ) 6.2  3.0 0.25 
!ssign ( resid 92 and name HN ) ( resid 39 and name HG# ) 5.0  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 91 and name HA ) 3.5  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 91 and name HB1 ) 3.9  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 91 and name HB2 ) 4.1  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 92 and name HA ) 3.5  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 92 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 92 and name HB1 ) 3.6  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 93 and name HN ) 2.5  3.0 0.25 
assign ( resid 92 and name HN ) ( resid 94 and name HA ) 6.5  3.0 0.25 
assign ( resid 92 and name HA ) ( resid 92 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 92 and name HA ) ( resid 92 and name HB1 ) 3.5  3.0 0.25 
!Arg 93
assign ( resid 93 and name HN ) ( resid 33 and name HG1# ) 5.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 33 and name HD1# ) 5.0  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 91 and name HN ) 5.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 92 and name HA ) 3.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 93 and name HA ) 4.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 93 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 93 and name HB2 ) 5.5  3.0 0.25 
assign ( resid 93 and name HN ) ( resid 94 and name HN ) 4.5  3.0 0.25 
!assign ( resid 93 and name HA ) ( resid 39 and name HG# ) 6.0  3.0 0.25 
assign ( resid 93 and name HA ) ( resid 93 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 93 and name HA ) ( resid 93 and name HB2 ) 3.0  3.0 0.25 
!Ser 94
assign ( resid 94 and name HN ) ( resid 32 and name HA ) 4.5  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 33 and name HB ) 4.7  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 33 and name HD1# ) 4.5  3.0 0.25 
!assign ( resid 94 and name HN ) ( resid 39 and name HG# ) 5.5  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 41 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 93 and name HA ) 3.0  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 94 and name HA ) 4.5  3.0 0.25 
assign ( resid 94 and name HN ) ( resid 94 and name HB# ) 4.5  3.0 0.25 
assign ( resid 94 and name HA ) ( resid 94 and name HB# ) 3.5  3.0 0.25 
!Ile 95
assign ( resid 95 and name HN ) ( resid 94 and name HA ) 3.0  3.0 0.25 
assign ( resid 95 and name HN ) ( resid 95 and name HA ) 3.5  3.0 0.25 
assign ( resid 95 and name HN ) ( resid 95 and name HB ) 3.5  3.0 0.25 
assign ( resid 95 and name HN ) ( resid 95 and name HD1# ) 5.5  3.0 0.25 
assign ( resid 95 and name HN ) ( resid 95 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 95 and name HA ) ( resid 30 and name HA ) 3.5  3.0 0.25 
assign ( resid 95 and name HA ) ( resid 95 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 95 and name HA ) ( resid 95 and name HD1# ) 4.0  3.0 0.25 
!Phe 96
assign ( resid 96 and name HN ) ( resid 95 and name HA ) 3.0  3.0 0.25 
assign ( resid 96 and name HN ) ( resid 96 and name HA ) 4.5  3.0 0.25 
assign ( resid 96 and name HN ) ( resid 96 and name HB# ) 4.0  3.0 0.25 
assign ( resid 96 and name HA ) ( resid 96 and name HD# ) 5.0  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 29 and name HB2 ) 5.0  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 29 and name HG ) 5.1  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 29 and name HD1# ) 6.5  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 87 and name HB ) 6.0  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 87 and name HG1# ) 5.5  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 87 and name HG2# ) 5.5  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 97 and name HN ) 6.0  3.0 0.25 
assign ( resid 96 and name HD# ) ( resid 98 and name HG1# ) 5.0  3.0 0.25 
assign ( resid 96 and name HE# ) ( resid 27 and name HD2# ) 6.0  3.0 0.25 
assign ( resid 96 and name HE# ) ( resid 87 and name HG2# ) 5.5  3.0 0.25 
assign ( resid 96 and name HE# ) ( resid 98 and name HG1# ) 5.0  3.0 0.25 
assign ( resid 96 and name HE# ) ( resid 98 and name HG2# ) 6.0  3.0 0.25 
assign ( resid 96 and name HE# ) ( resid 109 and name HD# ) 6.5  3.0 0.25 
assign ( resid 96 and name HZ ) ( resid 85 and name HG2# ) 5.0  3.0 0.25 
assign ( resid 96 and name HZ ) ( resid 87 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 96 and name HZ ) ( resid 98 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 96 and name HZ ) ( resid 98 and name HG2# ) 5.0  3.0 0.25 
assign ( resid 96 and name HZ ) ( resid 109 and name HE# ) 4.5  3.0 0.25 
!Thr 97
assign ( resid 97 and name HN ) ( resid 88 and name HN ) 4.5  3.0 0.25 
assign ( resid 97 and name HN ) ( resid 96 and name HA ) 3.0  3.0 0.25 
assign ( resid 97 and name HN ) ( resid 97 and name HA ) 4.5  3.0 0.25 
assign ( resid 97 and name HN ) ( resid 97 and name HB ) 5.5  3.0 0.25 
assign ( resid 97 and name HA ) ( resid 97 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 97 and name HB ) ( resid 95 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 97 and name HG2# ) ( resid 95 and name HG1# ) 5.0  3.0 0.25 
!Val 98
assign ( resid 98 and name HN ) ( resid 97 and name HA ) 3.0  3.0 0.25 
assign ( resid 98 and name HN ) ( resid 98 and name HA ) 3.5  3.0 0.25 
assign ( resid 98 and name HN ) ( resid 98 and name HB ) 3.7  3.0 0.25 
assign ( resid 98 and name HN ) ( resid 98 and name HG1# ) 3.2  3.0 0.25 
assign ( resid 98 and name HN ) ( resid 98 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 98 and name HA ) ( resid 85 and name HA ) 4.5  3.0 0.25 
!Glu 99
assign ( resid 99 and name HN ) ( resid 98 and name HA ) 3.0  3.0 0.25 
assign ( resid 99 and name HN ) ( resid 99 and name HA ) 3.5  3.0 0.25 
assign ( resid 99 and name HN ) ( resid 99 and name HB# ) 4.0  3.0 0.25 
assign ( resid 99 and name HN ) ( resid 99 and name HG# ) 5.0  3.0 0.25 
!Gly 100
assign ( resid 100 and name HN ) ( resid 99 and name HA ) 2.5  3.0 0.25 
assign ( resid 100 and name HN ) ( resid 99 and name HB# ) 4.2  3.0 0.25 
assign ( resid 100 and name HN ) ( resid 100 and name HA# ) 3.5  3.0 0.25 
assign ( resid 100 and name HN ) ( resid 102 and name HN ) 5.0  3.0 0.25 
!Ala 101
assign ( resid 101 and name HN ) ( resid 98 and name HB# ) 5.0  3.0 0.25 
assign ( resid 101 and name HN ) ( resid 100 and name HA# ) 3.5  3.0 0.25 
assign ( resid 101 and name HN ) ( resid 101 and name HA ) 3.5  3.0 0.25 
assign ( resid 101 and name HN ) ( resid 101 and name HB# ) 3.5  3.0 0.25 
assign ( resid 101 and name HN ) ( resid 102 and name HN ) 3.8  3.0 0.25 
assign ( resid 101 and name HN ) ( resid 98 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 101 and name HA ) ( resid 85 and name HB ) 5.0  3.0 0.25 
assign ( resid 101 and name HA ) ( resid 98 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 101 and name HA ) ( resid 98 and name HG2# ) 5.0  3.0 0.25 
assign ( resid 101 and name HB# ) ( resid 98 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 101 and name HB# ) ( resid 98 and name HG2# ) 5.0  3.0 0.25 
!Glu 102
assign ( resid 102 and name HN ) ( resid 101 and name HA ) 3.5  3.0 0.25 
assign ( resid 102 and name HN ) ( resid 101 and name HB# ) 4.0  3.0 0.25 
assign ( resid 102 and name HN ) ( resid 102 and name HA ) 4.5  3.0 0.25 
assign ( resid 102 and name HN ) ( resid 102 and name HG# ) 5.5  3.0 0.25 
assign ( resid 102 and name HN ) ( resid 102 and name HB# ) 4.5  3.0 0.25 
assign ( resid 102 and name HN ) ( resid 128 and name HG2# ) 4.5  3.0 0.25 
!Lys 103
assign ( resid 103 and name HN ) ( resid 102 and name HN ) 4.5  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 102 and name HA ) 3.0  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 102 and name HG# ) 4.0  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 103 and name HA ) 3.0  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 103 and name HB# ) 4.0  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 103 and name HG# ) 4.5  3.0 0.25 
assign ( resid 103 and name HN ) ( resid 104 and name HN ) 3.0  3.0 0.25 
assign ( resid 103 and name HA ) ( resid 103 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 103 and name HA ) ( resid 103 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 103 and name HA ) ( resid 128 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 103 and name HA ) ( resid 128 and name HG1# ) 4.5  3.0 0.25 
!Glu 104
assign ( resid 104 and name HN ) ( resid 103 and name HA ) 4.5  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 103 and name HB# ) 4.5  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 104 and name HA ) 3.0  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 104 and name HB# ) 4.0  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 104 and name HG1 ) 3.0  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 104 and name HG2 ) 3.0  3.0 0.25 
assign ( resid 104 and name HN ) ( resid 105 and name HN ) 3.0  3.0 0.25 
!Asp 105
!assign ( resid 105 and name HN ) ( resid 24 and name HN ) 3.5  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 104 and name HA ) 3.5  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 105 and name HA ) 3.5  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 105 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 105 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 106 and name HN ) 3.0  3.0 0.25 
assign ( resid 105 and name HN ) ( resid 128 and name HG2# ) 4.4  3.0 0.25 
!Glu 106
assign ( resid 106 and name HN ) ( resid 104 and name HN ) 4.5  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 105 and name HA ) 4.5  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 105 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 105 and name HB2 ) 5.5  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 106 and name HA ) 3.0  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 106 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 106 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 106 and name HN ) ( resid 128 and name HG2# ) 3.1  3.0 0.25 
assign ( resid 106 and name HA ) ( resid 106 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 106 and name HA ) ( resid 106 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 106 and name HA ) ( resid 128 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 106 and name HB1 ) ( resid 128 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 106 and name HB2 ) ( resid 128 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 106 and name HG1 ) ( resid 128 and name HG2# ) 4.5  3.0 0.25 
!Gly 107
assign ( resid 107 and name HN ) ( resid 106 and name HA ) 3.0  3.0 0.25 
assign ( resid 107 and name HN ) ( resid 106 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 107 and name HN ) ( resid 106 and name HG2 ) 3.5  3.0 0.25 
assign ( resid 107 and name HN ) ( resid 107 and name HA# ) 3.5  3.0 0.25 
assign ( resid 107 and name HN ) ( resid 126 and name HB ) 4.5  3.0 0.25 
assign ( resid 107 and name HN ) ( resid 126 and name HG2# ) 4.5  3.0 0.25 
!Val 108
assign ( resid 108 and name HN ) ( resid 46 and name HN ) 4.5  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 107 and name HN ) 4.0  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 107 and name HA# ) 3.5  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 108 and name HA ) 4.5  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 108 and name HB ) 3.0  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 108 and name HG1# ) 4.4  3.0 0.25 
assign ( resid 108 and name HN ) ( resid 108 and name HG2# ) 3.7  3.0 0.25 
assign ( resid 108 and name HA ) ( resid 108 and name HB ) 4.5  3.0 0.25 
assign ( resid 108 and name HA ) ( resid 108 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 108 and name HA ) ( resid 108 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 108 and name HA ) ( resid 125 and name HA ) 3.5  3.0 0.25 
!Tyr 109
assign ( resid 109 and name HN ) ( resid 108 and name HA ) 3.0  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 108 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 108 and name HG2# ) 4.3  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 109 and name HA ) 4.5  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 109 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 109 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 109 and name HD# ) 6.0  3.0 0.25 
assign ( resid 109 and name HN ) ( resid 125 and name HA ) 3.5  3.0 0.25 
assign ( resid 109 and name HA ) ( resid 109 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 109 and name HA ) ( resid 109 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 109 and name HA ) ( resid 109 and name HD# ) 4.0  3.0 0.25 
assign ( resid 109 and name HD# ) ( resid 43 and name HB1 ) 6.0  3.0 0.25 
assign ( resid 109 and name HD# ) ( resid 45 and name HB# ) 6.5  3.0 0.25 
assign ( resid 109 and name HD# ) ( resid 124 and name HG ) 7.5  3.0 0.25 
assign ( resid 109 and name HD# ) ( resid 124 and name HD2# ) 4.5  3.0 0.25 
assign ( resid 109 and name HD# ) ( resid 126 and name HB ) 5.0  3.0 0.25 
assign ( resid 109 and name HE# ) ( resid 45 and name HA ) 4.0  3.0 0.25 
assign ( resid 109 and name HE# ) ( resid 109 and name HB2 ) 7.5  3.0 0.25 
assign ( resid 109 and name HE# ) ( resid 109 and name HB1 ) 7.5  3.0 0.25 
assign ( resid 109 and name HE# ) ( resid 126 and name HB ) 5.0  3.0 0.25 
assign ( resid 109 and name HE# ) ( resid 124 and name HD2# ) 5.5  3.0 0.25 
!Thr 110
assign ( resid 110 and name HN ) ( resid 45 and name HA ) 3.5  3.0 0.25 
assign ( resid 110 and name HN ) ( resid 109 and name HA ) 3.0  3.0 0.25 
assign ( resid 110 and name HN ) ( resid 109 and name HD# ) 5.5  3.0 0.25 
assign ( resid 110 and name HN ) ( resid 110 and name HA ) 4.5  3.0 0.25 
assign ( resid 110 and name HN ) ( resid 110 and name HB ) 3.0  3.0 0.25 
assign ( resid 110 and name HN ) ( resid 110 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 110 and name HA ) ( resid 110 and name HB ) 4.5  3.0 0.25 
assign ( resid 110 and name HA ) ( resid 110 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 110 and name HA ) ( resid 123 and name HA ) 3.0  3.0 0.25 
assign ( resid 110 and name HB ) ( resid 44 and name HB# ) 4.5  3.0 0.25 
assign ( resid 110 and name HG2# ) ( resid 123 and name HA ) 3.5  3.0 0.25 
assign ( resid 110 and name HG2# ) ( resid 121 and name HB# ) 5.0  3.0 0.25 
assign ( resid 110 and name HG2# ) ( resid 121 and name HG# ) 4.5  3.0 0.25 
assign ( resid 110 and name HG2# ) ( resid 121 and name HE22 ) 5.5  3.0 0.25 
!Val 111
assign ( resid 111 and name HN ) ( resid 110 and name HA ) 3.0  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 110 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 111 and name HA ) 4.5  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 111 and name HB ) 3.5  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 111 and name HG1# ) 3.5  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 111 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 111 and name HN ) ( resid 122 and name HN ) 3.5  3.0 0.25 
assign ( resid 111 and name HA ) ( resid 111 and name HB ) 3.5  3.0 0.25 
assign ( resid 111 and name HA ) ( resid 111 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 111 and name HA ) ( resid 111 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 33 and name HD1# ) 6.2  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 41 and name HG2# ) 5.1  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 43 and name HA ) 4.7  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 43 and name HH2 ) 4.5  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 43 and name HE3 ) 4.5  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 43 and name HZ3 ) 4.5  3.0 0.25 
assign ( resid 111 and name HG1# ) ( resid 122 and name HG1# ) 5.0  3.0 0.25 
!assign ( resid 111 and name HG1# ) ( resid 122 and name HG2# ) 6.5  3.0 0.25 
assign ( resid 111 and name HG2# ) ( resid 15 and name HG2# ) 6.7  3.0 0.25 
assign ( resid 111 and name HG2# ) ( resid 33 and name HD1# ) 5.5  3.0 0.25 
assign ( resid 111 and name HG2# ) ( resid 41 and name HG2# ) 5.0  3.0 0.25 
assign ( resid 111 and name HG2# ) ( resid 43 and name HH2 ) 4.5  3.0 0.25 
assign ( resid 111 and name HG2# ) ( resid 122 and name HG2# ) 6.6  3.0 0.25 
!Thr 112
assign ( resid 112 and name HN ) ( resid 42 and name HG2# ) 4.2  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 43 and name HA ) 4.5  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 111 and name HA ) 3.0  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 111 and name HG1# ) 5.5  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 111 and name HG2# ) 5.5  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 112 and name HA ) 4.5  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 112 and name HB ) 3.0  3.0 0.25 
assign ( resid 112 and name HN ) ( resid 112 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 112 and name HA ) ( resid 112 and name HB ) 5.5  3.0 0.25 
assign ( resid 112 and name HA ) ( resid 112 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 112 and name HA ) ( resid 121 and name HA ) 3.0  3.0 0.25 
assign ( resid 112 and name HG2# ) ( resid 42 and name HG1# ) 5.5  3.0 0.25 
!assign ( resid 112 and name HG2# ) ( resid 120 and name HB# ) 6.5  3.0 0.25 
assign ( resid 112 and name HG2# ) ( resid 121 and name HA ) 5.5  3.0 0.25 
assign ( resid 112 and name HG2# ) ( resid 121 and name HG# ) 5.5  3.0 0.25 
!Val 113
assign ( resid 113 and name HN ) ( resid 112 and name HA ) 3.0  3.0 0.25 
assign ( resid 113 and name HN ) ( resid 112 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 113 and name HN ) ( resid 113 and name HA ) 4.5  3.0 0.25 
assign ( resid 113 and name HN ) ( resid 113 and name HB ) 3.5  3.0 0.25 
assign ( resid 113 and name HN ) ( resid 113 and name HG# ) 4.0  3.0 0.25 
assign ( resid 113 and name HN ) ( resid 121 and name HA ) 4.5  3.0 0.25 
assign ( resid 113 and name HA ) ( resid 113 and name HB ) 4.5  3.0 0.25 
assign ( resid 113 and name HA ) ( resid 113 and name HG# ) 5.5  3.0 0.25 
assign ( resid 113 and name HG# ) ( resid 111 and name HG1# ) 6.0  3.0 0.25 
assign ( resid 113 and name HG# ) ( resid 111 and name HG2# ) 7.5  3.0 0.25 
assign ( resid 113 and name HG# ) ( resid 122 and name HB# ) 6.5  3.0 0.25 
!Lys 114
assign ( resid 114 and name HN ) ( resid 40 and name HN ) 3.5  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 41 and name HA ) 3.5  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 113 and name HA ) 3.0  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 113 and name HG# ) 5.0  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 114 and name HA ) 4.5  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 114 and name HB# ) 4.5  3.0 0.25 
assign ( resid 114 and name HN ) ( resid 114 and name HG# ) 4.5  3.0 0.25 
assign ( resid 114 and name HA ) ( resid 119 and name HA ) 3.5  3.0 0.25 
assign ( resid 114 and name HA ) ( resid 119 and name HB# ) 3.5  3.0 0.25 
!Asn 115
assign ( resid 115 and name HN ) ( resid 114 and name HA ) 3.0  3.0 0.25 
assign ( resid 115 and name HN ) ( resid 114 and name HB# ) 4.0  3.0 0.25 
assign ( resid 115 and name HN ) ( resid 114 and name HG# ) 4.0  3.0 0.25 
assign ( resid 115 and name HN ) ( resid 115 and name HA ) 3.5  3.0 0.25 
assign ( resid 115 and name HN ) ( resid 118 and name HN ) 3.5  3.0 0.25 
assign ( resid 115 and name HN ) ( resid 119 and name HA ) 3.5  3.0 0.25 
assign ( resid 115 and name HA ) ( resid 114 and name HA ) 4.5  3.0 0.25 
assign ( resid 115 and name HA ) ( resid 114 and name HB# ) 5.5  3.0 0.25 
assign ( resid 115 and name HA ) ( resid 115 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 115 and name HA ) ( resid 115 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 115 and name HA ) ( resid 116 and name HD# ) 4.5  3.0 0.25 
!Pro 116
!Val 117
assign ( resid 117 and name HN ) ( resid 116 and name HA ) 3.5  3.0 0.25 
assign ( resid 117 and name HN ) ( resid 117 and name HA ) 3.5  3.0 0.25 
assign ( resid 117 and name HN ) ( resid 117 and name HB ) 3.5  3.0 0.25 
assign ( resid 117 and name HN ) ( resid 117 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 117 and name HN ) ( resid 117 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 117 and name HN ) ( resid 118 and name HN ) 3.0  3.0 0.25 
assign ( resid 117 and name HA ) ( resid 4 and name HD# ) 6.5  3.0 0.25 
assign ( resid 117 and name HA ) ( resid 117 and name HB ) 3.0  3.0 0.25 
assign ( resid 117 and name HA ) ( resid 117 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 117 and name HA ) ( resid 117 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 117 and name HB ) ( resid 4 and name HD# ) 4.6  3.0 0.25 
assign ( resid 117 and name HG1# ) ( resid 4 and name HD# ) 4.5  3.0 0.25 
assign ( resid 117 and name HG2# ) ( resid 4 and name HD# ) 5.5  3.0 0.25 
!Gly 118
assign ( resid 118 and name HN ) ( resid 117 and name HA ) 3.5  3.0 0.25 
assign ( resid 118 and name HN ) ( resid 117 and name HB ) 3.5  3.0 0.25 
assign ( resid 118 and name HN ) ( resid 117 and name HG1# ) 4.2  3.0 0.25 
assign ( resid 118 and name HN ) ( resid 117 and name HG2# ) 5.0  3.0 0.25 
assign ( resid 118 and name HN ) ( resid 118 and name HA1 ) 3.0  3.0 0.25 
assign ( resid 118 and name HN ) ( resid 118 and name HA2 ) 3.0  3.0 0.25 
!Glu 119
assign ( resid 119 and name HN ) ( resid 118 and name HN ) 4.0  3.0 0.25 
assign ( resid 119 and name HN ) ( resid 118 and name HA1 ) 2.5  3.0 0.25 
assign ( resid 119 and name HN ) ( resid 118 and name HA2 ) 3.0  3.0 0.25 
assign ( resid 119 and name HN ) ( resid 119 and name HA ) 3.5  3.0 0.25 
assign ( resid 119 and name HN ) ( resid 119 and name HB# ) 4.0  3.0 0.25 
assign ( resid 119 and name HN ) ( resid 119 and name HG# ) 4.0  3.0 0.25 
!Asp 120
assign ( resid 120 and name HN ) ( resid 113 and name HG# ) 5.0  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 113 and name HB ) 4.0  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 114 and name HA ) 3.5  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 119 and name HA ) 2.5  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 119 and name HB# ) 4.0  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 119 and name HG# ) 4.0  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 120 and name HA ) 3.5  3.0 0.25 
assign ( resid 120 and name HN ) ( resid 120 and name HB# ) 4.5  3.0 0.25 
assign ( resid 120 and name HB# ) ( resid 113 and name HG2# ) 4.5  3.0 0.25 
!Gln 121
assign ( resid 121 and name HN ) ( resid 7 and name HD1# ) 4.5  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 113 and name HN ) 4.5  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 120 and name HA ) 3.0  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 120 and name HB# ) 4.0  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 121 and name HA ) 3.5  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 121 and name HB# ) 3.5  3.0 0.25 
assign ( resid 121 and name HN ) ( resid 121 and name HG# ) 4.2  3.0 0.25 
assign ( resid 121 and name HA ) ( resid 113 and name HG# ) 6.5  3.0 0.25 
assign ( resid 121 and name HA ) ( resid 121 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 121 and name HA ) ( resid 121 and name HB2 ) 3.0  3.0 0.25 
assign ( resid 121 and name HE21 ) ( resid 112 and name HG2# ) 4.5  3.0 0.25 
!Val 122
assign ( resid 122 and name HN ) ( resid 112 and name HA ) 3.5  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 121 and name HA ) 3.5  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 121 and name HG# ) 4.5  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 122 and name HA ) 3.5  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 122 and name HB ) 3.5  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 122 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 122 and name HN ) ( resid 122 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 122 and name HA ) ( resid 122 and name HB ) 3.0  3.0 0.25 
assign ( resid 122 and name HA ) ( resid 122 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 122 and name HA ) ( resid 122 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 122 and name HG1# ) ( resid 7 and name HD1# ) 4.0  3.0 0.25 
assign ( resid 122 and name HG2# ) ( resid 124 and name HB2 ) 5.5  3.0 0.25 
!Asn 123
assign ( resid 123 and name HN ) ( resid 122 and name HA ) 3.0  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 122 and name HB ) 3.6  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 122 and name HG1# ) 4.5  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 122 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 123 and name HA ) 3.5  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 123 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 123 and name HN ) ( resid 123 and name HB2 ) 3.5  3.0 0.25 
assign ( resid 123 and name HA ) ( resid 111 and name HN ) 3.1  3.0 0.25 
assign ( resid 123 and name HA ) ( resid 123 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 123 and name HA ) ( resid 123 and name HB2 ) 3.5  3.0 0.25 
!Leu 124
assign ( resid 124 and name HN ) ( resid 108 and name HG1# ) 5.5  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 109 and name HN ) 4.5  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 123 and name HA ) 3.0  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 123 and name HB1 ) 3.8  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 123 and name HB2 ) 3.7  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 124 and name HA ) 4.5  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 124 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 124 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 124 and name HN ) ( resid 124 and name HD2# ) 5.2  3.0 0.25 
assign ( resid 124 and name HA ) ( resid 124 and name HB2 ) 4.5  3.0 0.25 
assign ( resid 124 and name HA ) ( resid 124 and name HB1 ) 4.5  3.0 0.25 
!Thr 125
assign ( resid 125 and name HN ) ( resid 18 and name HA ) 3.5  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 19 and name HN ) 4.0  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 124 and name HA ) 3.0  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 124 and name HD1# ) 5.5  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 125 and name HA ) 4.5  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 125 and name HB ) 3.0  3.0 0.25 
assign ( resid 125 and name HN ) ( resid 125 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 125 and name HA ) ( resid 125 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 125 and name HA ) ( resid 126 and name HG1# ) 4.5  3.0 0.25 
!Val 126
assign ( resid 126 and name HN ) ( resid 125 and name HA ) 3.0  3.0 0.25 
assign ( resid 126 and name HN ) ( resid 126 and name HA ) 3.5  3.0 0.25 
assign ( resid 126 and name HN ) ( resid 126 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 126 and name HA ) ( resid 18 and name HA ) 4.0  3.0 0.25 
assign ( resid 126 and name HA ) ( resid 20 and name HA ) 4.0  3.0 0.25 
assign ( resid 126 and name HA ) ( resid 126 and name HB ) 4.0  3.0 0.25 
assign ( resid 126 and name HA ) ( resid 126 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 126 and name HA ) ( resid 126 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 126 and name HG2# ) ( resid 20 and name HA ) 4.0  3.0 0.25 
assign ( resid 126 and name HG2# ) ( resid 109 and name HE# ) 7.5  3.0 0.25 
assign ( resid 126 and name HG1# ) ( resid 109 and name HD# ) 6.5  3.0 0.25 
assign ( resid 126 and name HG1# ) ( resid 109 and name HE# ) 6.5  3.0 0.25 
!Lys 127
assign ( resid 127 and name HN ) ( resid 19 and name HN ) 5.5  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 19 and name HG2# ) 4.5  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 20 and name HA ) 3.5  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 21 and name HN ) 4.0  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 21 and name HG# ) 6.0  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 126 and name HA ) 3.0  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 127 and name HA ) 4.5  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 127 and name HB1 ) 3.5  3.0 0.25 
assign ( resid 127 and name HN ) ( resid 127 and name HB2 ) 3.5  3.0 0.25 
!Val 128
assign ( resid 128 and name HN ) ( resid 106 and name HB1 ) 4.5  3.0 0.25 
assign ( resid 128 and name HN ) ( resid 127 and name HA ) 3.0  3.0 0.25 
assign ( resid 128 and name HN ) ( resid 128 and name HA ) 3.5  3.0 0.25 
assign ( resid 128 and name HN ) ( resid 128 and name HB ) 3.5  3.0 0.25 
assign ( resid 128 and name HN ) ( resid 128 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 128 and name HA ) ( resid 20 and name HA ) 4.5  3.0 0.25 
assign ( resid 128 and name HA ) ( resid 22 and name HA ) 4.0  3.0 0.25 
assign ( resid 128 and name HA ) ( resid 128 and name HB ) 3.5  3.0 0.25 
assign ( resid 128 and name HA ) ( resid 128 and name HG1# ) 4.0  3.0 0.25 
assign ( resid 128 and name HA ) ( resid 128 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 128 and name HG1# ) ( resid 21 and name HN ) 5.0  3.0 0.25 
!Ile 129
assign ( resid 129 and name HN ) ( resid 21 and name HN ) 3.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 22 and name HA ) 3.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 128 and name HA ) 2.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 128 and name HG1# ) 3.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 129 and name HA ) 3.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 129 and name HB ) 3.5  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 129 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 129 and name HN ) ( resid 129 and name HD1# ) 4.1  3.0 0.25 
assign ( resid 129 and name HA ) ( resid 129 and name HB ) 3.0  3.0 0.25 
assign ( resid 129 and name HA ) ( resid 129 and name HG2# ) 4.0  3.0 0.25 
assign ( resid 129 and name HA ) ( resid 129 and name HD1# ) 4.5  3.0 0.25 
!Asp 130
assign ( resid 130 and name HN ) ( resid 129 and name HA ) 2.5  3.0 0.25 
assign ( resid 130 and name HN ) ( resid 129 and name HG2# ) 4.3  3.0 0.25 
assign ( resid 130 and name HN ) ( resid 129 and name HD1# ) 4.0  3.0 0.25 
assign ( resid 130 and name HN ) ( resid 130 and name HA ) 3.5  3.0 0.25 
assign ( resid 130 and name HN ) ( resid 130 and name HB1 ) 3.0  3.0 0.25 
assign ( resid 130 and name HN ) ( resid 130 and name HB2 ) 3.3  3.0 0.25 
assign ( resid 130 and name HA ) ( resid 23 and name HB# ) 4.5  3.0 0.25 


restraints dihedral

  reset

! E3
  assign (resid   2 and name c) (resid   3 and name n) (resid   3 and name ca) (resid   3 and name c)  1  -110.0  30.0  2
  assign (resid   3 and name n) (resid   3 and name ca) (resid   3 and name c) (resid   4 and name n)  1   120.0  30.0  2
! P4
  assign (resid   3 and name c) (resid   4 and name n) (resid   4 and name ca) (resid   4 and name c)  1   -60.0  35.0  2
  assign (resid   4 and name n) (resid   4 and name ca) (resid   4 and name c) (resid   5 and name n)  1   140.0  35.0  2
! P5
  assign (resid   4 and name c) (resid   5 and name n) (resid   5 and name ca) (resid   5 and name c)  1  -105.0  60.0  2
  assign (resid   5 and name n) (resid   5 and name ca) (resid   5 and name c) (resid   6 and name n)  1   145.0  45.0  2
! K6
  assign (resid   5 and name c) (resid   6 and name n) (resid   6 and name ca) (resid   6 and name c)  1  -130.0  40.0  2
  assign (resid   6 and name n) (resid   6 and name ca) (resid   6 and name c) (resid   7 and name n)  1   140.0  40.0  2
! I7
! H8
  assign (resid   7 and name c) (resid   8 and name n) (resid   8 and name ca) (resid   8 and name c)  1   -85.0  40.0  2
  assign (resid   8 and name n) (resid   8 and name ca) (resid   8 and name c) (resid   9 and name n)  1   134.0  40.0  2
! L9
! D10
  assign (resid   9 and name c) (resid  10 and name n) (resid  10 and name ca) (resid  10 and name c)  1   -80.0  40.0  2
  assign (resid  10 and name n) (resid  10 and name ca) (resid  10 and name c) (resid  11 and name n)  1   -14.0  40.0  2
! C11
! P12
! G13
  assign (resid  12 and name c) (resid  13 and name n) (resid  13 and name ca) (resid  13 and name c)  1    80.0  40.0  2
  assign (resid  13 and name n) (resid  13 and name ca) (resid  13 and name c) (resid  14 and name n)  1    10.0  40.0  2
! R14
! I15
  assign (resid  14 and name c) (resid  15 and name n) (resid  15 and name ca) (resid  15 and name c)  1  -110.0  30.0  2
  assign (resid  15 and name n) (resid  15 and name ca) (resid  15 and name c) (resid  16 and name n)  1   126.0  60.0  2
! P16
! D17
  assign (resid  16 and name c) (resid  17 and name n) (resid  17 and name ca) (resid  17 and name c)  1   -82.0  30.0  2
  assign (resid  17 and name n) (resid  17 and name ca) (resid  17 and name c) (resid  18 and name n)  1   131.0  50.0  2
! T18
  assign (resid  17 and name c) (resid  18 and name n) (resid  18 and name ca) (resid  18 and name c)  1   -99.0  40.0  2
  assign (resid  18 and name n) (resid  18 and name ca) (resid  18 and name c) (resid  19 and name n)  1   124.0  35.0  2
! I19
  assign (resid  18 and name c) (resid  19 and name n) (resid  19 and name ca) (resid  19 and name c)  1   -95.0  50.0  2
  assign (resid  19 and name n) (resid  19 and name ca) (resid  19 and name c) (resid  20 and name n)  1   124.0  30.0  2
! V20
  assign (resid  19 and name c) (resid  20 and name n) (resid  20 and name ca) (resid  20 and name c)  1  -103.0  30.0  2
  assign (resid  20 and name n) (resid  20 and name ca) (resid  20 and name c) (resid  21 and name n)  1   133.0  30.0  2
! V21
  assign (resid  20 and name c) (resid  21 and name n) (resid  21 and name ca) (resid  21 and name c)  1  -116.0  35.0  2
  assign (resid  21 and name n) (resid  21 and name ca) (resid  21 and name c) (resid  22 and name n)  1   129.0  30.0  2
! V22
! A23
! G24
! N25
  assign (resid  24 and name c) (resid  25 and name n) (resid  25 and name ca) (resid  25 and name c)  1   -94.0  45.0  2
  assign (resid  25 and name n) (resid  25 and name ca) (resid  25 and name c) (resid  26 and name n)  1   141.0  50.0  2
! K26
! L27
  assign (resid  26 and name c) (resid  27 and name n) (resid  27 and name ca) (resid  27 and name c)  1  -113.0  45.0  2
  assign (resid  27 and name n) (resid  27 and name ca) (resid  27 and name c) (resid  28 and name n)  1   117.0  40.0  2
! R28
  assign (resid  27 and name c) (resid  28 and name n) (resid  28 and name ca) (resid  28 and name c)  1  -105.0  30.0  2
  assign (resid  28 and name n) (resid  28 and name ca) (resid  28 and name c) (resid  29 and name n)  1   128.0  30.0  2
! L29
  assign (resid  28 and name c) (resid  29 and name n) (resid  29 and name ca) (resid  29 and name c)  1  -118.0  40.0  2
  assign (resid  29 and name n) (resid  29 and name ca) (resid  29 and name c) (resid  30 and name n)  1   125.0  30.0  2
! D30
  assign (resid  29 and name c) (resid  30 and name n) (resid  30 and name ca) (resid  30 and name c)  1  -102.0  30.0  2
  assign (resid  30 and name n) (resid  30 and name ca) (resid  30 and name c) (resid  31 and name n)  1   133.0  30.0  2
! V31
  assign (resid  30 and name c) (resid  31 and name n) (resid  31 and name ca) (resid  31 and name c)  1  -115.0  40.0  2
  assign (resid  31 and name n) (resid  31 and name ca) (resid  31 and name c) (resid  32 and name n)  1   127.0  30.0  2
! P32
  assign (resid  31 and name c) (resid  32 and name n) (resid  32 and name ca) (resid  32 and name c)  1   -95.0  40.0  2
  assign (resid  32 and name n) (resid  32 and name ca) (resid  32 and name c) (resid  33 and name n)  1   138.0  30.0  2
! I33
  assign (resid  32 and name c) (resid  33 and name n) (resid  33 and name ca) (resid  33 and name c)  1  -139.0  30.0  2
  assign (resid  33 and name n) (resid  33 and name ca) (resid  33 and name c) (resid  34 and name n)  1   155.0  30.0  2
! S34
! G35
! D36
  assign (resid  35 and name c) (resid  36 and name n) (resid  36 and name ca) (resid  36 and name c)  1  -122.0  30.0  2
  assign (resid  36 and name n) (resid  36 and name ca) (resid  36 and name c) (resid  37 and name n)  1   138.0  30.0  2
! P37
! A38
  assign (resid  37 and name c) (resid  38 and name n) (resid  38 and name ca) (resid  38 and name c)  1   -92.0  45.0  2
  assign (resid  38 and name n) (resid  38 and name ca) (resid  38 and name c) (resid  39 and name n)  1   120.0  50.0  2
! P39
! T40
  assign (resid  39 and name c) (resid  40 and name n) (resid  40 and name ca) (resid  40 and name c)  1   -95.0  40.0  2
  assign (resid  40 and name n) (resid  40 and name ca) (resid  40 and name c) (resid  41 and name n)  1   128.0  40.0  2
! V41
  assign (resid  40 and name c) (resid  41 and name n) (resid  41 and name ca) (resid  41 and name c)  1  -108.0  30.0  2
  assign (resid  41 and name n) (resid  41 and name ca) (resid  41 and name c) (resid  42 and name n)  1   129.0  30.0  2
! I42
  assign (resid  41 and name c) (resid  42 and name n) (resid  42 and name ca) (resid  42 and name c)  1  -123.0  40.0  2
  assign (resid  42 and name n) (resid  42 and name ca) (resid  42 and name c) (resid  43 and name n)  1   134.0  30.0  2
! W43
  assign (resid  42 and name c) (resid  43 and name n) (resid  43 and name ca) (resid  43 and name c)  1   -92.0  30.0  2
  assign (resid  43 and name n) (resid  43 and name ca) (resid  43 and name c) (resid  44 and name n)  1   133.0  30.0  2
! Q44
  assign (resid  43 and name c) (resid  44 and name n) (resid  44 and name ca) (resid  44 and name c)  1  -106.0  50.0  2
  assign (resid  44 and name n) (resid  44 and name ca) (resid  44 and name c) (resid  45 and name n)  1   138.0  30.0  2
! K45
  assign (resid  44 and name c) (resid  45 and name n) (resid  45 and name ca) (resid  45 and name c)  1  -132.0  40.0  2
  assign (resid  45 and name n) (resid  45 and name ca) (resid  45 and name c) (resid  46 and name n)  1   125.0  40.0  2
! A46
  assign (resid  45 and name c) (resid  46 and name n) (resid  46 and name ca) (resid  46 and name c)  1   -96.0  40.0  2
  assign (resid  46 and name n) (resid  46 and name ca) (resid  46 and name c) (resid  47 and name n)  1   122.0  30.0  2
! I47
! T48
! Q49
! G50
! N51
! K52
! A53
  assign (resid  52 and name c) (resid  53 and name n) (resid  53 and name ca) (resid  53 and name c)  1   -94.0  50.0  2
  assign (resid  53 and name n) (resid  53 and name ca) (resid  53 and name c) (resid  54 and name n)  1   124.0  50.0  2
! P54
  assign (resid  53 and name c) (resid  54 and name n) (resid  54 and name ca) (resid  54 and name c)  1   -74.0  40.0  2
  assign (resid  54 and name n) (resid  54 and name ca) (resid  54 and name c) (resid  55 and name n)  1   137.0  30.0  2
! A55
! R56
  assign (resid  55 and name c) (resid  56 and name n) (resid  56 and name ca) (resid  56 and name c)  1   -95.0  45.0  2
  assign (resid  56 and name n) (resid  56 and name ca) (resid  56 and name c) (resid  57 and name n)  1   124.0  50.0  2
! P57
! A58
  assign (resid  57 and name c) (resid  58 and name n) (resid  58 and name ca) (resid  58 and name c)  1   -89.0  50.0  2
  assign (resid  58 and name n) (resid  58 and name ca) (resid  58 and name c) (resid  59 and name n)  1   126.0  60.0  2
! P59
! D60
!  assign (resid  59 and name c) (resid  60 and name n) (resid  60 and name ca) (resid  60 and name c)  1   -81.0  40.0  2
!  assign (resid  60 and name n) (resid  60 and name ca) (resid  60 and name c) (resid  61 and name n)  1   137.0  50.0  2
! A61
  assign (resid  60 and name c) (resid  61 and name n) (resid  61 and name ca) (resid  61 and name c)  1  -102.0  60.0  2
  assign (resid  61 and name n) (resid  61 and name ca) (resid  61 and name c) (resid  62 and name n)  1   139.0  60.0  2
! P62
  assign (resid  61 and name c) (resid  62 and name n) (resid  62 and name ca) (resid  62 and name c)  1   -71.0  40.0  2
  assign (resid  62 and name n) (resid  62 and name ca) (resid  62 and name c) (resid  63 and name n)  1   139.0  30.0  2
! E63
! D64
! T65
! G66
! D67
! S68
! D69
! E70
! W71
! V72
! F73
! D74
! K75
! K76
! L77
! L78
! C79
! E80
! T81
! E82
! G83
! R84
! V85
  assign (resid  84 and name c) (resid  85 and name n) (resid  85 and name ca) (resid  85 and name c)  1  -107.0  50.0  2
  assign (resid  85 and name n) (resid  85 and name ca) (resid  85 and name c) (resid  86 and name n)  1   141.0  30.0  2
! R86
  assign (resid  85 and name c) (resid  86 and name n) (resid  86 and name ca) (resid  86 and name c)  1  -115.0  50.0  2
  assign (resid  86 and name n) (resid  86 and name ca) (resid  86 and name c) (resid  87 and name n)  1   135.0  40.0  2
! V87
  assign (resid  86 and name c) (resid  87 and name n) (resid  87 and name ca) (resid  87 and name c)  1  -107.0  30.0  2
  assign (resid  87 and name n) (resid  87 and name ca) (resid  87 and name c) (resid  88 and name n)  1   134.0  30.0  2
! E88
  assign (resid  87 and name c) (resid  88 and name n) (resid  88 and name ca) (resid  88 and name c)  1  -108.0  60.0  2
  assign (resid  88 and name n) (resid  88 and name ca) (resid  88 and name c) (resid  89 and name n)  1   124.0  30.0  2
! T89
  assign (resid  88 and name c) (resid  89 and name n) (resid  89 and name ca) (resid  89 and name c)  1  -107.0  40.0  2
  assign (resid  89 and name n) (resid  89 and name ca) (resid  89 and name c) (resid  90 and name n)  1   125.0  30.0  2
! T90
  assign (resid  89 and name c) (resid  90 and name n) (resid  90 and name ca) (resid  90 and name c)  1  -116.0  50.0  2
  assign (resid  90 and name n) (resid  90 and name ca) (resid  90 and name c) (resid  91 and name n)  1   159.0  40.0  2
! K91
  assign (resid  90 and name c) (resid  91 and name n) (resid  91 and name ca) (resid  91 and name c)  1   -73.0  30.0  2
  assign (resid  91 and name n) (resid  91 and name ca) (resid  91 and name c) (resid  92 and name n)  1   -17.0  30.0  2
! D92
  assign (resid  91 and name c) (resid  92 and name n) (resid  92 and name ca) (resid  92 and name c)  1  -114.0  40.0  2
  assign (resid  92 and name n) (resid  92 and name ca) (resid  92 and name c) (resid  93 and name n)  1   8.0  40.0  2
! R93
! S94
  assign (resid  93 and name c) (resid  94 and name n) (resid  94 and name ca) (resid  94 and name c)  1  -114.0  40.0  2
  assign (resid  94 and name n) (resid  94 and name ca) (resid  94 and name c) (resid  95 and name n)  1   129.0  40.0  2
! I95
  assign (resid  94 and name c) (resid  95 and name n) (resid  95 and name ca) (resid  95 and name c)  1  -120.0  40.0  2
  assign (resid  95 and name n) (resid  95 and name ca) (resid  95 and name c) (resid  96 and name n)  1   129.0  30.0  2
! F96
  assign (resid  95 and name c) (resid  96 and name n) (resid  96 and name ca) (resid  96 and name c)  1  -114.0  30.0  2
  assign (resid  96 and name n) (resid  96 and name ca) (resid  96 and name c) (resid  97 and name n)  1   127.0  30.0  2
! T97
  assign (resid  96 and name c) (resid  97 and name n) (resid  97 and name ca) (resid  97 and name c)  1  -105.0  40.0  2
  assign (resid  97 and name n) (resid  97 and name ca) (resid  97 and name c) (resid  98 and name n)  1   124.0  40.0  2
! V98
  assign (resid  97 and name c) (resid  98 and name n) (resid  98 and name ca) (resid  98 and name c)  1  -115.0  40.0  2
  assign (resid  98 and name n) (resid  98 and name ca) (resid  98 and name c) (resid  99 and name n)  1   124.0  40.0  2
! E99
! G100
! A101
! E102
  assign (resid 101 and name c) (resid 102 and name n) (resid 102 and name ca) (resid 102 and name c)  1  -103.0  30.0  2
  assign (resid 102 and name n) (resid 102 and name ca) (resid 102 and name c) (resid 103 and name n)  1   161.0  30.0  2
! K103
  assign (resid 102 and name c) (resid 103 and name n) (resid 103 and name ca) (resid 103 and name c)  1   -65.0  30.0  2
  assign (resid 103 and name n) (resid 103 and name ca) (resid 103 and name c) (resid 104 and name n)  1   -31.0  30.0  2
! E104
  assign (resid 103 and name c) (resid 104 and name n) (resid 104 and name ca) (resid 104 and name c)  1   -65.0  30.0  2
  assign (resid 104 and name n) (resid 104 and name ca) (resid 104 and name c) (resid 105 and name n)  1   -34.0  30.0  2
! D105
  assign (resid 104 and name c) (resid 105 and name n) (resid 105 and name ca) (resid 105 and name c)  1   -93.0  40.0  2
  assign (resid 105 and name n) (resid 105 and name ca) (resid 105 and name c) (resid 106 and name n)  1   -19.0  40.0  2
! E106
! G107
! V108
  assign (resid 107 and name c) (resid 108 and name n) (resid 108 and name ca) (resid 108 and name c)  1  -112.0  30.0  2
  assign (resid 108 and name n) (resid 108 and name ca) (resid 108 and name c) (resid 109 and name n)  1   129.0  30.0  2
! Y109
  assign (resid 108 and name c) (resid 109 and name n) (resid 109 and name ca) (resid 109 and name c)  1  -108.0  30.0  2
  assign (resid 109 and name n) (resid 109 and name ca) (resid 109 and name c) (resid 110 and name n)  1   129.0  30.0  2
! T110
  assign (resid 109 and name c) (resid 110 and name n) (resid 110 and name ca) (resid 110 and name c)  1  -117.0  30.0  2
  assign (resid 110 and name n) (resid 110 and name ca) (resid 110 and name c) (resid 111 and name n)  1   132.0  30.0  2
! V111
  assign (resid 110 and name c) (resid 111 and name n) (resid 111 and name ca) (resid 111 and name c)  1  -112.0  40.0  2
  assign (resid 111 and name n) (resid 111 and name ca) (resid 111 and name c) (resid 112 and name n)  1   128.0  30.0  2
! T112
  assign (resid 111 and name c) (resid 112 and name n) (resid 112 and name ca) (resid 112 and name c)  1  -111.0  40.0  2
  assign (resid 112 and name n) (resid 112 and name ca) (resid 112 and name c) (resid 113 and name n)  1   135.0  30.0  2
! V113
  assign (resid 112 and name c) (resid 113 and name n) (resid 113 and name ca) (resid 113 and name c)  1  -126.0  40.0  2
  assign (resid 113 and name n) (resid 113 and name ca) (resid 113 and name c) (resid 114 and name n)  1   138.0  30.0  2
! K114
  assign (resid 113 and name c) (resid 114 and name n) (resid 114 and name ca) (resid 114 and name c)  1  -109.0  30.0  2
  assign (resid 114 and name n) (resid 114 and name ca) (resid 114 and name c) (resid 115 and name n)  1   128.0  40.0  2
! N115
!  assign (resid 114 and name c) (resid 115 and name n) (resid 115 and name ca) (resid 115 and name c)  1  -100.0  40.0  2
!  assign (resid 115 and name n) (resid 115 and name ca) (resid 115 and name c) (resid 116 and name n)  1   119.0  30.0  2
! P116
  assign (resid 115 and name c) (resid 116 and name n) (resid 116 and name ca) (resid 116 and name c)  1   -73.0  30.0  2
  assign (resid 116 and name n) (resid 116 and name ca) (resid 116 and name c) (resid 117 and name n)  1   -17.0  40.0  2
! V117
  assign (resid 116 and name c) (resid 117 and name n) (resid 117 and name ca) (resid 117 and name c)  1   -96.0  30.0  2
  assign (resid 117 and name n) (resid 117 and name ca) (resid 117 and name c) (resid 118 and name n)  1   -28.0  30.0  2
! G118
! E119
  assign (resid 118 and name c) (resid 119 and name n) (resid 119 and name ca) (resid 119 and name c)  1  -129.0  40.0  2
  assign (resid 119 and name n) (resid 119 and name ca) (resid 119 and name c) (resid 120 and name n)  1   145.0  30.0  2
! D120
  assign (resid 119 and name c) (resid 120 and name n) (resid 120 and name ca) (resid 120 and name c)  1  -136.0  40.0  2
  assign (resid 120 and name n) (resid 120 and name ca) (resid 120 and name c) (resid 121 and name n)  1   138.0  50.0  2
! Q121
  assign (resid 120 and name c) (resid 121 and name n) (resid 121 and name ca) (resid 121 and name c)  1  -107.0  40.0  2
  assign (resid 121 and name n) (resid 121 and name ca) (resid 121 and name c) (resid 122 and name n)  1   136.0  30.0  2
! V122
  assign (resid 121 and name c) (resid 122 and name n) (resid 122 and name ca) (resid 122 and name c)  1  -144.0  30.0  2
  assign (resid 122 and name n) (resid 122 and name ca) (resid 122 and name c) (resid 123 and name n)  1   151.0  30.0  2
! N123
  assign (resid 122 and name c) (resid 123 and name n) (resid 123 and name ca) (resid 123 and name c)  1  -107.0  30.0  2
  assign (resid 123 and name n) (resid 123 and name ca) (resid 123 and name c) (resid 124 and name n)  1   120.0  30.0  2
! L124
  assign (resid 123 and name c) (resid 124 and name n) (resid 124 and name ca) (resid 124 and name c)  1   -86.0  30.0  2
  assign (resid 124 and name n) (resid 124 and name ca) (resid 124 and name c) (resid 125 and name n)  1   125.0  30.0  2
! T125
  assign (resid 124 and name c) (resid 125 and name n) (resid 125 and name ca) (resid 125 and name c)  1  -107.0  70.0  2
  assign (resid 125 and name n) (resid 125 and name ca) (resid 125 and name c) (resid 126 and name n)  1   128.0  30.0  2
! V126
  assign (resid 125 and name c) (resid 126 and name n) (resid 126 and name ca) (resid 126 and name c)  1  -111.0  30.0  2
  assign (resid 126 and name n) (resid 126 and name ca) (resid 126 and name c) (resid 127 and name n)  1   129.0  30.0  2
! K127
  assign (resid 126 and name c) (resid 127 and name n) (resid 127 and name ca) (resid 127 and name c)  1  -129.0  40.0  2
  assign (resid 127 and name n) (resid 127 and name ca) (resid 127 and name c) (resid 128 and name n)  1   139.0  40.0  2
! V128
  assign (resid 127 and name c) (resid 128 and name n) (resid 128 and name ca) (resid 128 and name c)  1  -110.0  30.0  2
  assign (resid 128 and name n) (resid 128 and name ca) (resid 128 and name c) (resid 129 and name n)  1   131.0  30.0  2
! I129
  assign (resid 128 and name c) (resid 129 and name n) (resid 129 and name ca) (resid 129 and name c)  1  -107.0  40.0  2
  assign (resid 129 and name n) (resid 129 and name ca) (resid 129 and name c) (resid 130 and name n)  1   136.0  30.0  2

end
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1          1H        ARG   1  26.796   3.561  -6.737
    2    H2   ARG   1          2H        ARG   1  26.893   3.301  -8.414
    3    H3   ARG   1          3H        ARG   1  28.160   2.799  -7.398
    4    HA   ARG   1           HA       ARG   1  28.816   5.022  -6.938
    5   1HB   ARG   1          1HB       ARG   1  28.086   4.548  -9.848
    6   2HB   ARG   1          2HB       ARG   1  29.278   5.723  -9.291
    7   1HG   ARG   1          1HG       ARG   1  30.372   3.704  -8.072
    8   2HG   ARG   1          2HG       ARG   1  29.401   2.715  -9.163
    9   1HD   ARG   1          1HD       ARG   1  30.481   4.563 -10.901
   10   2HD   ARG   1          2HD       ARG   1  31.805   4.314  -9.745
   11    HE   ARG   1           HE       ARG   1  30.731   2.294 -11.566
   12   1HH1  ARG   1          1HH1      ARG   1  33.555   2.853 -10.259
   13   2HH1  ARG   1          2HH1      ARG   1  33.774   1.351  -9.426
   14   1HH2  ARG   1          1HH2      ARG   1  30.463   0.377  -9.765
   15   2HH2  ARG   1          2HH2      ARG   1  32.023  -0.052  -9.146
   16    H    GLN   2           H        GLN   2  26.318   5.394  -5.978
   17    HA   GLN   2           HA       GLN   2  25.471   7.935  -7.270
   18   1HB   GLN   2          1HB       GLN   2  23.111   7.145  -7.197
   19   2HB   GLN   2          2HB       GLN   2  24.113   6.123  -8.228
   20   1HG   GLN   2          1HG       GLN   2  24.123   4.369  -6.725
   21   2HG   GLN   2          2HG       GLN   2  23.847   5.416  -5.338
   22   1HE2  GLN   2          2HE2      GLN   2  21.724   5.578  -4.593
   23   2HE2  GLN   2          1HE2      GLN   2  20.359   5.049  -5.450
   24    H    GLU   3           H        GLU   3  23.004   7.454  -5.318
   25    HA   GLU   3           HA       GLU   3  24.454   8.393  -2.870
   26   1HB   GLU   3          1HB       GLU   3  21.748   9.053  -4.065
   27   2HB   GLU   3          2HB       GLU   3  22.256   9.597  -2.466
   28   1HG   GLU   3          1HG       GLU   3  24.154  10.788  -3.425
   29   2HG   GLU   3          2HG       GLU   3  23.769  10.168  -5.030
   30    HA   PRO   4           HA       PRO   4  22.792   4.908  -0.735
   31   1HB   PRO   4          1HB       PRO   4  22.571   5.971   1.786
   32   2HB   PRO   4          2HB       PRO   4  24.118   5.477   1.066
   33   1HG   PRO   4          1HG       PRO   4  22.896   8.200   1.227
   34   2HG   PRO   4          2HG       PRO   4  24.568   7.698   1.539
   35   1HD   PRO   4          1HD       PRO   4  23.879   8.846  -0.779
   36   2HD   PRO   4          2HD       PRO   4  25.084   7.538  -0.719
   37    HA   PRO   5           HA       PRO   5  18.441   5.830  -1.004
   38   1HB   PRO   5          1HB       PRO   5  17.561   3.314  -0.378
   39   2HB   PRO   5          2HB       PRO   5  18.210   3.738  -1.972
   40   1HG   PRO   5          1HG       PRO   5  19.548   2.393   0.328
   41   2HG   PRO   5          2HG       PRO   5  19.627   2.003  -1.397
   42   1HD   PRO   5          1HD       PRO   5  21.589   3.349  -0.134
   43   2HD   PRO   5          2HD       PRO   5  21.169   3.654  -1.835
   44    H    LYS   6           H        LYS   6  16.787   6.256   0.533
   45    HA   LYS   6           HA       LYS   6  16.808   5.156   3.222
   46   1HB   LYS   6          1HB       LYS   6  18.354   7.564   2.539
   47   2HB   LYS   6          2HB       LYS   6  17.249   7.805   3.892
   48   1HG   LYS   6          1HG       LYS   6  18.274   5.397   4.573
   49   2HG   LYS   6          2HG       LYS   6  19.650   6.067   3.697
   50   1HD   LYS   6          1HD       LYS   6  19.265   8.195   5.118
   51   2HD   LYS   6          2HD       LYS   6  18.278   7.160   6.150
   52   1HE   LYS   6          1HE       LYS   6  20.161   5.679   6.571
   53   2HE   LYS   6          2HE       LYS   6  21.162   6.562   5.401
   54   1HZ   LYS   6          1HZ       LYS   6  19.876   7.806   7.772
   55   2HZ   LYS   6          2HZ       LYS   6  21.495   7.302   7.731
   56   3HZ   LYS   6          3HZ       LYS   6  20.967   8.544   6.698
   57    H    ILE   7           H        ILE   7  14.960   5.902   4.435
   58    HA   ILE   7           HA       ILE   7  12.763   6.927   2.788
   59    HB   ILE   7           HB       ILE   7  12.848   6.378   5.770
   60   1HG1  ILE   7          1HG1      ILE   7  13.771   4.411   4.692
   61   2HG1  ILE   7          2HG1      ILE   7  12.107   4.054   5.139
   62   1HG2  ILE   7          1HG2      ILE   7  10.831   7.492   4.703
   63   2HG2  ILE   7          2HG2      ILE   7  10.596   6.005   3.784
   64   3HG2  ILE   7          3HG2      ILE   7  10.496   5.979   5.544
   65   1HD1  ILE   7          1HD1      ILE   7  11.376   4.562   2.835
   66   2HD1  ILE   7          2HD1      ILE   7  13.044   4.917   2.385
   67   3HD1  ILE   7          3HD1      ILE   7  12.584   3.278   2.846
   68    H    HIS   8           H        HIS   8  14.579   8.952   2.791
   69    HA   HIS   8           HA       HIS   8  13.493  10.923   4.774
   70   1HB   HIS   8          1HB       HIS   8  15.760  10.380   5.347
   71   2HB   HIS   8          2HB       HIS   8  16.271  10.444   3.662
   72    HD1  HIS   8           HD1      HIS   8  15.983  12.501   6.673
   73    HD2  HIS   8           HD2      HIS   8  16.156  13.204   2.568
   74    HE1  HIS   8           HE1      HIS   8  16.566  14.949   6.392
   75    H    LEU   9           H        LEU   9  13.596  13.213   3.914
   76    HA   LEU   9           HA       LEU   9  13.288  13.249   0.935
   77   1HB   LEU   9          1HB       LEU   9  11.856  15.426   1.928
   78   2HB   LEU   9          2HB       LEU   9  11.184  13.909   1.377
   79    HG   LEU   9           HG       LEU   9  11.532  13.043   3.767
   80   1HD1  LEU   9          1HD1      LEU   9  13.088  14.883   4.443
   81   2HD1  LEU   9          2HD1      LEU   9  11.754  16.024   4.290
   82   3HD1  LEU   9          3HD1      LEU   9  11.690  14.752   5.507
   83   1HD2  LEU   9          1HD2      LEU   9   9.589  15.135   2.867
   84   2HD2  LEU   9          2HD2      LEU   9   9.307  13.435   3.244
   85   3HD2  LEU   9          3HD2      LEU   9   9.539  14.600   4.547
   86    H    ASP  10           H        ASP  10  13.186  16.158   2.920
   87    HA   ASP  10           HA       ASP  10  15.810  16.949   1.706
   88   1HB   ASP  10          1HB       ASP  10  13.615  17.975   0.891
   89   2HB   ASP  10          2HB       ASP  10  13.508  18.752   2.471
   90    H    CYS  11           H        CYS  11  14.118  16.519   4.702
   91    HA   CYS  11           HA       CYS  11  16.459  17.407   6.197
   92   1HB   CYS  11          1HB       CYS  11  14.379  19.294   5.481
   93   2HB   CYS  11          2HB       CYS  11  14.514  19.162   7.234
   94    HG   CYS  11           HG       CYS  11  17.189  19.538   5.736
   95    HA   PRO  12           HA       PRO  12  13.152  16.322   9.460
   96   1HB   PRO  12          1HB       PRO  12  10.591  15.807   8.621
   97   2HB   PRO  12          2HB       PRO  12  11.157  17.418   9.108
   98   1HG   PRO  12          1HG       PRO  12  10.833  16.277   6.373
   99   2HG   PRO  12          2HG       PRO  12  10.435  17.895   6.973
  100   1HD   PRO  12          1HD       PRO  12  12.668  17.396   5.538
  101   2HD   PRO  12          2HD       PRO  12  12.609  18.640   6.807
  102    H    GLY  13           H        GLY  13  13.451  14.767   6.422
  103   1HA   GLY  13          2HA       GLY  13  14.128  12.244   7.325
  104   2HA   GLY  13          1HA       GLY  13  13.364  12.512   5.761
  105    H    ARG  14           H        ARG  14  10.808  13.278   6.458
  106    HA   ARG  14           HA       ARG  14   9.804  10.883   7.962
  107   1HB   ARG  14          1HB       ARG  14   9.696  13.565   8.702
  108   2HB   ARG  14          2HB       ARG  14   8.101  13.267   8.011
  109   1HG   ARG  14          1HG       ARG  14   8.025  11.160   9.462
  110   2HG   ARG  14          2HG       ARG  14   9.434  11.810  10.301
  111   1HD   ARG  14          1HD       ARG  14   6.906  13.441   9.940
  112   2HD   ARG  14          2HD       ARG  14   7.163  12.388  11.346
  113    HE   ARG  14           HE       ARG  14   9.481  14.048  10.866
  114   1HH1  ARG  14          1HH1      ARG  14   9.603  14.353  13.378
  115   2HH1  ARG  14          2HH1      ARG  14   8.427  15.488  13.952
  116   1HH2  ARG  14          1HH2      ARG  14   6.518  15.375  11.059
  117   2HH2  ARG  14          2HH2      ARG  14   6.680  16.067  12.638
  118    H    ILE  15           H        ILE  15   9.186   9.674   6.136
  119    HA   ILE  15           HA       ILE  15   7.706  10.897   3.917
  120    HB   ILE  15           HB       ILE  15   8.784   8.212   4.715
  121   1HG1  ILE  15          1HG1      ILE  15   8.929   9.860   2.175
  122   2HG1  ILE  15          2HG1      ILE  15  10.118   9.913   3.475
  123   1HG2  ILE  15          1HG2      ILE  15   6.445   8.674   2.926
  124   2HG2  ILE  15          2HG2      ILE  15   7.690   7.580   2.326
  125   3HG2  ILE  15          3HG2      ILE  15   6.883   7.241   3.856
  126   1HD1  ILE  15          1HD1      ILE  15   9.545   7.185   2.569
  127   2HD1  ILE  15          2HD1      ILE  15  10.202   8.210   1.297
  128   3HD1  ILE  15          3HD1      ILE  15  11.097   7.991   2.797
  129    HA   PRO  16           HA       PRO  16   3.883  10.377   6.207
  130   1HB   PRO  16          1HB       PRO  16   2.248  11.466   4.302
  131   2HB   PRO  16          2HB       PRO  16   3.238  12.446   5.401
  132   1HG   PRO  16          1HG       PRO  16   3.732  11.706   2.561
  133   2HG   PRO  16          2HG       PRO  16   4.046  13.232   3.402
  134   1HD   PRO  16          1HD       PRO  16   5.983  11.397   2.844
  135   2HD   PRO  16          2HD       PRO  16   6.061  12.520   4.220
  136    H    ASP  17           H        ASP  17   4.679   7.994   5.336
  137    HA   ASP  17           HA       ASP  17   3.301   6.852   3.090
  138   1HB   ASP  17          1HB       ASP  17   3.852   4.699   4.401
  139   2HB   ASP  17          2HB       ASP  17   5.211   5.734   3.972
  140    H    THR  18           H        THR  18   1.106   7.795   3.479
  141    HA   THR  18           HA       THR  18  -0.509   6.005   5.247
  142    HB   THR  18           HB       THR  18  -0.953   8.988   5.013
  143    HG1  THR  18           HG1      THR  18   0.532   7.574   6.973
  144   1HG2  THR  18          1HG2      THR  18  -2.017   6.729   6.646
  145   2HG2  THR  18          2HG2      THR  18  -1.878   8.307   7.422
  146   3HG2  THR  18          3HG2      THR  18  -2.862   8.122   5.971
  147    H    ILE  19           H        ILE  19  -1.553   4.924   3.566
  148    HA   ILE  19           HA       ILE  19  -2.686   6.505   1.321
  149    HB   ILE  19           HB       ILE  19  -1.313   4.423   1.008
  150   1HG1  ILE  19          1HG1      ILE  19  -2.872   3.375  -0.617
  151   2HG1  ILE  19          2HG1      ILE  19  -4.196   4.290   0.095
  152   1HG2  ILE  19          1HG2      ILE  19  -2.723   3.414   3.100
  153   2HG2  ILE  19          2HG2      ILE  19  -3.606   2.702   1.750
  154   3HG2  ILE  19          3HG2      ILE  19  -1.875   2.412   1.923
  155   1HD1  ILE  19          1HD1      ILE  19  -1.707   5.581  -1.054
  156   2HD1  ILE  19          2HD1      ILE  19  -3.191   5.346  -1.976
  157   3HD1  ILE  19          3HD1      ILE  19  -3.193   6.389  -0.555
  158    H    VAL  20           H        VAL  20  -4.757   7.266   1.613
  159    HA   VAL  20           HA       VAL  20  -6.684   5.525   3.113
  160    HB   VAL  20           HB       VAL  20  -6.357   8.544   3.154
  161   1HG1  VAL  20          1HG1      VAL  20  -8.720   7.624   3.368
  162   2HG1  VAL  20          2HG1      VAL  20  -8.182   6.821   4.844
  163   3HG1  VAL  20          3HG1      VAL  20  -8.156   8.582   4.737
  164   1HG2  VAL  20          1HG2      VAL  20  -5.499   6.303   4.949
  165   2HG2  VAL  20          2HG2      VAL  20  -4.656   7.799   4.547
  166   3HG2  VAL  20          3HG2      VAL  20  -5.998   7.823   5.691
  167    H    VAL  21           H        VAL  21  -8.798   5.484   2.282
  168    HA   VAL  21           HA       VAL  21  -9.455   7.152  -0.095
  169    HB   VAL  21           HB       VAL  21  -8.373   5.204  -1.027
  170   1HG1  VAL  21          1HG1      VAL  21  -9.776   3.870   1.206
  171   2HG1  VAL  21          2HG1      VAL  21  -9.735   2.956  -0.300
  172   3HG1  VAL  21          3HG1      VAL  21  -8.230   3.478   0.453
  173   1HG2  VAL  21          1HG2      VAL  21 -10.660   5.943  -1.947
  174   2HG2  VAL  21          2HG2      VAL  21 -10.103   4.331  -2.397
  175   3HG2  VAL  21          3HG2      VAL  21 -11.313   4.524  -1.128
  176    H    VAL  22           H        VAL  22 -11.793   7.046  -0.589
  177    HA   VAL  22           HA       VAL  22 -13.409   6.539   1.848
  178    HB   VAL  22           HB       VAL  22 -14.020   7.841  -0.830
  179   1HG1  VAL  22          1HG1      VAL  22 -15.641   7.264   1.596
  180   2HG1  VAL  22          2HG1      VAL  22 -15.827   8.872   0.894
  181   3HG1  VAL  22          3HG1      VAL  22 -16.152   7.440  -0.083
  182   1HG2  VAL  22          1HG2      VAL  22 -12.299   8.818   0.963
  183   2HG2  VAL  22          2HG2      VAL  22 -13.429   9.872   0.113
  184   3HG2  VAL  22          3HG2      VAL  22 -13.789   9.333   1.753
  185    H    ALA  23           H        ALA  23 -12.658   4.126   0.921
  186    HA   ALA  23           HA       ALA  23 -13.386   2.075  -0.006
  187   1HB   ALA  23          2HB       ALA  23 -16.049   3.341   0.689
  188   2HB   ALA  23          1HB       ALA  23 -14.940   2.660   1.881
  189   3HB   ALA  23          3HB       ALA  23 -15.671   1.618   0.661
  190    H    GLY  24           H        GLY  24 -12.865   2.329  -2.245
  191   1HA   GLY  24          2HA       GLY  24 -15.194   2.442  -4.006
  192   2HA   GLY  24          1HA       GLY  24 -13.535   2.116  -4.504
  193    H    ASN  25           H        ASN  25 -12.188   4.363  -3.682
  194    HA   ASN  25           HA       ASN  25 -13.456   6.476  -5.375
  195   1HB   ASN  25          1HB       ASN  25 -12.984   6.464  -2.508
  196   2HB   ASN  25          2HB       ASN  25 -12.105   7.782  -3.278
  197   1HD2  ASN  25          1HD2      ASN  25 -13.340   9.494  -4.269
  198   2HD2  ASN  25          2HD2      ASN  25 -15.024   9.616  -4.094
  199    H    LYS  26           H        LYS  26 -11.822   8.093  -6.094
  200    HA   LYS  26           HA       LYS  26  -9.331   6.809  -6.910
  201   1HB   LYS  26          1HB       LYS  26 -10.483   9.604  -7.168
  202   2HB   LYS  26          2HB       LYS  26  -8.987   9.090  -7.949
  203   1HG   LYS  26          1HG       LYS  26 -10.076   7.829  -9.508
  204   2HG   LYS  26          2HG       LYS  26 -11.309   7.298  -8.363
  205   1HD   LYS  26          1HD       LYS  26 -12.371   8.724 -10.012
  206   2HD   LYS  26          2HD       LYS  26 -12.316   9.596  -8.479
  207   1HE   LYS  26          1HE       LYS  26 -10.041  10.540  -9.381
  208   2HE   LYS  26          2HE       LYS  26 -10.678  10.053 -10.965
  209   1HZ   LYS  26          1HZ       LYS  26 -12.246  11.620  -8.992
  210   2HZ   LYS  26          2HZ       LYS  26 -11.337  12.342 -10.229
  211   3HZ   LYS  26          3HZ       LYS  26 -12.634  11.316 -10.618
  212    H    LEU  27           H        LEU  27  -7.747   6.576  -5.343
  213    HA   LEU  27           HA       LEU  27  -7.299   8.875  -3.478
  214   1HB   LEU  27          1HB       LEU  27  -7.745   7.051  -2.134
  215   2HB   LEU  27          2HB       LEU  27  -7.165   5.897  -3.330
  216    HG   LEU  27           HG       LEU  27  -4.843   6.474  -2.807
  217   1HD1  LEU  27          1HD1      LEU  27  -6.039   8.825  -1.733
  218   2HD1  LEU  27          2HD1      LEU  27  -5.223   8.000  -0.405
  219   3HD1  LEU  27          3HD1      LEU  27  -4.322   8.443  -1.854
  220   1HD2  LEU  27          1HD2      LEU  27  -6.741   5.615  -0.679
  221   2HD2  LEU  27          2HD2      LEU  27  -5.393   4.740  -1.401
  222   3HD2  LEU  27          3HD2      LEU  27  -5.092   5.977  -0.181
  223    H    ARG  28           H        ARG  28  -5.238   9.770  -3.345
  224    HA   ARG  28           HA       ARG  28  -3.111   8.635  -5.128
  225   1HB   ARG  28          1HB       ARG  28  -4.377  10.638  -6.034
  226   2HB   ARG  28          2HB       ARG  28  -3.754  11.564  -4.669
  227   1HG   ARG  28          1HG       ARG  28  -2.042  12.029  -6.108
  228   2HG   ARG  28          2HG       ARG  28  -1.451  10.452  -5.583
  229   1HD   ARG  28          1HD       ARG  28  -1.783   9.551  -7.642
  230   2HD   ARG  28          2HD       ARG  28  -3.418  10.235  -7.750
  231    HE   ARG  28           HE       ARG  28  -1.122  12.092  -8.079
  232   1HH1  ARG  28          1HH1      ARG  28  -4.007  12.733  -8.760
  233   2HH1  ARG  28          2HH1      ARG  28  -3.991  12.594 -10.487
  234   1HH2  ARG  28          1HH2      ARG  28  -0.985  10.869 -10.585
  235   2HH2  ARG  28          2HH2      ARG  28  -2.280  11.540 -11.520
  236    H    LEU  29           H        LEU  29  -1.177   8.371  -4.042
  237    HA   LEU  29           HA       LEU  29  -0.793   9.892  -1.478
  238   1HB   LEU  29          1HB       LEU  29  -1.420   7.587  -1.034
  239   2HB   LEU  29          2HB       LEU  29  -0.223   7.001  -2.183
  240    HG   LEU  29           HG       LEU  29   1.585   7.888  -0.786
  241   1HD1  LEU  29          1HD1      LEU  29  -0.707   8.777   0.984
  242   2HD1  LEU  29          2HD1      LEU  29   0.975   8.725   1.516
  243   3HD1  LEU  29          3HD1      LEU  29   0.496   9.805   0.205
  244   1HD2  LEU  29          1HD2      LEU  29  -0.449   6.022   0.382
  245   2HD2  LEU  29          2HD2      LEU  29   1.185   5.677  -0.181
  246   3HD2  LEU  29          3HD2      LEU  29   0.938   6.491   1.363
  247    H    ASP  30           H        ASP  30   1.088  11.044  -1.473
  248    HA   ASP  30           HA       ASP  30   3.259  10.220  -3.378
  249   1HB   ASP  30          1HB       ASP  30   2.312  12.968  -2.504
  250   2HB   ASP  30          2HB       ASP  30   3.684  12.672  -3.572
  251    H    VAL  31           H        VAL  31   5.164   9.766  -2.374
  252    HA   VAL  31           HA       VAL  31   5.828  11.146   0.187
  253    HB   VAL  31           HB       VAL  31   6.628   8.810   0.955
  254   1HG1  VAL  31          1HG1      VAL  31   4.521  10.099   1.672
  255   2HG1  VAL  31          2HG1      VAL  31   3.642   9.042   0.568
  256   3HG1  VAL  31          3HG1      VAL  31   4.516   8.355   1.937
  257   1HG2  VAL  31          1HG2      VAL  31   6.245   7.964  -1.498
  258   2HG2  VAL  31          2HG2      VAL  31   5.837   6.904  -0.150
  259   3HG2  VAL  31          3HG2      VAL  31   4.567   7.798  -0.987
  260    HA   PRO  32           HA       PRO  32   9.559  11.385  -2.273
  261   1HB   PRO  32          1HB       PRO  32  10.905  13.092  -0.619
  262   2HB   PRO  32          2HB       PRO  32   9.625  13.627  -1.725
  263   1HG   PRO  32          1HG       PRO  32   9.527  13.184   1.204
  264   2HG   PRO  32          2HG       PRO  32   8.680  14.377   0.211
  265   1HD   PRO  32          1HD       PRO  32   7.565  12.056   1.220
  266   2HD   PRO  32          2HD       PRO  32   6.925  12.988  -0.150
  267    H    ILE  33           H        ILE  33  11.589  10.368  -2.161
  268    HA   ILE  33           HA       ILE  33  12.462   9.273   0.481
  269    HB   ILE  33           HB       ILE  33  12.691   7.529  -1.934
  270   1HG1  ILE  33          1HG1      ILE  33  10.064   7.736  -0.429
  271   2HG1  ILE  33          2HG1      ILE  33  10.330   8.483  -2.002
  272   1HG2  ILE  33          1HG2      ILE  33  12.957   7.313   0.884
  273   2HG2  ILE  33          2HG2      ILE  33  11.589   6.300   0.424
  274   3HG2  ILE  33          3HG2      ILE  33  13.167   6.042  -0.319
  275   1HD1  ILE  33          1HD1      ILE  33  11.095   5.625  -1.772
  276   2HD1  ILE  33          2HD1      ILE  33   9.367   5.976  -1.717
  277   3HD1  ILE  33          3HD1      ILE  33  10.325   6.483  -3.108
  278    H    SER  34           H        SER  34  14.766   8.353   0.241
  279    HA   SER  34           HA       SER  34  16.429  10.320  -1.166
  280   1HB   SER  34          1HB       SER  34  16.604   8.810   1.131
  281   2HB   SER  34          2HB       SER  34  17.671   7.929   0.042
  282    HG   SER  34           HG       SER  34  17.769  10.666   0.782
  283    H    GLY  35           H        GLY  35  18.571   8.279  -1.678
  284   1HA   GLY  35          2HA       GLY  35  17.503   6.462  -3.696
  285   2HA   GLY  35          1HA       GLY  35  19.210   6.715  -3.329
  286    H    ASP  36           H        ASP  36  19.841   6.976  -5.506
  287    HA   ASP  36           HA       ASP  36  18.537   9.078  -7.136
  288   1HB   ASP  36          1HB       ASP  36  20.448   9.837  -5.414
  289   2HB   ASP  36          2HB       ASP  36  21.488   9.305  -6.735
  290    HA   PRO  37           HA       PRO  37  18.473   9.763  -8.962
  291   1HB   PRO  37          1HB       PRO  37  17.136   9.006 -11.222
  292   2HB   PRO  37          2HB       PRO  37  18.731   9.779 -11.256
  293   1HG   PRO  37          1HG       PRO  37  18.002   6.938 -11.645
  294   2HG   PRO  37          2HG       PRO  37  19.309   7.882 -12.370
  295   1HD   PRO  37          1HD       PRO  37  19.606   6.078 -10.288
  296   2HD   PRO  37          2HD       PRO  37  20.758   7.363 -10.707
  297    H    ALA  38           H        ALA  38  17.077   6.618  -9.995
  298    HA   ALA  38           HA       ALA  38  14.764   7.151  -8.171
  299   1HB   ALA  38          2HB       ALA  38  14.218   5.050  -9.990
  300   2HB   ALA  38          3HB       ALA  38  13.597   6.700 -10.047
  301   3HB   ALA  38          1HB       ALA  38  15.081   6.286 -10.905
  302    HA   PRO  39           HA       PRO  39  16.401   3.595  -6.014
  303   1HB   PRO  39          1HB       PRO  39  14.760   3.788  -3.841
  304   2HB   PRO  39          2HB       PRO  39  16.162   4.847  -4.082
  305   1HG   PRO  39          1HG       PRO  39  13.298   5.439  -4.353
  306   2HG   PRO  39          2HG       PRO  39  14.651   6.525  -4.021
  307   1HD   PRO  39          1HD       PRO  39  13.320   6.142  -6.495
  308   2HD   PRO  39          2HD       PRO  39  14.775   7.113  -6.194
  309    H    THR  40           H        THR  40  14.902   1.869  -4.524
  310    HA   THR  40           HA       THR  40  12.750   0.930  -6.395
  311    HB   THR  40           HB       THR  40  14.313  -0.923  -4.630
  312    HG1  THR  40           HG1      THR  40  15.248   0.218  -7.052
  313   1HG2  THR  40          1HG2      THR  40  12.456  -1.741  -6.036
  314   2HG2  THR  40          2HG2      THR  40  13.269  -1.109  -7.469
  315   3HG2  THR  40          3HG2      THR  40  13.998  -2.427  -6.550
  316    H    VAL  41           H        VAL  41  11.166   2.044  -5.050
  317    HA   VAL  41           HA       VAL  41  10.937   1.223  -2.217
  318    HB   VAL  41           HB       VAL  41  10.644   3.568  -2.904
  319   1HG1  VAL  41          1HG1      VAL  41   9.357   2.485  -5.117
  320   2HG1  VAL  41          2HG1      VAL  41   8.036   3.191  -4.189
  321   3HG1  VAL  41          3HG1      VAL  41   9.397   4.195  -4.688
  322   1HG2  VAL  41          1HG2      VAL  41   9.303   2.524  -1.002
  323   2HG2  VAL  41          2HG2      VAL  41   8.630   4.004  -1.683
  324   3HG2  VAL  41          3HG2      VAL  41   7.944   2.440  -2.123
  325    H    ILE  42           H        ILE  42  10.204  -0.927  -2.215
  326    HA   ILE  42           HA       ILE  42   7.908  -1.709  -3.905
  327    HB   ILE  42           HB       ILE  42  10.151  -2.920  -2.516
  328   1HG1  ILE  42          1HG1      ILE  42   8.475  -4.653  -4.184
  329   2HG1  ILE  42          2HG1      ILE  42   8.844  -3.109  -4.954
  330   1HG2  ILE  42          1HG2      ILE  42   7.422  -4.127  -1.995
  331   2HG2  ILE  42          2HG2      ILE  42   8.926  -5.039  -1.867
  332   3HG2  ILE  42          3HG2      ILE  42   8.634  -3.665  -0.802
  333   1HD1  ILE  42          1HD1      ILE  42  11.286  -3.633  -4.046
  334   2HD1  ILE  42          2HD1      ILE  42  10.701  -5.295  -4.106
  335   3HD1  ILE  42          3HD1      ILE  42  10.720  -4.314  -5.571
  336    H    TRP  43           H        TRP  43   5.849  -1.376  -3.161
  337    HA   TRP  43           HA       TRP  43   5.315  -0.696  -0.355
  338   1HB   TRP  43          1HB       TRP  43   3.669  -1.095  -2.871
  339   2HB   TRP  43          2HB       TRP  43   2.925  -0.704  -1.322
  340    HD1  TRP  43           HD1      TRP  43   4.475   0.868  -4.269
  341    HE1  TRP  43           HE1      TRP  43   4.901   3.375  -3.847
  342    HE3  TRP  43           HE3      TRP  43   3.725   1.061   0.782
  343    HZ2  TRP  43           HZ2      TRP  43   4.923   5.215  -1.658
  344    HZ3  TRP  43           HZ3      TRP  43   3.970   3.187   2.007
  345    HH2  TRP  43           HH2      TRP  43   4.562   5.272   0.797
  346    H    GLN  44           H        GLN  44   5.512  -2.499   1.023
  347    HA   GLN  44           HA       GLN  44   4.334  -5.096   0.166
  348   1HB   GLN  44          1HB       GLN  44   6.667  -4.517   1.338
  349   2HB   GLN  44          2HB       GLN  44   5.684  -4.648   2.797
  350   1HG   GLN  44          1HG       GLN  44   4.826  -6.867   1.670
  351   2HG   GLN  44          2HG       GLN  44   6.331  -6.752   0.757
  352   1HE2  GLN  44          2HE2      GLN  44   8.317  -6.175   2.334
  353   2HE2  GLN  44          1HE2      GLN  44   8.373  -7.089   3.763
  354    H    LYS  45           H        LYS  45   2.902  -6.238   1.714
  355    HA   LYS  45           HA       LYS  45   1.159  -4.320   3.216
  356   1HB   LYS  45          1HB       LYS  45   0.186  -5.559   1.300
  357   2HB   LYS  45          2HB       LYS  45   0.624  -7.082   2.074
  358   1HG   LYS  45          1HG       LYS  45  -0.988  -6.867   3.728
  359   2HG   LYS  45          2HG       LYS  45  -1.004  -5.106   3.628
  360   1HD   LYS  45          1HD       LYS  45  -2.079  -5.290   1.376
  361   2HD   LYS  45          2HD       LYS  45  -2.169  -7.037   1.603
  362   1HE   LYS  45          1HE       LYS  45  -3.268  -6.067   3.960
  363   2HE   LYS  45          2HE       LYS  45  -3.877  -4.937   2.734
  364   1HZ   LYS  45          1HZ       LYS  45  -4.481  -6.847   1.353
  365   2HZ   LYS  45          2HZ       LYS  45  -3.969  -7.904   2.577
  366   3HZ   LYS  45          3HZ       LYS  45  -5.298  -6.879   2.843
  367    H    ALA  46           H        ALA  46   0.454  -4.930   5.341
  368    HA   ALA  46           HA       ALA  46   1.860  -7.267   6.579
  369   1HB   ALA  46          1HB       ALA  46   2.045  -4.360   7.125
  370   2HB   ALA  46          3HB       ALA  46   3.221  -5.637   7.437
  371   3HB   ALA  46          2HB       ALA  46   1.881  -5.380   8.555
  372    H    ILE  47           H        ILE  47   0.445  -8.496   7.765
  373    HA   ILE  47           HA       ILE  47  -2.250  -7.351   8.367
  374    HB   ILE  47           HB       ILE  47  -1.207 -10.198   8.211
  375   1HG1  ILE  47          1HG1      ILE  47  -1.219  -9.039   6.032
  376   2HG1  ILE  47          2HG1      ILE  47  -2.477 -10.273   6.088
  377   1HG2  ILE  47          1HG2      ILE  47  -3.874  -9.000   8.871
  378   2HG2  ILE  47          2HG2      ILE  47  -3.824 -10.521   7.980
  379   3HG2  ILE  47          3HG2      ILE  47  -3.076 -10.407   9.574
  380   1HD1  ILE  47          1HD1      ILE  47  -4.086  -8.433   6.800
  381   2HD1  ILE  47          2HD1      ILE  47  -2.812  -7.280   6.400
  382   3HD1  ILE  47          3HD1      ILE  47  -3.492  -8.315   5.144
  383    H    THR  48           H        THR  48   0.663  -7.874   9.918
  384    HA   THR  48           HA       THR  48   1.298  -8.230  12.170
  385    HB   THR  48           HB       THR  48  -0.023  -6.801  13.664
  386    HG1  THR  48           HG1      THR  48  -2.082  -7.411  13.064
  387   1HG2  THR  48          1HG2      THR  48   0.207  -5.739  10.837
  388   2HG2  THR  48          2HG2      THR  48  -0.068  -4.731  12.257
  389   3HG2  THR  48          3HG2      THR  48   1.432  -5.646  12.102
  390    H    GLN  49           H        GLN  49   0.435 -10.630  11.432
  391    HA   GLN  49           HA       GLN  49  -1.813 -11.478  13.191
  392   1HB   GLN  49          1HB       GLN  49  -0.668 -12.236  10.654
  393   2HB   GLN  49          2HB       GLN  49  -0.662 -13.632  11.731
  394   1HG   GLN  49          1HG       GLN  49  -3.101 -13.011  12.273
  395   2HG   GLN  49          2HG       GLN  49  -3.020 -11.959  10.859
  396   1HE2  GLN  49          2HE2      GLN  49  -4.581 -13.348   9.708
  397   2HE2  GLN  49          1HE2      GLN  49  -4.105 -14.854   9.086
  398    H    GLY  50           H        GLY  50   1.240 -13.124  12.341
  399   1HA   GLY  50          2HA       GLY  50   1.454 -14.421  14.890
  400   2HA   GLY  50          1HA       GLY  50   2.511 -13.009  14.858
  401    H    ASN  51           H        ASN  51   4.407 -13.116  13.651
  402    HA   ASN  51           HA       ASN  51   5.186 -15.798  12.676
  403   1HB   ASN  51          1HB       ASN  51   4.055 -13.915  10.962
  404   2HB   ASN  51          2HB       ASN  51   5.788 -13.717  10.703
  405   1HD2  ASN  51          2HD2      ASN  51   6.023 -14.831   8.707
  406   2HD2  ASN  51          1HD2      ASN  51   5.634 -16.470   8.499
  407    H    LYS  52           H        LYS  52   7.497 -14.886  11.267
  408    HA   LYS  52           HA       LYS  52   9.745 -14.308  11.732
  409   1HB   LYS  52          1HB       LYS  52   7.984 -12.143  12.233
  410   2HB   LYS  52          2HB       LYS  52   9.171 -12.127  13.537
  411   1HG   LYS  52          1HG       LYS  52  10.310 -10.900  11.935
  412   2HG   LYS  52          2HG       LYS  52  10.875 -12.524  11.543
  413   1HD   LYS  52          1HD       LYS  52   8.334 -11.734  10.247
  414   2HD   LYS  52          2HD       LYS  52   9.754 -10.832   9.721
  415   1HE   LYS  52          1HE       LYS  52  10.328 -13.690   9.932
  416   2HE   LYS  52          2HE       LYS  52   9.007 -13.358   8.795
  417   1HZ   LYS  52          1HZ       LYS  52  11.616 -11.933   8.855
  418   2HZ   LYS  52          2HZ       LYS  52  11.184 -13.130   7.729
  419   3HZ   LYS  52          3HZ       LYS  52  10.352 -11.650   7.760
  420    H    ALA  53           H        ALA  53  10.855 -13.178  14.057
  421    HA   ALA  53           HA       ALA  53  11.401 -15.381  15.708
  422   1HB   ALA  53          3HB       ALA  53  12.711 -13.839  16.761
  423   2HB   ALA  53          1HB       ALA  53  12.168 -12.751  15.484
  424   3HB   ALA  53          2HB       ALA  53  11.352 -12.751  17.048
  425    HA   PRO  54           HA       PRO  54   8.038 -15.822  18.500
  426   1HB   PRO  54          1HB       PRO  54   9.210 -15.975  20.969
  427   2HB   PRO  54          2HB       PRO  54   9.319 -17.275  19.765
  428   1HG   PRO  54          1HG       PRO  54  11.318 -15.196  20.490
  429   2HG   PRO  54          2HG       PRO  54  11.560 -16.899  20.074
  430   1HD   PRO  54          1HD       PRO  54  12.009 -14.840  18.339
  431   2HD   PRO  54          2HD       PRO  54  11.570 -16.483  17.826
  432    H    ALA  55           H        ALA  55   6.865 -14.779  20.384
  433    HA   ALA  55           HA       ALA  55   7.796 -12.121  21.250
  434   1HB   ALA  55          1HB       ALA  55   6.583 -12.265  18.832
  435   2HB   ALA  55          3HB       ALA  55   6.420 -10.868  19.897
  436   3HB   ALA  55          2HB       ALA  55   5.163 -12.104  19.865
  437    H    ARG  56           H        ARG  56   6.582 -11.372  23.061
  438    HA   ARG  56           HA       ARG  56   4.535 -13.298  24.106
  439   1HB   ARG  56          1HB       ARG  56   6.609 -13.384  25.343
  440   2HB   ARG  56          2HB       ARG  56   6.675 -11.626  25.446
  441   1HG   ARG  56          1HG       ARG  56   5.311 -11.585  27.245
  442   2HG   ARG  56          2HG       ARG  56   4.166 -12.694  26.491
  443   1HD   ARG  56          1HD       ARG  56   5.298 -14.606  27.296
  444   2HD   ARG  56          2HD       ARG  56   6.794 -13.699  27.599
  445    HE   ARG  56           HE       ARG  56   5.282 -12.392  29.301
  446   1HH1  ARG  56          1HH1      ARG  56   6.306 -15.496  29.467
  447   2HH1  ARG  56          2HH1      ARG  56   5.069 -16.077  30.530
  448   1HH2  ARG  56          1HH2      ARG  56   3.114 -13.228  30.243
  449   2HH2  ARG  56          2HH2      ARG  56   3.261 -14.793  30.969
  450    HA   PRO  57           HA       PRO  57   2.639  -9.081  23.606
  451   1HB   PRO  57          1HB       PRO  57   0.389  -9.945  22.308
  452   2HB   PRO  57          2HB       PRO  57   1.891  -9.524  21.461
  453   1HG   PRO  57          1HG       PRO  57   0.806 -12.200  22.173
  454   2HG   PRO  57          2HG       PRO  57   1.672 -11.682  20.719
  455   1HD   PRO  57          1HD       PRO  57   2.834 -13.080  22.765
  456   2HD   PRO  57          2HD       PRO  57   3.727 -11.997  21.676
  457    H    ALA  58           H        ALA  58  -0.008  -8.793  24.062
  458    HA   ALA  58           HA       ALA  58  -0.354  -9.927  26.768
  459   1HB   ALA  58          3HB       ALA  58  -0.752  -7.591  26.540
  460   2HB   ALA  58          1HB       ALA  58  -1.704  -7.819  25.072
  461   3HB   ALA  58          2HB       ALA  58  -2.361  -8.307  26.635
  462    HA   PRO  59           HA       PRO  59  -3.135 -13.035  25.252
  463   1HB   PRO  59          1HB       PRO  59  -4.228 -13.783  27.645
  464   2HB   PRO  59          2HB       PRO  59  -2.593 -14.256  27.142
  465   1HG   PRO  59          1HG       PRO  59  -3.451 -12.124  29.026
  466   2HG   PRO  59          2HG       PRO  59  -2.049 -13.201  29.100
  467   1HD   PRO  59          1HD       PRO  59  -1.934 -10.583  28.298
  468   2HD   PRO  59          2HD       PRO  59  -0.769 -11.829  27.803
  469    H    ASP  60           H        ASP  60  -4.672 -11.738  24.109
  470    HA   ASP  60           HA       ASP  60  -7.044 -10.870  25.733
  471   1HB   ASP  60          1HB       ASP  60  -5.762  -9.553  23.314
  472   2HB   ASP  60          2HB       ASP  60  -7.218  -8.979  24.128
  473    H    ALA  61           H        ALA  61  -7.374 -13.336  24.872
  474    HA   ALA  61           HA       ALA  61  -7.923 -14.108  22.277
  475   1HB   ALA  61          2HB       ALA  61 -10.006 -14.662  24.347
  476   2HB   ALA  61          1HB       ALA  61  -8.346 -15.127  24.720
  477   3HB   ALA  61          3HB       ALA  61  -9.148 -15.787  23.295
  478    HA   PRO  62           HA       PRO  62 -11.112 -10.980  21.513
  479   1HB   PRO  62          1HB       PRO  62 -10.259 -10.313  19.006
  480   2HB   PRO  62          2HB       PRO  62  -9.530  -9.650  20.476
  481   1HG   PRO  62          1HG       PRO  62  -8.436 -11.571  18.574
  482   2HG   PRO  62          2HG       PRO  62  -7.610 -10.608  19.805
  483   1HD   PRO  62          1HD       PRO  62  -8.400 -13.385  19.917
  484   2HD   PRO  62          2HD       PRO  62  -7.445 -12.454  21.090
  485    H    GLU  63           H        GLU  63 -13.014 -12.109  21.134
  486    HA   GLU  63           HA       GLU  63 -13.309 -14.340  19.366
  487   1HB   GLU  63          1HB       GLU  63 -14.873 -12.705  21.159
  488   2HB   GLU  63          2HB       GLU  63 -15.790 -12.986  19.679
  489   1HG   GLU  63          1HG       GLU  63 -14.836 -15.476  20.067
  490   2HG   GLU  63          2HG       GLU  63 -14.884 -14.928  21.743
  491    H    ASP  64           H        ASP  64 -13.629 -14.402  17.169
  492    HA   ASP  64           HA       ASP  64 -14.876 -12.205  15.700
  493   1HB   ASP  64          1HB       ASP  64 -11.961 -12.423  16.069
  494   2HB   ASP  64          2HB       ASP  64 -12.449 -12.267  14.382
  495    H    THR  65           H        THR  65 -14.138 -12.723  13.159
  496    HA   THR  65           HA       THR  65 -14.940 -15.566  12.782
  497    HB   THR  65           HB       THR  65 -15.290 -14.644  10.405
  498    HG1  THR  65           HG1      THR  65 -15.056 -12.520  10.123
  499   1HG2  THR  65          1HG2      THR  65 -16.737 -13.819  12.885
  500   2HG2  THR  65          2HG2      THR  65 -17.221 -13.081  11.358
  501   3HG2  THR  65          3HG2      THR  65 -17.287 -14.833  11.551
  502    H    GLY  66           H        GLY  66 -12.412 -13.245  11.832
  503   1HA   GLY  66          2HA       GLY  66 -10.405 -15.294  11.605
  504   2HA   GLY  66          1HA       GLY  66 -10.226 -13.625  11.062
  505    H    ASP  67           H        ASP  67 -11.670 -13.176   9.005
  506    HA   ASP  67           HA       ASP  67 -11.002 -15.311   7.038
  507   1HB   ASP  67          1HB       ASP  67 -13.568 -14.858   8.136
  508   2HB   ASP  67          2HB       ASP  67 -13.617 -14.173   6.512
  509    H    SER  68           H        SER  68  -9.987 -12.558   7.655
  510    HA   SER  68           HA       SER  68 -10.963 -10.798   5.532
  511   1HB   SER  68          1HB       SER  68  -9.694 -10.482   7.919
  512   2HB   SER  68          2HB       SER  68  -8.324 -10.357   6.820
  513    HG   SER  68           HG       SER  68 -10.733  -8.851   6.782
  514    H    ASP  69           H        ASP  69  -8.150 -12.918   6.032
  515    HA   ASP  69           HA       ASP  69  -6.957 -12.169   3.442
  516   1HB   ASP  69          1HB       ASP  69  -6.293 -14.224   5.576
  517   2HB   ASP  69          2HB       ASP  69  -5.270 -13.872   4.182
  518    H    GLU  70           H        GLU  70  -6.058 -14.569   2.454
  519    HA   GLU  70           HA       GLU  70  -8.368 -16.407   2.156
  520   1HB   GLU  70          1HB       GLU  70  -7.482 -14.345   0.243
  521   2HB   GLU  70          2HB       GLU  70  -7.660 -15.949  -0.469
  522   1HG   GLU  70          1HG       GLU  70  -9.839 -15.074   1.353
  523   2HG   GLU  70          2HG       GLU  70  -9.732 -14.237  -0.196
  524    H    TRP  71           H        TRP  71  -7.467 -17.896   0.028
  525    HA   TRP  71           HA       TRP  71  -4.875 -18.975   1.056
  526   1HB   TRP  71          1HB       TRP  71  -6.973 -20.362   1.012
  527   2HB   TRP  71          2HB       TRP  71  -6.973 -20.218  -0.746
  528    HD1  TRP  71           HD1      TRP  71  -5.542 -21.866  -2.049
  529    HE1  TRP  71           HE1      TRP  71  -3.786 -23.652  -1.430
  530    HE3  TRP  71           HE3      TRP  71  -4.988 -20.854   2.916
  531    HZ2  TRP  71           HZ2      TRP  71  -2.341 -24.525   0.876
  532    HZ3  TRP  71           HZ3      TRP  71  -3.416 -22.170   4.302
  533    HH2  TRP  71           HH2      TRP  71  -2.090 -24.007   3.291
  534    H    VAL  72           H        VAL  72  -3.849 -17.114  -0.244
  535    HA   VAL  72           HA       VAL  72  -3.980 -17.066  -3.120
  536    HB   VAL  72           HB       VAL  72  -1.825 -16.174  -1.173
  537   1HG1  VAL  72          1HG1      VAL  72  -2.380 -15.528  -4.077
  538   2HG1  VAL  72          2HG1      VAL  72  -1.381 -14.498  -3.051
  539   3HG1  VAL  72          3HG1      VAL  72  -0.891 -16.161  -3.375
  540   1HG2  VAL  72          1HG2      VAL  72  -4.423 -15.336  -1.228
  541   2HG2  VAL  72          2HG2      VAL  72  -3.074 -14.305  -0.752
  542   3HG2  VAL  72          3HG2      VAL  72  -3.701 -14.233  -2.399
  543    H    PHE  73           H        PHE  73  -2.367 -19.170  -0.895
  544    HA   PHE  73           HA       PHE  73  -0.832 -20.929  -1.204
  545   1HB   PHE  73          1HB       PHE  73  -2.625 -21.760  -2.561
  546   2HB   PHE  73          2HB       PHE  73  -2.237 -20.646  -3.868
  547    HD1  PHE  73           HD1      PHE  73  -1.345 -21.743  -5.720
  548    HD2  PHE  73           HD2      PHE  73  -0.256 -23.064  -1.781
  549    HE1  PHE  73           HE1      PHE  73   0.171 -23.438  -6.708
  550    HE2  PHE  73           HE2      PHE  73   1.261 -24.759  -2.769
  551    HZ   PHE  73           HZ       PHE  73   1.474 -24.946  -5.233
  552    H    ASP  74           H        ASP  74  -0.460 -19.971  -4.576
  553    HA   ASP  74           HA       ASP  74   2.410 -19.757  -4.338
  554   1HB   ASP  74          1HB       ASP  74   2.199 -19.035  -6.712
  555   2HB   ASP  74          2HB       ASP  74   1.220 -20.462  -6.374
  556    H    LYS  75           H        LYS  75   3.057 -17.478  -5.812
  557    HA   LYS  75           HA       LYS  75   2.540 -15.335  -3.811
  558   1HB   LYS  75          1HB       LYS  75   4.849 -16.081  -4.534
  559   2HB   LYS  75          2HB       LYS  75   4.483 -15.443  -6.137
  560   1HG   LYS  75          1HG       LYS  75   4.074 -13.212  -5.151
  561   2HG   LYS  75          2HG       LYS  75   4.468 -13.851  -3.555
  562   1HD   LYS  75          1HD       LYS  75   6.717 -13.962  -4.001
  563   2HD   LYS  75          2HD       LYS  75   6.467 -14.318  -5.710
  564   1HE   LYS  75          1HE       LYS  75   5.433 -11.740  -5.429
  565   2HE   LYS  75          2HE       LYS  75   6.894 -11.731  -4.420
  566   1HZ   LYS  75          1HZ       LYS  75   6.788 -12.848  -7.170
  567   2HZ   LYS  75          2HZ       LYS  75   7.327 -11.276  -6.814
  568   3HZ   LYS  75          3HZ       LYS  75   8.168 -12.623  -6.209
  569    H    LYS  76           H        LYS  76   1.167 -13.674  -4.314
  570    HA   LYS  76           HA       LYS  76  -0.357 -13.566  -6.729
  571   1HB   LYS  76          1HB       LYS  76  -0.497 -12.490  -4.251
  572   2HB   LYS  76          2HB       LYS  76   0.105 -11.091  -5.139
  573   1HG   LYS  76          1HG       LYS  76  -1.995 -10.703  -5.850
  574   2HG   LYS  76          2HG       LYS  76  -1.921 -12.214  -6.757
  575   1HD   LYS  76          1HD       LYS  76  -3.831 -12.408  -5.338
  576   2HD   LYS  76          2HD       LYS  76  -2.575 -13.389  -4.582
  577   1HE   LYS  76          1HE       LYS  76  -2.366 -11.971  -2.784
  578   2HE   LYS  76          2HE       LYS  76  -2.677 -10.524  -3.764
  579   1HZ   LYS  76          1HZ       LYS  76  -4.995 -11.278  -4.000
  580   2HZ   LYS  76          2HZ       LYS  76  -4.677 -12.561  -2.935
  581   3HZ   LYS  76          3HZ       LYS  76  -4.583 -10.956  -2.382
  582    H    LEU  77           H        LEU  77   0.909 -13.416  -8.618
  583    HA   LEU  77           HA       LEU  77   3.084 -11.448  -8.831
  584   1HB   LEU  77          1HB       LEU  77   1.965 -13.745 -10.294
  585   2HB   LEU  77          2HB       LEU  77   2.541 -12.457 -11.351
  586    HG   LEU  77           HG       LEU  77   4.341 -14.076 -10.856
  587   1HD1  LEU  77          1HD1      LEU  77   4.561 -11.393 -10.900
  588   2HD1  LEU  77          2HD1      LEU  77   5.163 -11.694  -9.269
  589   3HD1  LEU  77          3HD1      LEU  77   5.951 -12.451 -10.654
  590   1HD2  LEU  77          1HD2      LEU  77   3.527 -14.779  -8.627
  591   2HD2  LEU  77          2HD2      LEU  77   5.210 -14.254  -8.552
  592   3HD2  LEU  77          3HD2      LEU  77   3.927 -13.186  -7.982
  593    H    LEU  78           H        LEU  78  -0.265 -11.806  -9.948
  594    HA   LEU  78           HA       LEU  78  -0.175  -9.406 -11.628
  595   1HB   LEU  78          1HB       LEU  78  -1.711 -11.692 -11.431
  596   2HB   LEU  78          2HB       LEU  78  -2.779 -10.468 -10.744
  597    HG   LEU  78           HG       LEU  78  -1.348 -10.151 -13.396
  598   1HD1  LEU  78          1HD1      LEU  78  -3.275 -11.989 -13.001
  599   2HD1  LEU  78          2HD1      LEU  78  -4.294 -10.569 -13.240
  600   3HD1  LEU  78          3HD1      LEU  78  -3.154 -11.057 -14.494
  601   1HD2  LEU  78          1HD2      LEU  78  -3.232  -8.523 -11.748
  602   2HD2  LEU  78          2HD2      LEU  78  -1.918  -7.996 -12.800
  603   3HD2  LEU  78          3HD2      LEU  78  -3.459  -8.495 -13.497
  604    H    CYS  79           H        CYS  79   0.553  -7.848  -9.964
  605    HA   CYS  79           HA       CYS  79  -1.184  -7.313  -7.656
  606   1HB   CYS  79          1HB       CYS  79   1.370  -6.293  -8.844
  607   2HB   CYS  79          2HB       CYS  79   0.523  -5.266  -7.687
  608    HG   CYS  79           HG       CYS  79   2.057  -7.794  -6.995
  609    H    GLU  80           H        GLU  80   0.014  -5.018 -10.117
  610    HA   GLU  80           HA       GLU  80  -2.280  -3.282  -9.851
  611   1HB   GLU  80          1HB       GLU  80  -1.201  -2.155 -11.804
  612   2HB   GLU  80          2HB       GLU  80  -0.050  -2.515 -10.519
  613   1HG   GLU  80          1HG       GLU  80   1.197  -3.584 -12.064
  614   2HG   GLU  80          2HG       GLU  80  -0.061  -4.819 -12.115
  615    H    THR  81           H        THR  81  -4.265  -4.134 -10.444
  616    HA   THR  81           HA       THR  81  -4.621  -5.992 -12.651
  617    HB   THR  81           HB       THR  81  -6.864  -4.344 -11.562
  618    HG1  THR  81           HG1      THR  81  -6.729  -5.668  -9.630
  619   1HG2  THR  81          1HG2      THR  81  -6.694  -6.663 -12.993
  620   2HG2  THR  81          2HG2      THR  81  -6.822  -7.289 -11.350
  621   3HG2  THR  81          3HG2      THR  81  -8.074  -6.223 -11.987
  622    H    GLU  82           H        GLU  82  -6.882  -4.949 -13.958
  623    HA   GLU  82           HA       GLU  82  -5.625  -3.063 -15.823
  624   1HB   GLU  82          1HB       GLU  82  -8.314  -4.451 -15.634
  625   2HB   GLU  82          2HB       GLU  82  -7.855  -3.415 -16.986
  626   1HG   GLU  82          1HG       GLU  82  -5.691  -4.978 -16.968
  627   2HG   GLU  82          2HG       GLU  82  -6.822  -6.113 -16.230
  628    H    GLY  83           H        GLY  83  -8.010  -2.963 -13.239
  629   1HA   GLY  83          2HA       GLY  83  -9.519  -0.722 -13.689
  630   2HA   GLY  83          1HA       GLY  83  -7.950  -0.034 -13.267
  631    H    ARG  84           H        ARG  84  -7.188  -2.047 -11.367
  632    HA   ARG  84           HA       ARG  84  -9.280  -1.732  -9.242
  633   1HB   ARG  84          1HB       ARG  84  -8.371  -4.012 -10.154
  634   2HB   ARG  84          2HB       ARG  84  -6.949  -3.640  -9.179
  635   1HG   ARG  84          1HG       ARG  84  -8.128  -3.749  -7.171
  636   2HG   ARG  84          2HG       ARG  84  -9.676  -3.411  -7.946
  637   1HD   ARG  84          1HD       ARG  84  -9.276  -5.704  -9.164
  638   2HD   ARG  84          2HD       ARG  84  -8.160  -6.009  -7.818
  639    HE   ARG  84           HE       ARG  84 -11.067  -5.826  -7.607
  640   1HH1  ARG  84          1HH1      ARG  84  -8.531  -7.087  -6.027
  641   2HH1  ARG  84          2HH1      ARG  84  -8.942  -6.526  -4.441
  642   1HH2  ARG  84          1HH2      ARG  84 -11.398  -4.349  -5.559
  643   2HH2  ARG  84          2HH2      ARG  84 -10.565  -4.975  -4.176
  644    H    VAL  85           H        VAL  85  -5.712  -2.090  -9.408
  645    HA   VAL  85           HA       VAL  85  -5.469   0.251  -7.559
  646    HB   VAL  85           HB       VAL  85  -5.388  -1.823  -6.256
  647   1HG1  VAL  85          1HG1      VAL  85  -4.049  -2.798  -8.590
  648   2HG1  VAL  85          2HG1      VAL  85  -2.954  -2.984  -7.220
  649   3HG1  VAL  85          3HG1      VAL  85  -4.562  -3.707  -7.169
  650   1HG2  VAL  85          1HG2      VAL  85  -3.686   0.151  -5.947
  651   2HG2  VAL  85          2HG2      VAL  85  -3.418  -1.359  -5.075
  652   3HG2  VAL  85          3HG2      VAL  85  -2.503  -1.013  -6.543
  653    H    ARG  86           H        ARG  86  -3.765   1.605  -8.084
  654    HA   ARG  86           HA       ARG  86  -1.866   0.668 -10.213
  655   1HB   ARG  86          1HB       ARG  86  -3.847   2.706 -10.238
  656   2HB   ARG  86          2HB       ARG  86  -2.286   3.525 -10.194
  657   1HG   ARG  86          1HG       ARG  86  -1.706   1.656 -12.031
  658   2HG   ARG  86          2HG       ARG  86  -3.445   1.769 -12.304
  659   1HD   ARG  86          1HD       ARG  86  -3.097   4.326 -12.383
  660   2HD   ARG  86          2HD       ARG  86  -1.370   3.955 -12.555
  661    HE   ARG  86           HE       ARG  86  -3.407   3.498 -14.584
  662   1HH1  ARG  86          1HH1      ARG  86  -0.178   3.753 -14.272
  663   2HH1  ARG  86          2HH1      ARG  86   0.253   2.391 -15.251
  664   1HH2  ARG  86          1HH2      ARG  86  -2.977   1.140 -15.403
  665   2HH2  ARG  86          2HH2      ARG  86  -1.331   0.912 -15.891
  666    H    VAL  87           H        VAL  87   0.032   0.385  -9.055
  667    HA   VAL  87           HA       VAL  87   0.895   2.634  -7.262
  668    HB   VAL  87           HB       VAL  87   1.459  -0.348  -7.109
  669   1HG1  VAL  87          1HG1      VAL  87   2.433   2.039  -5.569
  670   2HG1  VAL  87          2HG1      VAL  87   2.221   0.502  -4.730
  671   3HG1  VAL  87          3HG1      VAL  87   3.326   0.613  -6.099
  672   1HG2  VAL  87          1HG2      VAL  87  -0.315   1.484  -5.462
  673   2HG2  VAL  87          2HG2      VAL  87  -0.848   0.161  -6.500
  674   3HG2  VAL  87          3HG2      VAL  87   0.066  -0.184  -5.031
  675    H    GLU  88           H        GLU  88   2.530   3.736  -8.270
  676    HA   GLU  88           HA       GLU  88   4.636   2.149  -9.692
  677   1HB   GLU  88          1HB       GLU  88   2.694   3.582 -10.950
  678   2HB   GLU  88          2HB       GLU  88   3.921   4.832 -10.744
  679   1HG   GLU  88          1HG       GLU  88   5.569   3.520 -11.905
  680   2HG   GLU  88          2HG       GLU  88   4.519   2.102 -11.910
  681    H    THR  89           H        THR  89   6.743   3.145  -9.624
  682    HA   THR  89           HA       THR  89   7.094   5.035  -7.355
  683    HB   THR  89           HB       THR  89   9.126   3.507  -9.011
  684    HG1  THR  89           HG1      THR  89   8.956   1.943  -7.406
  685   1HG2  THR  89          1HG2      THR  89   9.187   5.136  -6.510
  686   2HG2  THR  89          2HG2      THR  89  10.227   3.712  -6.590
  687   3HG2  THR  89          3HG2      THR  89  10.394   4.996  -7.790
  688    H    THR  90           H        THR  90   7.408   7.181  -7.790
  689    HA   THR  90           HA       THR  90   7.606   8.224 -10.465
  690    HB   THR  90           HB       THR  90   8.483  10.167  -8.618
  691    HG1  THR  90           HG1      THR  90   6.335   8.772  -7.463
  692   1HG2  THR  90          1HG2      THR  90   6.626  10.047 -10.491
  693   2HG2  THR  90          2HG2      THR  90   5.573   9.680  -9.125
  694   3HG2  THR  90          3HG2      THR  90   6.477  11.194  -9.160
  695    H    LYS  91           H        LYS  91   9.512   9.999 -10.736
  696    HA   LYS  91           HA       LYS  91  11.896   8.581 -11.321
  697   1HB   LYS  91          1HB       LYS  91  10.810  11.238 -11.497
  698   2HB   LYS  91          2HB       LYS  91  12.477  11.341 -10.935
  699   1HG   LYS  91          1HG       LYS  91  11.622   9.701 -13.334
  700   2HG   LYS  91          2HG       LYS  91  12.230  11.353 -13.448
  701   1HD   LYS  91          1HD       LYS  91  13.807   9.272 -11.955
  702   2HD   LYS  91          2HD       LYS  91  13.912   9.366 -13.713
  703   1HE   LYS  91          1HE       LYS  91  14.145  11.974 -12.326
  704   2HE   LYS  91          2HE       LYS  91  15.486  10.845 -12.046
  705   1HZ   LYS  91          1HZ       LYS  91  14.347  11.398 -14.730
  706   2HZ   LYS  91          2HZ       LYS  91  15.703  12.213 -14.112
  707   3HZ   LYS  91          3HZ       LYS  91  15.767  10.538 -14.368
  708    H    ASP  92           H        ASP  92  11.110  10.601  -8.463
  709    HA   ASP  92           HA       ASP  92  13.488   9.381  -7.107
  710   1HB   ASP  92          1HB       ASP  92  13.501  11.880  -8.148
  711   2HB   ASP  92          2HB       ASP  92  12.837  12.227  -6.551
  712    H    ARG  93           H        ARG  93  10.710   8.646  -6.780
  713    HA   ARG  93           HA       ARG  93  10.469   8.718  -3.927
  714   1HB   ARG  93          1HB       ARG  93   8.474  10.253  -3.827
  715   2HB   ARG  93          2HB       ARG  93   9.968  11.075  -4.268
  716   1HG   ARG  93          1HG       ARG  93   9.024  10.316  -6.728
  717   2HG   ARG  93          2HG       ARG  93   7.523  10.632  -5.859
  718   1HD   ARG  93          1HD       ARG  93   7.882  12.877  -5.862
  719   2HD   ARG  93          2HD       ARG  93   9.576  12.683  -5.374
  720    HE   ARG  93           HE       ARG  93   9.517  11.754  -7.993
  721   1HH1  ARG  93          1HH1      ARG  93  10.064  14.589  -6.373
  722   2HH1  ARG  93          2HH1      ARG  93   9.730  15.646  -7.704
  723   1HH2  ARG  93          1HH2      ARG  93   8.449  13.133  -9.721
  724   2HH2  ARG  93          2HH2      ARG  93   8.816  14.822  -9.600
  725    H    SER  94           H        SER  94   8.269   7.820  -3.252
  726    HA   SER  94           HA       SER  94   7.285   5.955  -5.371
  727   1HB   SER  94          1HB       SER  94   6.759   4.510  -3.502
  728   2HB   SER  94          2HB       SER  94   8.380   5.146  -3.241
  729    HG   SER  94           HG       SER  94   7.184   5.365  -1.358
  730    H    ILE  95           H        ILE  95   5.063   5.857  -5.818
  731    HA   ILE  95           HA       ILE  95   3.304   7.777  -4.330
  732    HB   ILE  95           HB       ILE  95   4.204   7.792  -7.049
  733   1HG1  ILE  95          1HG1      ILE  95   2.616   9.809  -7.106
  734   2HG1  ILE  95          2HG1      ILE  95   2.226   9.405  -5.436
  735   1HG2  ILE  95          1HG2      ILE  95   1.230   7.266  -6.746
  736   2HG2  ILE  95          2HG2      ILE  95   1.985   7.902  -8.207
  737   3HG2  ILE  95          3HG2      ILE  95   2.387   6.281  -7.643
  738   1HD1  ILE  95          1HD1      ILE  95   4.800   9.386  -5.069
  739   2HD1  ILE  95          2HD1      ILE  95   4.868  10.281  -6.588
  740   3HD1  ILE  95          3HD1      ILE  95   3.991  10.947  -5.210
  741    H    PHE  96           H        PHE  96   1.513   6.773  -3.494
  742    HA   PHE  96           HA       PHE  96   0.736   4.117  -4.654
  743   1HB   PHE  96          1HB       PHE  96   1.614   4.175  -2.306
  744   2HB   PHE  96          2HB       PHE  96   0.294   5.254  -1.872
  745    HD1  PHE  96           HD1      PHE  96   0.110   3.164  -0.190
  746    HD2  PHE  96           HD2      PHE  96  -0.935   3.081  -4.361
  747    HE1  PHE  96           HE1      PHE  96  -1.358   1.204   0.209
  748    HE2  PHE  96           HE2      PHE  96  -2.400   1.129  -3.956
  749    HZ   PHE  96           HZ       PHE  96  -2.615   0.190  -1.674
  750    H    THR  97           H        THR  97  -0.774   4.904  -6.175
  751    HA   THR  97           HA       THR  97  -3.117   6.379  -5.024
  752    HB   THR  97           HB       THR  97  -2.006   7.830  -6.548
  753    HG1  THR  97           HG1      THR  97  -4.187   7.705  -7.028
  754   1HG2  THR  97          1HG2      THR  97  -1.706   5.391  -8.317
  755   2HG2  THR  97          2HG2      THR  97  -1.365   7.033  -8.862
  756   3HG2  THR  97          3HG2      THR  97  -0.422   6.325  -7.550
  757    H    VAL  98           H        VAL  98  -4.627   4.776  -4.698
  758    HA   VAL  98           HA       VAL  98  -5.121   2.870  -6.967
  759    HB   VAL  98           HB       VAL  98  -4.195   1.802  -4.965
  760   1HG1  VAL  98          1HG1      VAL  98  -6.531   3.117  -3.546
  761   2HG1  VAL  98          2HG1      VAL  98  -5.484   1.894  -2.826
  762   3HG1  VAL  98          3HG1      VAL  98  -4.820   3.459  -3.291
  763   1HG2  VAL  98          1HG2      VAL  98  -6.611   1.108  -6.215
  764   2HG2  VAL  98          2HG2      VAL  98  -5.591   0.048  -5.245
  765   3HG2  VAL  98          3HG2      VAL  98  -6.927   0.915  -4.491
  766    H    GLU  99           H        GLU  99  -7.234   2.712  -7.697
  767    HA   GLU  99           HA       GLU  99  -9.223   4.553  -6.436
  768   1HB   GLU  99          1HB       GLU  99 -10.281   4.448  -8.693
  769   2HB   GLU  99          2HB       GLU  99  -8.608   4.997  -8.772
  770   1HG   GLU  99          1HG       GLU  99  -8.891   2.073  -8.938
  771   2HG   GLU  99          2HG       GLU  99  -9.664   2.934 -10.269
  772    H    GLY 100           H        GLY 100  -8.808   2.063  -5.203
  773   1HA   GLY 100          2HA       GLY 100 -10.401  -0.094  -6.050
  774   2HA   GLY 100          1HA       GLY 100 -11.475   0.995  -5.171
  775    H    ALA 101           H        ALA 101  -9.211   1.882  -3.406
  776    HA   ALA 101           HA       ALA 101  -8.182  -0.428  -2.001
  777   1HB   ALA 101          1HB       ALA 101  -8.281   2.524  -1.725
  778   2HB   ALA 101          3HB       ALA 101  -6.911   1.426  -1.563
  779   3HB   ALA 101          2HB       ALA 101  -8.044   1.623  -0.227
  780    H    GLU 102           H        GLU 102 -10.193  -1.655  -1.690
  781    HA   GLU 102           HA       GLU 102 -12.298  -0.522   0.035
  782   1HB   GLU 102          1HB       GLU 102 -11.792  -3.099  -1.448
  783   2HB   GLU 102          2HB       GLU 102 -13.130  -2.967  -0.306
  784   1HG   GLU 102          1HG       GLU 102 -14.041  -1.063  -1.540
  785   2HG   GLU 102          2HG       GLU 102 -12.668  -1.096  -2.647
  786    H    LYS 103           H        LYS 103 -13.053  -2.446   1.716
  787    HA   LYS 103           HA       LYS 103 -11.355  -2.336   3.950
  788   1HB   LYS 103          1HB       LYS 103 -13.843  -3.270   3.363
  789   2HB   LYS 103          2HB       LYS 103 -12.981  -4.793   3.589
  790   1HG   LYS 103          1HG       LYS 103 -12.744  -4.467   5.825
  791   2HG   LYS 103          2HG       LYS 103 -12.369  -2.755   5.628
  792   1HD   LYS 103          1HD       LYS 103 -15.155  -3.454   4.967
  793   2HD   LYS 103          2HD       LYS 103 -14.726  -3.726   6.656
  794   1HE   LYS 103          1HE       LYS 103 -14.102  -1.443   6.976
  795   2HE   LYS 103          2HE       LYS 103 -14.085  -1.128   5.229
  796   1HZ   LYS 103          1HZ       LYS 103 -16.496  -2.064   6.684
  797   2HZ   LYS 103          2HZ       LYS 103 -16.167  -0.419   6.414
  798   3HZ   LYS 103          3HZ       LYS 103 -16.409  -1.461   5.098
  799    H    GLU 104           H        GLU 104 -11.292  -4.566   1.226
  800    HA   GLU 104           HA       GLU 104  -9.622  -6.602   2.367
  801   1HB   GLU 104          1HB       GLU 104  -9.934  -5.585  -0.480
  802   2HB   GLU 104          2HB       GLU 104  -9.219  -7.134  -0.033
  803   1HG   GLU 104          1HG       GLU 104 -11.438  -7.582   1.215
  804   2HG   GLU 104          2HG       GLU 104 -12.083  -6.238   0.272
  805    H    ASP 105           H        ASP 105  -8.944  -3.434   0.998
  806    HA   ASP 105           HA       ASP 105  -6.032  -3.908   0.886
  807   1HB   ASP 105          1HB       ASP 105  -8.004  -2.099  -0.198
  808   2HB   ASP 105          2HB       ASP 105  -6.723  -1.166   0.576
  809    H    GLU 106           H        GLU 106  -8.405  -2.279   2.945
  810    HA   GLU 106           HA       GLU 106  -6.805  -0.622   4.538
  811   1HB   GLU 106          1HB       GLU 106  -9.382  -1.440   4.495
  812   2HB   GLU 106          2HB       GLU 106  -8.812  -2.348   5.895
  813   1HG   GLU 106          1HG       GLU 106  -8.075   0.544   5.692
  814   2HG   GLU 106          2HG       GLU 106  -9.723   0.130   6.166
  815    H    GLY 107           H        GLY 107  -5.932  -1.050   6.750
  816   1HA   GLY 107          2HA       GLY 107  -4.709  -3.771   6.915
  817   2HA   GLY 107          1HA       GLY 107  -5.364  -2.978   8.349
  818    H    VAL 108           H        VAL 108  -2.530  -3.640   6.889
  819    HA   VAL 108           HA       VAL 108  -1.243  -1.016   7.492
  820    HB   VAL 108           HB       VAL 108  -0.647  -3.720   8.732
  821   1HG1  VAL 108          1HG1      VAL 108   0.964  -1.156   8.715
  822   2HG1  VAL 108          2HG1      VAL 108   1.179  -2.406   9.941
  823   3HG1  VAL 108          3HG1      VAL 108   1.497  -2.770   8.245
  824   1HG2  VAL 108          1HG2      VAL 108  -1.558  -1.030   9.775
  825   2HG2  VAL 108          2HG2      VAL 108  -2.384  -2.583   9.915
  826   3HG2  VAL 108          3HG2      VAL 108  -0.908  -2.283  10.834
  827    H    TYR 109           H        TYR 109   0.866  -0.813   6.494
  828    HA   TYR 109           HA       TYR 109   1.597  -2.968   4.551
  829   1HB   TYR 109          1HB       TYR 109   1.033  -0.039   4.061
  830   2HB   TYR 109          2HB       TYR 109   1.996  -0.995   2.936
  831    HD1  TYR 109           HD1      TYR 109  -1.332  -0.765   4.584
  832    HD2  TYR 109           HD2      TYR 109   0.989  -2.547   1.441
  833    HE1  TYR 109           HE1      TYR 109  -3.402  -1.688   3.579
  834    HE2  TYR 109           HE2      TYR 109  -1.081  -3.471   0.435
  835    HH   TYR 109           HH       TYR 109  -3.509  -2.964   0.441
  836    H    THR 110           H        THR 110   3.838  -2.782   3.803
  837    HA   THR 110           HA       THR 110   5.583  -1.019   5.476
  838    HB   THR 110           HB       THR 110   6.205  -3.906   4.823
  839    HG1  THR 110           HG1      THR 110   5.389  -4.378   6.892
  840   1HG2  THR 110          1HG2      THR 110   7.251  -1.807   6.709
  841   2HG2  THR 110          2HG2      THR 110   7.521  -3.520   7.030
  842   3HG2  THR 110          3HG2      THR 110   8.143  -2.792   5.549
  843    H    VAL 111           H        VAL 111   6.221   0.319   3.767
  844    HA   VAL 111           HA       VAL 111   6.901  -0.809   1.145
  845    HB   VAL 111           HB       VAL 111   5.735   1.401   1.687
  846   1HG1  VAL 111          1HG1      VAL 111   7.302   2.109   3.463
  847   2HG1  VAL 111          2HG1      VAL 111   8.580   2.255   2.255
  848   3HG1  VAL 111          3HG1      VAL 111   7.170   3.313   2.181
  849   1HG2  VAL 111          1HG2      VAL 111   8.145   1.235  -0.121
  850   2HG2  VAL 111          2HG2      VAL 111   6.445   1.062  -0.556
  851   3HG2  VAL 111          3HG2      VAL 111   7.083   2.643  -0.103
  852    H    THR 112           H        THR 112   8.979  -1.191   0.390
  853    HA   THR 112           HA       THR 112  11.228  -0.598   2.286
  854    HB   THR 112           HB       THR 112  10.447  -2.996   1.965
  855    HG1  THR 112           HG1      THR 112  13.071  -2.377   1.089
  856   1HG2  THR 112          1HG2      THR 112  10.185  -2.438  -0.621
  857   2HG2  THR 112          2HG2      THR 112  11.858  -2.996  -0.667
  858   3HG2  THR 112          3HG2      THR 112  10.587  -4.065  -0.074
  859    H    VAL 113           H        VAL 113  12.807   0.708   1.454
  860    HA   VAL 113           HA       VAL 113  12.829   1.218  -1.491
  861    HB   VAL 113           HB       VAL 113  13.950   3.299  -0.862
  862   1HG1  VAL 113          1HG1      VAL 113  11.467   3.146  -0.607
  863   2HG1  VAL 113          2HG1      VAL 113  11.703   2.743   1.094
  864   3HG1  VAL 113          3HG1      VAL 113  12.203   4.320   0.484
  865   1HG2  VAL 113          1HG2      VAL 113  13.953   2.145   1.947
  866   2HG2  VAL 113          2HG2      VAL 113  15.372   2.417   0.937
  867   3HG2  VAL 113          3HG2      VAL 113  14.434   3.788   1.525
  868    H    LYS 114           H        LYS 114  14.614   0.580  -2.696
  869    HA   LYS 114           HA       LYS 114  17.070  -0.281  -1.210
  870   1HB   LYS 114          1HB       LYS 114  15.439  -2.143  -1.797
  871   2HB   LYS 114          2HB       LYS 114  15.773  -1.791  -3.492
  872   1HG   LYS 114          1HG       LYS 114  18.223  -2.130  -2.999
  873   2HG   LYS 114          2HG       LYS 114  17.762  -2.685  -1.389
  874   1HD   LYS 114          1HD       LYS 114  16.339  -3.944  -3.676
  875   2HD   LYS 114          2HD       LYS 114  18.041  -4.367  -3.482
  876   1HE   LYS 114          1HE       LYS 114  17.273  -5.907  -1.976
  877   2HE   LYS 114          2HE       LYS 114  17.087  -4.521  -0.883
  878   1HZ   LYS 114          1HZ       LYS 114  14.883  -4.134  -1.913
  879   2HZ   LYS 114          2HZ       LYS 114  15.054  -5.595  -2.764
  880   3HZ   LYS 114          3HZ       LYS 114  14.977  -5.606  -1.069
  881    H    ASN 115           H        ASN 115  18.996  -0.359  -2.586
  882    HA   ASN 115           HA       ASN 115  18.943   0.670  -5.314
  883   1HB   ASN 115          1HB       ASN 115  18.969   2.461  -3.062
  884   2HB   ASN 115          2HB       ASN 115  20.507   2.597  -3.912
  885   1HD2  ASN 115          2HD2      ASN 115  18.343   4.619  -3.883
  886   2HD2  ASN 115          1HD2      ASN 115  17.852   4.816  -5.495
  887    HA   PRO 116           HA       PRO 116  22.971  -1.061  -5.385
  888   1HB   PRO 116          1HB       PRO 116  24.567   0.777  -6.638
  889   2HB   PRO 116          2HB       PRO 116  23.342  -0.189  -7.484
  890   1HG   PRO 116          1HG       PRO 116  23.206   2.630  -6.539
  891   2HG   PRO 116          2HG       PRO 116  22.591   1.910  -8.035
  892   1HD   PRO 116          1HD       PRO 116  21.012   2.492  -5.902
  893   2HD   PRO 116          2HD       PRO 116  20.660   1.175  -7.042
  894    H    VAL 117           H        VAL 117  22.506   1.765  -3.528
  895    HA   VAL 117           HA       VAL 117  25.282   1.635  -2.428
  896    HB   VAL 117           HB       VAL 117  23.079   3.692  -2.097
  897   1HG1  VAL 117          1HG1      VAL 117  25.958   3.542  -1.183
  898   2HG1  VAL 117          2HG1      VAL 117  25.101   5.078  -1.330
  899   3HG1  VAL 117          3HG1      VAL 117  24.521   3.848  -0.205
  900   1HG2  VAL 117          1HG2      VAL 117  25.531   3.552  -3.870
  901   2HG2  VAL 117          2HG2      VAL 117  23.849   3.688  -4.382
  902   3HG2  VAL 117          3HG2      VAL 117  24.637   5.042  -3.572
  903    H    GLY 118           H        GLY 118  21.846   1.314  -1.505
  904   1HA   GLY 118          2HA       GLY 118  22.113   1.227   1.293
  905   2HA   GLY 118          1HA       GLY 118  22.535  -0.387   0.722
  906    H    GLU 119           H        GLU 119  20.187   0.529   2.300
  907    HA   GLU 119           HA       GLU 119  17.843   0.434   0.580
  908   1HB   GLU 119          1HB       GLU 119  17.193  -1.877   1.204
  909   2HB   GLU 119          2HB       GLU 119  18.726  -1.862   0.334
  910   1HG   GLU 119          1HG       GLU 119  19.653  -1.608   2.857
  911   2HG   GLU 119          2HG       GLU 119  18.171  -2.508   3.183
  912    H    ASP 120           H        ASP 120  15.914   0.726   1.831
  913    HA   ASP 120           HA       ASP 120  16.244   0.860   4.799
  914   1HB   ASP 120          1HB       ASP 120  16.291   3.036   3.028
  915   2HB   ASP 120          2HB       ASP 120  14.664   3.047   3.705
  916    H    GLN 121           H        GLN 121  13.957   1.309   5.796
  917    HA   GLN 121           HA       GLN 121  11.760   0.158   4.147
  918   1HB   GLN 121          1HB       GLN 121  13.356  -1.289   5.991
  919   2HB   GLN 121          2HB       GLN 121  11.797  -1.042   6.777
  920   1HG   GLN 121          1HG       GLN 121  10.631  -1.977   4.845
  921   2HG   GLN 121          2HG       GLN 121  12.156  -2.141   3.974
  922   1HE2  GLN 121          2HE2      GLN 121  12.375  -4.417   3.879
  923   2HE2  GLN 121          1HE2      GLN 121  12.408  -5.419   5.249
  924    H    VAL 122           H        VAL 122   9.644   0.332   5.331
  925    HA   VAL 122           HA       VAL 122   9.412   2.021   7.685
  926    HB   VAL 122           HB       VAL 122   9.872   3.910   6.427
  927   1HG1  VAL 122          1HG1      VAL 122   9.160   2.145   4.159
  928   2HG1  VAL 122          2HG1      VAL 122   8.872   3.865   3.906
  929   3HG1  VAL 122          3HG1      VAL 122  10.487   3.292   4.321
  930   1HG2  VAL 122          1HG2      VAL 122   7.475   4.061   7.146
  931   2HG2  VAL 122          2HG2      VAL 122   7.821   5.007   5.699
  932   3HG2  VAL 122          3HG2      VAL 122   6.999   3.453   5.561
  933    H    ASN 123           H        ASN 123   7.069   2.417   8.175
  934    HA   ASN 123           HA       ASN 123   5.384   0.252   6.985
  935   1HB   ASN 123          1HB       ASN 123   4.103   0.536   9.119
  936   2HB   ASN 123          2HB       ASN 123   5.795   0.123   9.381
  937   1HD2  ASN 123          2HD2      ASN 123   3.399   2.695   9.707
  938   2HD2  ASN 123          1HD2      ASN 123   4.385   3.750  10.599
  939    H    LEU 124           H        LEU 124   3.396   0.735   6.097
  940    HA   LEU 124           HA       LEU 124   2.679   3.640   5.855
  941   1HB   LEU 124          1HB       LEU 124   3.382   2.726   3.753
  942   2HB   LEU 124          2HB       LEU 124   2.457   1.251   4.005
  943    HG   LEU 124           HG       LEU 124   0.590   3.377   4.178
  944   1HD1  LEU 124          1HD1      LEU 124   2.719   4.397   2.812
  945   2HD1  LEU 124          2HD1      LEU 124   1.805   3.662   1.496
  946   3HD1  LEU 124          3HD1      LEU 124   1.047   4.876   2.524
  947   1HD2  LEU 124          1HD2      LEU 124   1.230   1.101   2.360
  948   2HD2  LEU 124          2HD2      LEU 124  -0.261   1.456   3.232
  949   3HD2  LEU 124          3HD2      LEU 124   0.117   2.324   1.744
  950    H    THR 125           H        THR 125   0.804   4.143   6.912
  951    HA   THR 125           HA       THR 125  -1.012   1.991   7.817
  952    HB   THR 125           HB       THR 125  -1.070   4.999   8.226
  953    HG1  THR 125           HG1      THR 125   0.220   4.667   9.917
  954   1HG2  THR 125          1HG2      THR 125  -2.578   2.673   9.346
  955   2HG2  THR 125          2HG2      THR 125  -2.202   4.019  10.422
  956   3HG2  THR 125          3HG2      THR 125  -3.147   4.297   8.959
  957    H    VAL 126           H        VAL 126  -2.947   1.551   6.816
  958    HA   VAL 126           HA       VAL 126  -3.890   3.465   4.711
  959    HB   VAL 126           HB       VAL 126  -3.034   1.326   3.856
  960   1HG1  VAL 126          1HG1      VAL 126  -4.623   0.299   6.119
  961   2HG1  VAL 126          2HG1      VAL 126  -4.809  -0.623   4.628
  962   3HG1  VAL 126          3HG1      VAL 126  -3.208  -0.395   5.330
  963   1HG2  VAL 126          1HG2      VAL 126  -5.189   2.462   2.955
  964   2HG2  VAL 126          2HG2      VAL 126  -4.870   0.797   2.466
  965   3HG2  VAL 126          3HG2      VAL 126  -6.044   1.134   3.739
  966    H    LYS 127           H        LYS 127  -6.287   3.552   4.445
  967    HA   LYS 127           HA       LYS 127  -7.983   2.369   6.524
  968   1HB   LYS 127          1HB       LYS 127  -6.578   4.633   7.194
  969   2HB   LYS 127          2HB       LYS 127  -8.093   5.320   6.605
  970   1HG   LYS 127          1HG       LYS 127  -8.012   3.052   8.604
  971   2HG   LYS 127          2HG       LYS 127  -8.026   4.746   9.094
  972   1HD   LYS 127          1HD       LYS 127 -10.199   5.069   8.422
  973   2HD   LYS 127          2HD       LYS 127 -10.072   3.909   7.100
  974   1HE   LYS 127          1HE       LYS 127 -11.344   2.602   8.507
  975   2HE   LYS 127          2HE       LYS 127  -9.772   2.248   9.250
  976   1HZ   LYS 127          1HZ       LYS 127 -10.083   4.244  10.647
  977   2HZ   LYS 127          2HZ       LYS 127 -11.653   4.417  10.019
  978   3HZ   LYS 127          3HZ       LYS 127 -11.251   3.050  10.944
  979    H    VAL 128           H        VAL 128  -9.766   1.883   5.313
  980    HA   VAL 128           HA       VAL 128 -10.508   3.617   3.017
  981    HB   VAL 128           HB       VAL 128 -11.566   0.944   4.004
  982   1HG1  VAL 128          1HG1      VAL 128 -12.986   2.504   2.462
  983   2HG1  VAL 128          2HG1      VAL 128 -11.823   2.048   1.218
  984   3HG1  VAL 128          3HG1      VAL 128 -12.795   0.809   2.012
  985   1HG2  VAL 128          1HG2      VAL 128  -9.446   1.697   1.978
  986   2HG2  VAL 128          2HG2      VAL 128  -9.292   0.605   3.355
  987   3HG2  VAL 128          3HG2      VAL 128 -10.252   0.130   1.955
  988    H    ILE 129           H        ILE 129 -11.979   5.208   3.400
  989    HA   ILE 129           HA       ILE 129 -13.775   5.047   5.751
  990    HB   ILE 129           HB       ILE 129 -13.091   7.182   3.703
  991   1HG1  ILE 129          1HG1      ILE 129 -11.267   6.616   5.262
  992   2HG1  ILE 129          2HG1      ILE 129 -11.907   8.220   5.613
  993   1HG2  ILE 129          1HG2      ILE 129 -15.051   7.112   5.966
  994   2HG2  ILE 129          2HG2      ILE 129 -14.205   8.618   5.614
  995   3HG2  ILE 129          3HG2      ILE 129 -15.205   7.859   4.376
  996   1HD1  ILE 129          1HD1      ILE 129 -13.411   7.104   7.344
  997   2HD1  ILE 129          2HD1      ILE 129 -12.446   5.646   7.110
  998   3HD1  ILE 129          3HD1      ILE 129 -11.689   7.115   7.727
  999    H    ASP 130           H        ASP 130 -16.112   5.518   5.408
 1000    HA   ASP 130           HA       ASP 130 -17.064   4.505   2.749
 1001   1HB   ASP 130          1HB       ASP 130 -17.401   3.135   4.869
 1002   2HB   ASP 130          2HB       ASP 130 -18.473   4.419   5.432

  No H/Q in entry =        1002
  Start of MODEL    2
    1    H1   ARG   1          1H        ARG   1  28.118   3.851  -8.596
    2    H2   ARG   1          2H        ARG   1  28.687   2.357  -8.030
    3    H3   ARG   1          3H        ARG   1  27.038   2.743  -7.894
    4    HA   ARG   1           HA       ARG   1  27.997   3.031  -5.739
    5   1HB   ARG   1          1HB       ARG   1  30.132   4.078  -7.502
    6   2HB   ARG   1          2HB       ARG   1  29.934   4.951  -5.982
    7   1HG   ARG   1          1HG       ARG   1  29.938   2.653  -4.841
    8   2HG   ARG   1          2HG       ARG   1  30.528   2.015  -6.377
    9   1HD   ARG   1          1HD       ARG   1  31.877   4.324  -4.944
   10   2HD   ARG   1          2HD       ARG   1  32.363   2.630  -4.726
   11    HE   ARG   1           HE       ARG   1  32.447   4.091  -7.335
   12   1HH1  ARG   1          1HH1      ARG   1  32.608   1.909  -8.682
   13   2HH1  ARG   1          2HH1      ARG   1  34.046   1.031  -8.279
   14   1HH2  ARG   1          1HH2      ARG   1  34.597   2.768  -5.329
   15   2HH2  ARG   1          2HH2      ARG   1  35.173   1.518  -6.381
   16    H    GLN   2           H        GLN   2  25.860   4.230  -7.238
   17    HA   GLN   2           HA       GLN   2  25.865   7.078  -7.238
   18   1HB   GLN   2          1HB       GLN   2  23.359   6.728  -7.195
   19   2HB   GLN   2          2HB       GLN   2  24.209   5.792  -8.419
   20   1HG   GLN   2          1HG       GLN   2  23.776   3.812  -7.408
   21   2HG   GLN   2          2HG       GLN   2  23.938   4.482  -5.791
   22   1HE2  GLN   2          2HE2      GLN   2  22.054   5.668  -4.896
   23   2HE2  GLN   2          1HE2      GLN   2  20.500   5.370  -5.504
   24    H    GLU   3           H        GLU   3  23.612   7.760  -5.635
   25    HA   GLU   3           HA       GLU   3  24.915   8.076  -3.032
   26   1HB   GLU   3          1HB       GLU   3  22.250   8.915  -4.211
   27   2HB   GLU   3          2HB       GLU   3  22.811   9.412  -2.614
   28   1HG   GLU   3          1HG       GLU   3  24.983  10.116  -3.980
   29   2HG   GLU   3          2HG       GLU   3  23.831  10.203  -5.313
   30    HA   PRO   4           HA       PRO   4  23.018   4.697  -0.940
   31   1HB   PRO   4          1HB       PRO   4  22.804   5.757   1.579
   32   2HB   PRO   4          2HB       PRO   4  24.339   5.196   0.883
   33   1HG   PRO   4          1HG       PRO   4  23.245   7.970   1.056
   34   2HG   PRO   4          2HG       PRO   4  24.889   7.387   1.372
   35   1HD   PRO   4          1HD       PRO   4  24.246   8.595  -0.938
   36   2HD   PRO   4          2HD       PRO   4  25.422   7.262  -0.877
   37    HA   PRO   5           HA       PRO   5  18.710   5.808  -1.241
   38   1HB   PRO   5          1HB       PRO   5  17.715   3.340  -0.601
   39   2HB   PRO   5          2HB       PRO   5  18.407   3.710  -2.192
   40   1HG   PRO   5          1HG       PRO   5  19.653   2.355   0.151
   41   2HG   PRO   5          2HG       PRO   5  19.733   1.919  -1.561
   42   1HD   PRO   5          1HD       PRO   5  21.742   3.200  -0.310
   43   2HD   PRO   5          2HD       PRO   5  21.350   3.495  -2.020
   44    H    LYS   6           H        LYS   6  17.207   6.500   0.329
   45    HA   LYS   6           HA       LYS   6  17.024   5.296   2.958
   46   1HB   LYS   6          1HB       LYS   6  18.000   7.250   4.175
   47   2HB   LYS   6          2HB       LYS   6  19.189   6.406   3.181
   48   1HG   LYS   6          1HG       LYS   6  18.871   8.075   1.386
   49   2HG   LYS   6          2HG       LYS   6  17.697   8.925   2.391
   50   1HD   LYS   6          1HD       LYS   6  19.492   9.177   4.143
   51   2HD   LYS   6          2HD       LYS   6  20.640   8.515   2.979
   52   1HE   LYS   6          1HE       LYS   6  20.498  10.387   1.572
   53   2HE   LYS   6          2HE       LYS   6  18.910  10.862   2.209
   54   1HZ   LYS   6          1HZ       LYS   6  21.387  10.796   3.844
   55   2HZ   LYS   6          2HZ       LYS   6  20.797  12.204   3.097
   56   3HZ   LYS   6          3HZ       LYS   6  19.878  11.424   4.295
   57    H    ILE   7           H        ILE   7  15.274   6.141   4.150
   58    HA   ILE   7           HA       ILE   7  13.195   7.478   2.674
   59    HB   ILE   7           HB       ILE   7  13.515   7.059   5.662
   60   1HG1  ILE   7          1HG1      ILE   7  13.870   4.901   4.741
   61   2HG1  ILE   7          2HG1      ILE   7  12.155   4.928   5.132
   62   1HG2  ILE   7          1HG2      ILE   7  11.561   8.425   4.392
   63   2HG2  ILE   7          2HG2      ILE   7  10.900   6.794   4.290
   64   3HG2  ILE   7          3HG2      ILE   7  11.284   7.492   5.863
   65   1HD1  ILE   7          1HD1      ILE   7  11.633   5.497   2.777
   66   2HD1  ILE   7          2HD1      ILE   7  13.351   5.444   2.389
   67   3HD1  ILE   7          3HD1      ILE   7  12.515   3.974   2.890
   68    H    HIS   8           H        HIS   8  14.982   9.326   2.212
   69    HA   HIS   8           HA       HIS   8  14.570  11.478   4.260
   70   1HB   HIS   8          1HB       HIS   8  16.853  10.714   4.304
   71   2HB   HIS   8          2HB       HIS   8  16.948  10.714   2.545
   72    HD1  HIS   8           HD1      HIS   8  17.608  12.811   5.456
   73    HD2  HIS   8           HD2      HIS   8  16.739  13.468   1.433
   74    HE1  HIS   8           HE1      HIS   8  18.288  15.200   4.960
   75    H    LEU   9           H        LEU   9  14.557  13.685   3.303
   76    HA   LEU   9           HA       LEU   9  13.734  13.691   0.424
   77   1HB   LEU   9          1HB       LEU   9  12.399  15.827   1.557
   78   2HB   LEU   9          2HB       LEU   9  11.700  14.248   1.257
   79    HG   LEU   9           HG       LEU   9  12.484  13.566   3.574
   80   1HD1  LEU   9          1HD1      LEU   9  14.169  15.443   3.727
   81   2HD1  LEU   9          2HD1      LEU   9  12.816  16.556   3.925
   82   3HD1  LEU   9          3HD1      LEU   9  13.110  15.303   5.124
   83   1HD2  LEU   9          1HD2      LEU   9  10.148  14.241   3.055
   84   2HD2  LEU   9          2HD2      LEU   9  10.622  14.705   4.688
   85   3HD2  LEU   9          3HD2      LEU   9  10.574  15.916   3.407
   86    H    ASP  10           H        ASP  10  13.824  16.682   2.244
   87    HA   ASP  10           HA       ASP  10  16.247  17.462   0.681
   88   1HB   ASP  10          1HB       ASP  10  13.951  18.555   0.378
   89   2HB   ASP  10          2HB       ASP  10  14.184  19.249   1.983
   90    H    CYS  11           H        CYS  11  15.007  17.101   3.942
   91    HA   CYS  11           HA       CYS  11  17.662  17.887   4.975
   92   1HB   CYS  11          1HB       CYS  11  16.718  20.023   4.967
   93   2HB   CYS  11          2HB       CYS  11  15.112  19.433   5.370
   94    HG   CYS  11           HG       CYS  11  16.812  20.533   7.403
   95    HA   PRO  12           HA       PRO  12  15.410  15.978   8.688
   96   1HB   PRO  12          1HB       PRO  12  12.720  15.453   8.543
   97   2HB   PRO  12          2HB       PRO  12  13.385  16.986   9.140
   98   1HG   PRO  12          1HG       PRO  12  12.252  16.331   6.465
   99   2HG   PRO  12          2HG       PRO  12  12.074  17.798   7.438
  100   1HD   PRO  12          1HD       PRO  12  13.766  17.630   5.322
  101   2HD   PRO  12          2HD       PRO  12  14.066  18.678   6.726
  102    H    GLY  13           H        GLY  13  12.838  14.530   6.749
  103   1HA   GLY  13          2HA       GLY  13  14.548  12.096   6.447
  104   2HA   GLY  13          1HA       GLY  13  13.392  12.602   5.215
  105    H    ARG  14           H        ARG  14  11.169  13.215   6.641
  106    HA   ARG  14           HA       ARG  14  10.523  10.690   8.131
  107   1HB   ARG  14          1HB       ARG  14  10.202  13.518   8.701
  108   2HB   ARG  14          2HB       ARG  14   8.632  12.717   8.695
  109   1HG   ARG  14          1HG       ARG  14   9.347  12.411  10.908
  110   2HG   ARG  14          2HG       ARG  14   9.826  10.898  10.139
  111   1HD   ARG  14          1HD       ARG  14  12.103  12.016   9.702
  112   2HD   ARG  14          2HD       ARG  14  11.580  13.259  10.857
  113    HE   ARG  14           HE       ARG  14  11.415  10.387  11.647
  114   1HH1  ARG  14          1HH1      ARG  14  13.793  10.282  12.587
  115   2HH1  ARG  14          2HH1      ARG  14  14.013  11.419  13.875
  116   1HH2  ARG  14          1HH2      ARG  14  11.204  13.284  13.065
  117   2HH2  ARG  14          2HH2      ARG  14  12.547  13.117  14.146
  118    H    ILE  15           H        ILE  15   9.785   9.555   6.254
  119    HA   ILE  15           HA       ILE  15   7.885  10.756   4.384
  120    HB   ILE  15           HB       ILE  15   9.181   8.083   4.873
  121   1HG1  ILE  15          1HG1      ILE  15   9.045   9.967   2.499
  122   2HG1  ILE  15          2HG1      ILE  15  10.385   9.849   3.638
  123   1HG2  ILE  15          1HG2      ILE  15   6.909   8.636   2.941
  124   2HG2  ILE  15          2HG2      ILE  15   7.948   7.212   2.871
  125   3HG2  ILE  15          3HG2      ILE  15   6.905   7.476   4.268
  126   1HD1  ILE  15          1HD1      ILE  15   9.809   7.212   2.692
  127   2HD1  ILE  15          2HD1      ILE  15   9.921   8.278   1.293
  128   3HD1  ILE  15          3HD1      ILE  15  11.266   8.168   2.427
  129    HA   PRO  16           HA       PRO  16   4.543   9.627   7.192
  130   1HB   PRO  16          1HB       PRO  16   2.653  11.226   6.039
  131   2HB   PRO  16          2HB       PRO  16   3.875  11.845   7.164
  132   1HG   PRO  16          1HG       PRO  16   3.724  12.087   4.225
  133   2HG   PRO  16          2HG       PRO  16   4.425  13.188   5.417
  134   1HD   PRO  16          1HD       PRO  16   5.839  11.418   3.784
  135   2HD   PRO  16          2HD       PRO  16   6.469  12.244   5.221
  136    H    ASP  17           H        ASP  17   5.052   7.618   5.536
  137    HA   ASP  17           HA       ASP  17   3.408   7.168   3.264
  138   1HB   ASP  17          1HB       ASP  17   4.806   5.473   5.324
  139   2HB   ASP  17          2HB       ASP  17   3.826   4.698   4.081
  140    H    THR  18           H        THR  18   1.322   8.135   4.057
  141    HA   THR  18           HA       THR  18  -0.360   6.047   5.373
  142    HB   THR  18           HB       THR  18  -0.758   8.937   6.067
  143    HG1  THR  18           HG1      THR  18   1.155   7.258   7.315
  144   1HG2  THR  18          1HG2      THR  18  -2.023   6.657   6.788
  145   2HG2  THR  18          2HG2      THR  18  -0.806   6.742   8.062
  146   3HG2  THR  18          3HG2      THR  18  -1.934   8.077   7.829
  147    H    ILE  19           H        ILE  19  -2.346   5.847   4.317
  148    HA   ILE  19           HA       ILE  19  -3.241   8.096   2.585
  149    HB   ILE  19           HB       ILE  19  -1.750   6.405   1.396
  150   1HG1  ILE  19          1HG1      ILE  19  -3.260   6.285  -0.572
  151   2HG1  ILE  19          2HG1      ILE  19  -4.612   6.748   0.463
  152   1HG2  ILE  19          1HG2      ILE  19  -3.155   4.520   2.719
  153   2HG2  ILE  19          2HG2      ILE  19  -4.087   4.570   1.222
  154   3HG2  ILE  19          3HG2      ILE  19  -2.362   4.204   1.176
  155   1HD1  ILE  19          1HD1      ILE  19  -2.313   8.539   0.739
  156   2HD1  ILE  19          2HD1      ILE  19  -2.962   8.508  -0.898
  157   3HD1  ILE  19          3HD1      ILE  19  -4.008   8.928   0.455
  158    H    VAL  20           H        VAL  20  -5.498   8.143   2.237
  159    HA   VAL  20           HA       VAL  20  -7.124   6.024   3.587
  160    HB   VAL  20           HB       VAL  20  -7.340   9.049   3.771
  161   1HG1  VAL  20          1HG1      VAL  20  -9.095   6.886   4.970
  162   2HG1  VAL  20          2HG1      VAL  20  -9.231   8.613   5.298
  163   3HG1  VAL  20          3HG1      VAL  20  -9.564   7.995   3.681
  164   1HG2  VAL  20          1HG2      VAL  20  -6.555   6.860   5.706
  165   2HG2  VAL  20          2HG2      VAL  20  -5.622   8.282   5.240
  166   3HG2  VAL  20          3HG2      VAL  20  -7.055   8.460   6.254
  167    H    VAL  21           H        VAL  21  -9.272   5.799   2.664
  168    HA   VAL  21           HA       VAL  21  -9.918   7.367   0.227
  169    HB   VAL  21           HB       VAL  21  -8.461   5.565  -0.549
  170   1HG1  VAL  21          1HG1      VAL  21  -9.819   4.106   1.523
  171   2HG1  VAL  21          2HG1      VAL  21 -10.007   3.246  -0.003
  172   3HG1  VAL  21          3HG1      VAL  21  -8.397   3.633   0.598
  173   1HG2  VAL  21          1HG2      VAL  21 -10.713   6.179  -1.730
  174   2HG2  VAL  21          2HG2      VAL  21  -9.852   4.728  -2.247
  175   3HG2  VAL  21          3HG2      VAL  21 -11.242   4.591  -1.171
  176    H    VAL  22           H        VAL  22 -12.174   6.956  -0.467
  177    HA   VAL  22           HA       VAL  22 -13.893   6.222   1.839
  178    HB   VAL  22           HB       VAL  22 -14.473   7.464  -0.872
  179   1HG1  VAL  22          1HG1      VAL  22 -16.158   6.732   1.480
  180   2HG1  VAL  22          2HG1      VAL  22 -16.501   8.270   0.688
  181   3HG1  VAL  22          3HG1      VAL  22 -16.575   6.768  -0.233
  182   1HG2  VAL  22          1HG2      VAL  22 -13.647   8.538   1.792
  183   2HG2  VAL  22          2HG2      VAL  22 -13.254   9.124   0.175
  184   3HG2  VAL  22          3HG2      VAL  22 -14.839   9.460   0.876
  185    H    ALA  23           H        ALA  23 -12.923   3.892   1.120
  186    HA   ALA  23           HA       ALA  23 -13.318   1.777   0.116
  187   1HB   ALA  23          1HB       ALA  23 -15.998   2.949   0.871
  188   2HB   ALA  23          3HB       ALA  23 -14.983   1.862   1.820
  189   3HB   ALA  23          2HB       ALA  23 -15.808   1.265   0.380
  190    H    GLY  24           H        GLY  24 -12.677   1.987  -2.086
  191   1HA   GLY  24          2HA       GLY  24 -14.867   1.840  -4.008
  192   2HA   GLY  24          1HA       GLY  24 -13.152   1.681  -4.380
  193    H    ASN  25           H        ASN  25 -12.026   4.010  -3.707
  194    HA   ASN  25           HA       ASN  25 -13.478   5.992  -5.411
  195   1HB   ASN  25          1HB       ASN  25 -12.689   6.135  -2.555
  196   2HB   ASN  25          2HB       ASN  25 -12.343   7.575  -3.512
  197   1HD2  ASN  25          2HD2      ASN  25 -15.043   5.280  -2.838
  198   2HD2  ASN  25          1HD2      ASN  25 -16.267   6.443  -3.004
  199    H    LYS  26           H        LYS  26 -11.993   7.653  -6.282
  200    HA   LYS  26           HA       LYS  26  -9.468   6.564  -7.169
  201   1HB   LYS  26          1HB       LYS  26 -10.602   9.383  -7.190
  202   2HB   LYS  26          2HB       LYS  26  -9.241   8.830  -8.166
  203   1HG   LYS  26          1HG       LYS  26 -10.662   8.066  -9.733
  204   2HG   LYS  26          2HG       LYS  26 -11.400   6.992  -8.545
  205   1HD   LYS  26          1HD       LYS  26 -13.151   8.409  -9.390
  206   2HD   LYS  26          2HD       LYS  26 -12.778   8.970  -7.759
  207   1HE   LYS  26          1HE       LYS  26 -12.619  11.024  -8.771
  208   2HE   LYS  26          2HE       LYS  26 -11.013  10.452  -9.265
  209   1HZ   LYS  26          1HZ       LYS  26 -13.502   9.908 -10.789
  210   2HZ   LYS  26          2HZ       LYS  26 -12.443  11.182 -11.150
  211   3HZ   LYS  26          3HZ       LYS  26 -11.909   9.574 -11.274
  212    H    LEU  27           H        LEU  27  -7.897   6.241  -5.584
  213    HA   LEU  27           HA       LEU  27  -7.396   8.493  -3.677
  214   1HB   LEU  27          1HB       LEU  27  -7.985   6.554  -2.479
  215   2HB   LEU  27          2HB       LEU  27  -7.122   5.494  -3.588
  216    HG   LEU  27           HG       LEU  27  -4.978   6.284  -2.753
  217   1HD1  LEU  27          1HD1      LEU  27  -6.491   8.541  -1.945
  218   2HD1  LEU  27          2HD1      LEU  27  -5.852   7.817  -0.473
  219   3HD1  LEU  27          3HD1      LEU  27  -4.755   8.292  -1.768
  220   1HD2  LEU  27          1HD2      LEU  27  -6.593   4.619  -1.430
  221   2HD2  LEU  27          2HD2      LEU  27  -5.030   5.100  -0.768
  222   3HD2  LEU  27          3HD2      LEU  27  -6.505   5.892  -0.212
  223    H    ARG  28           H        ARG  28  -5.316   9.338  -3.523
  224    HA   ARG  28           HA       ARG  28  -3.184   8.143  -5.248
  225   1HB   ARG  28          1HB       ARG  28  -4.285  10.954  -5.139
  226   2HB   ARG  28          2HB       ARG  28  -2.659  10.639  -5.747
  227   1HG   ARG  28          1HG       ARG  28  -4.348   8.732  -6.985
  228   2HG   ARG  28          2HG       ARG  28  -5.188  10.280  -7.091
  229   1HD   ARG  28          1HD       ARG  28  -2.264  10.281  -7.718
  230   2HD   ARG  28          2HD       ARG  28  -3.362   9.573  -8.920
  231    HE   ARG  28           HE       ARG  28  -4.676  11.740  -8.755
  232   1HH1  ARG  28          1HH1      ARG  28  -2.875  12.864 -10.402
  233   2HH1  ARG  28          2HH1      ARG  28  -1.907  13.968  -9.482
  234   1HH2  ARG  28          1HH2      ARG  28  -2.784  12.601  -6.419
  235   2HH2  ARG  28          2HH2      ARG  28  -1.856  13.820  -7.228
  236    H    LEU  29           H        LEU  29  -1.112   8.255  -4.307
  237    HA   LEU  29           HA       LEU  29  -0.861   9.794  -1.743
  238   1HB   LEU  29          1HB       LEU  29  -1.395   7.441  -1.281
  239   2HB   LEU  29          2HB       LEU  29  -0.088   6.925  -2.339
  240    HG   LEU  29           HG       LEU  29   1.556   7.991  -0.865
  241   1HD1  LEU  29          1HD1      LEU  29  -0.704   9.404   0.089
  242   2HD1  LEU  29          2HD1      LEU  29  -0.124   8.432   1.439
  243   3HD1  LEU  29          3HD1      LEU  29   0.964   9.562   0.635
  244   1HD2  LEU  29          1HD2      LEU  29  -0.319   5.892   0.059
  245   2HD2  LEU  29          2HD2      LEU  29   1.436   5.839  -0.109
  246   3HD2  LEU  29          3HD2      LEU  29   0.709   6.593   1.309
  247    H    ASP  30           H        ASP  30   1.149  10.785  -1.491
  248    HA   ASP  30           HA       ASP  30   3.295  10.094  -3.467
  249   1HB   ASP  30          1HB       ASP  30   1.715  12.510  -3.134
  250   2HB   ASP  30          2HB       ASP  30   3.432  12.854  -2.923
  251    H    VAL  31           H        VAL  31   5.100   9.506  -2.330
  252    HA   VAL  31           HA       VAL  31   5.655  10.889   0.274
  253    HB   VAL  31           HB       VAL  31   6.576   8.682   1.011
  254   1HG1  VAL  31          1HG1      VAL  31   3.743   9.139   0.242
  255   2HG1  VAL  31          2HG1      VAL  31   4.177   7.489   0.686
  256   3HG1  VAL  31          3HG1      VAL  31   4.441   8.808   1.826
  257   1HG2  VAL  31          1HG2      VAL  31   6.360   8.121  -1.784
  258   2HG2  VAL  31          2HG2      VAL  31   7.006   7.082  -0.516
  259   3HG2  VAL  31          3HG2      VAL  31   5.293   7.009  -0.931
  260    HA   PRO  32           HA       PRO  32   9.404  11.762  -1.986
  261   1HB   PRO  32          1HB       PRO  32  10.600  13.301  -0.077
  262   2HB   PRO  32          2HB       PRO  32   9.280  13.890  -1.104
  263   1HG   PRO  32          1HG       PRO  32   9.236  13.049   1.729
  264   2HG   PRO  32          2HG       PRO  32   8.249  14.252   0.889
  265   1HD   PRO  32          1HD       PRO  32   7.448  11.669   1.577
  266   2HD   PRO  32          2HD       PRO  32   6.638  12.737   0.412
  267    H    ILE  33           H        ILE  33  11.402  10.735  -2.068
  268    HA   ILE  33           HA       ILE  33  12.568   9.590   0.418
  269    HB   ILE  33           HB       ILE  33  12.622   7.682  -1.808
  270   1HG1  ILE  33          1HG1      ILE  33   9.903   8.375  -0.639
  271   2HG1  ILE  33          2HG1      ILE  33  10.406   8.714  -2.295
  272   1HG2  ILE  33          1HG2      ILE  33  12.598   7.722   1.031
  273   2HG2  ILE  33          2HG2      ILE  33  11.205   6.769   0.523
  274   3HG2  ILE  33          3HG2      ILE  33  12.822   6.330  -0.024
  275   1HD1  ILE  33          1HD1      ILE  33  10.818   5.918  -1.451
  276   2HD1  ILE  33          2HD1      ILE  33   9.129   6.420  -1.514
  277   3HD1  ILE  33          3HD1      ILE  33  10.144   6.556  -2.950
  278    H    SER  34           H        SER  34  14.842   8.850   0.023
  279    HA   SER  34           HA       SER  34  16.277  10.706  -1.695
  280   1HB   SER  34          1HB       SER  34  16.837   9.412   0.577
  281   2HB   SER  34          2HB       SER  34  17.517   8.235  -0.541
  282    HG   SER  34           HG       SER  34  19.113   9.552  -0.865
  283    H    GLY  35           H        GLY  35  18.304   8.590  -2.458
  284   1HA   GLY  35          2HA       GLY  35  16.783   7.139  -4.570
  285   2HA   GLY  35          1HA       GLY  35  18.401   6.714  -4.015
  286    H    ASP  36           H        ASP  36  19.442   6.862  -6.007
  287    HA   ASP  36           HA       ASP  36  19.168   9.326  -7.627
  288   1HB   ASP  36          1HB       ASP  36  20.902   9.401  -5.609
  289   2HB   ASP  36          2HB       ASP  36  21.919   8.527  -6.756
  290    HA   PRO  37           HA       PRO  37  18.712   9.623  -9.408
  291   1HB   PRO  37          1HB       PRO  37  17.063   8.671 -11.374
  292   2HB   PRO  37          2HB       PRO  37  18.663   9.365 -11.699
  293   1HG   PRO  37          1HG       PRO  37  17.823   6.520 -11.601
  294   2HG   PRO  37          2HG       PRO  37  19.000   7.318 -12.652
  295   1HD   PRO  37          1HD       PRO  37  19.666   5.792 -10.472
  296   2HD   PRO  37          2HD       PRO  37  20.697   7.066 -11.157
  297    H    ALA  38           H        ALA  38  17.062   6.462  -9.870
  298    HA   ALA  38           HA       ALA  38  15.127   7.287  -7.731
  299   1HB   ALA  38          2HB       ALA  38  13.932   5.341  -9.340
  300   2HB   ALA  38          3HB       ALA  38  13.654   7.079  -9.441
  301   3HB   ALA  38          1HB       ALA  38  14.863   6.319 -10.474
  302    HA   PRO  39           HA       PRO  39  16.598   3.559  -5.797
  303   1HB   PRO  39          1HB       PRO  39  15.010   3.684  -3.579
  304   2HB   PRO  39          2HB       PRO  39  16.436   4.719  -3.800
  305   1HG   PRO  39          1HG       PRO  39  13.571   5.378  -4.028
  306   2HG   PRO  39          2HG       PRO  39  14.939   6.406  -3.587
  307   1HD   PRO  39          1HD       PRO  39  13.648   6.322  -6.079
  308   2HD   PRO  39          2HD       PRO  39  15.193   7.118  -5.716
  309    H    THR  40           H        THR  40  15.152   1.766  -4.396
  310    HA   THR  40           HA       THR  40  12.940   0.960  -6.255
  311    HB   THR  40           HB       THR  40  14.533  -0.903  -4.499
  312    HG1  THR  40           HG1      THR  40  16.086  -1.023  -6.067
  313   1HG2  THR  40          1HG2      THR  40  12.419  -1.387  -6.054
  314   2HG2  THR  40          2HG2      THR  40  13.667  -1.482  -7.295
  315   3HG2  THR  40          3HG2      THR  40  13.733  -2.552  -5.896
  316    H    VAL  41           H        VAL  41  11.416   2.134  -4.893
  317    HA   VAL  41           HA       VAL  41  11.121   1.350  -2.070
  318    HB   VAL  41           HB       VAL  41  10.788   3.663  -2.834
  319   1HG1  VAL  41          1HG1      VAL  41   9.653   2.536  -5.069
  320   2HG1  VAL  41          2HG1      VAL  41   8.227   3.086  -4.195
  321   3HG1  VAL  41          3HG1      VAL  41   9.493   4.235  -4.624
  322   1HG2  VAL  41          1HG2      VAL  41   9.418   2.673  -0.934
  323   2HG2  VAL  41          2HG2      VAL  41   8.714   4.093  -1.707
  324   3HG2  VAL  41          3HG2      VAL  41   8.098   2.486  -2.089
  325    H    ILE  42           H        ILE  42  10.476  -0.801  -2.011
  326    HA   ILE  42           HA       ILE  42   8.315  -1.816  -3.728
  327    HB   ILE  42           HB       ILE  42  10.091  -2.899  -1.527
  328   1HG1  ILE  42          1HG1      ILE  42  11.185  -2.469  -3.680
  329   2HG1  ILE  42          2HG1      ILE  42  11.055  -4.206  -3.407
  330   1HG2  ILE  42          1HG2      ILE  42   7.765  -4.159  -2.940
  331   2HG2  ILE  42          2HG2      ILE  42   9.150  -5.155  -2.490
  332   3HG2  ILE  42          3HG2      ILE  42   8.247  -4.286  -1.248
  333   1HD1  ILE  42          1HD1      ILE  42   8.834  -4.042  -4.733
  334   2HD1  ILE  42          2HD1      ILE  42   9.436  -2.473  -5.270
  335   3HD1  ILE  42          3HD1      ILE  42  10.343  -3.940  -5.641
  336    H    TRP  43           H        TRP  43   6.214  -1.357  -3.140
  337    HA   TRP  43           HA       TRP  43   5.452  -0.671  -0.396
  338   1HB   TRP  43          1HB       TRP  43   4.014  -1.172  -3.018
  339   2HB   TRP  43          2HB       TRP  43   3.138  -0.796  -1.537
  340    HD1  TRP  43           HD1      TRP  43   4.741   0.819  -4.402
  341    HE1  TRP  43           HE1      TRP  43   5.051   3.343  -3.986
  342    HE3  TRP  43           HE3      TRP  43   3.836   1.009   0.622
  343    HZ2  TRP  43           HZ2      TRP  43   4.938   5.198  -1.813
  344    HZ3  TRP  43           HZ3      TRP  43   3.962   3.150   1.842
  345    HH2  TRP  43           HH2      TRP  43   4.503   5.252   0.631
  346    H    GLN  44           H        GLN  44   5.659  -2.466   1.012
  347    HA   GLN  44           HA       GLN  44   4.661  -5.118   0.121
  348   1HB   GLN  44          1HB       GLN  44   6.783  -4.237   1.641
  349   2HB   GLN  44          2HB       GLN  44   5.637  -4.752   2.880
  350   1HG   GLN  44          1HG       GLN  44   6.348  -6.475   0.496
  351   2HG   GLN  44          2HG       GLN  44   7.222  -6.557   2.026
  352   1HE2  GLN  44          2HE2      GLN  44   5.102  -8.380   0.522
  353   2HE2  GLN  44          1HE2      GLN  44   4.046  -8.813   1.779
  354    H    LYS  45           H        LYS  45   3.033  -6.261   1.345
  355    HA   LYS  45           HA       LYS  45   1.239  -4.481   2.968
  356   1HB   LYS  45          1HB       LYS  45   0.378  -5.067   0.733
  357   2HB   LYS  45          2HB       LYS  45   0.610  -6.779   1.085
  358   1HG   LYS  45          1HG       LYS  45  -0.893  -5.828   3.246
  359   2HG   LYS  45          2HG       LYS  45  -1.591  -5.024   1.841
  360   1HD   LYS  45          1HD       LYS  45  -1.268  -7.560   0.878
  361   2HD   LYS  45          2HD       LYS  45  -1.612  -7.887   2.577
  362   1HE   LYS  45          1HE       LYS  45  -3.779  -7.786   1.683
  363   2HE   LYS  45          2HE       LYS  45  -3.545  -6.101   2.191
  364   1HZ   LYS  45          1HZ       LYS  45  -2.766  -7.110  -0.488
  365   2HZ   LYS  45          2HZ       LYS  45  -4.275  -6.393  -0.176
  366   3HZ   LYS  45          3HZ       LYS  45  -2.847  -5.496   0.026
  367    H    ALA  46           H        ALA  46   0.314  -5.421   4.845
  368    HA   ALA  46           HA       ALA  46   1.191  -8.198   5.549
  369   1HB   ALA  46          3HB       ALA  46   2.260  -7.444   7.447
  370   2HB   ALA  46          1HB       ALA  46   2.445  -5.990   6.467
  371   3HB   ALA  46          2HB       ALA  46   1.148  -6.092   7.657
  372    H    ILE  47           H        ILE  47  -0.661  -9.334   5.976
  373    HA   ILE  47           HA       ILE  47  -3.062  -7.865   6.975
  374    HB   ILE  47           HB       ILE  47  -2.688 -10.618   5.748
  375   1HG1  ILE  47          1HG1      ILE  47  -4.173  -8.426   4.382
  376   2HG1  ILE  47          2HG1      ILE  47  -2.417  -8.268   4.447
  377   1HG2  ILE  47          1HG2      ILE  47  -4.666 -10.394   7.272
  378   2HG2  ILE  47          2HG2      ILE  47  -5.233  -9.053   6.277
  379   3HG2  ILE  47          3HG2      ILE  47  -5.117 -10.674   5.591
  380   1HD1  ILE  47          1HD1      ILE  47  -3.534 -10.928   3.678
  381   2HD1  ILE  47          2HD1      ILE  47  -3.625  -9.630   2.489
  382   3HD1  ILE  47          3HD1      ILE  47  -2.061 -10.129   3.131
  383    H    THR  48           H        THR  48  -0.656 -10.185   7.923
  384    HA   THR  48           HA       THR  48  -1.978 -11.722   9.880
  385    HB   THR  48           HB       THR  48   0.324 -12.082   9.125
  386    HG1  THR  48           HG1      THR  48   0.949 -12.778  11.024
  387   1HG2  THR  48          1HG2      THR  48   0.859  -9.448  10.521
  388   2HG2  THR  48          2HG2      THR  48   2.123 -10.548   9.976
  389   3HG2  THR  48          3HG2      THR  48   1.046  -9.794   8.803
  390    H    GLN  49           H        GLN  49  -0.881  -8.369  10.026
  391    HA   GLN  49           HA       GLN  49  -1.133  -6.722  11.704
  392   1HB   GLN  49          1HB       GLN  49  -3.527  -8.195  11.273
  393   2HB   GLN  49          2HB       GLN  49  -3.415  -7.909  13.010
  394   1HG   GLN  49          1HG       GLN  49  -3.059  -5.501  12.594
  395   2HG   GLN  49          2HG       GLN  49  -3.180  -5.785  10.857
  396   1HE2  GLN  49          2HE2      GLN  49  -5.028  -5.454  13.820
  397   2HE2  GLN  49          1HE2      GLN  49  -6.561  -5.587  13.105
  398    H    GLY  50           H        GLY  50   0.639  -8.914  12.399
  399   1HA   GLY  50          2HA       GLY  50   0.640 -10.368  14.582
  400   2HA   GLY  50          1HA       GLY  50   0.331  -8.815  15.360
  401    H    ASN  51           H        ASN  51   2.746 -10.927  14.296
  402    HA   ASN  51           HA       ASN  51   4.804  -8.743  14.343
  403   1HB   ASN  51          1HB       ASN  51   4.798 -11.452  15.717
  404   2HB   ASN  51          2HB       ASN  51   6.162 -10.333  15.716
  405   1HD2  ASN  51          2HD2      ASN  51   4.966  -7.869  16.161
  406   2HD2  ASN  51          1HD2      ASN  51   4.145  -7.870  17.646
  407    H    LYS  52           H        LYS  52   4.831 -12.300  13.922
  408    HA   LYS  52           HA       LYS  52   6.123 -11.882  11.243
  409   1HB   LYS  52          1HB       LYS  52   7.181 -12.967  13.631
  410   2HB   LYS  52          2HB       LYS  52   6.887 -14.341  12.565
  411   1HG   LYS  52          1HG       LYS  52   8.988 -13.729  11.825
  412   2HG   LYS  52          2HG       LYS  52   7.999 -12.727  10.762
  413   1HD   LYS  52          1HD       LYS  52   9.329 -11.049  11.565
  414   2HD   LYS  52          2HD       LYS  52   8.186 -11.082  12.909
  415   1HE   LYS  52          1HE       LYS  52   9.815 -11.750  14.335
  416   2HE   LYS  52          2HE       LYS  52  10.241 -13.108  13.275
  417   1HZ   LYS  52          1HZ       LYS  52  11.363 -11.453  11.814
  418   2HZ   LYS  52          2HZ       LYS  52  11.130 -10.286  13.023
  419   3HZ   LYS  52          3HZ       LYS  52  12.102 -11.645  13.332
  420    H    ALA  53           H        ALA  53   6.262 -14.610  10.601
  421    HA   ALA  53           HA       ALA  53   3.413 -15.167   9.995
  422   1HB   ALA  53          2HB       ALA  53   4.928 -17.086   8.754
  423   2HB   ALA  53          3HB       ALA  53   4.573 -15.506   8.056
  424   3HB   ALA  53          1HB       ALA  53   6.094 -15.773   8.908
  425    HA   PRO  54           HA       PRO  54   3.087 -18.543  12.788
  426   1HB   PRO  54          1HB       PRO  54   1.633 -20.366  11.361
  427   2HB   PRO  54          2HB       PRO  54   0.935 -18.866  12.001
  428   1HG   PRO  54          1HG       PRO  54   1.785 -19.528   9.237
  429   2HG   PRO  54          2HG       PRO  54   0.437 -18.528   9.797
  430   1HD   PRO  54          1HD       PRO  54   2.826 -17.545   8.836
  431   2HD   PRO  54          2HD       PRO  54   1.718 -16.650   9.898
  432    H    ALA  55           H        ALA  55   3.636 -20.920  13.069
  433    HA   ALA  55           HA       ALA  55   6.124 -21.556  11.621
  434   1HB   ALA  55          1HB       ALA  55   4.644 -22.416  14.062
  435   2HB   ALA  55          3HB       ALA  55   6.355 -22.037  13.865
  436   3HB   ALA  55          2HB       ALA  55   5.732 -23.600  13.337
  437    H    ARG  56           H        ARG  56   5.812 -22.500   9.620
  438    HA   ARG  56           HA       ARG  56   3.758 -24.675   9.406
  439   1HB   ARG  56          1HB       ARG  56   3.227 -22.724   8.075
  440   2HB   ARG  56          2HB       ARG  56   4.865 -22.669   7.424
  441   1HG   ARG  56          1HG       ARG  56   4.465 -24.335   5.922
  442   2HG   ARG  56          2HG       ARG  56   3.440 -25.234   7.042
  443   1HD   ARG  56          1HD       ARG  56   1.559 -23.758   6.606
  444   2HD   ARG  56          2HD       ARG  56   2.578 -22.688   5.622
  445    HE   ARG  56           HE       ARG  56   1.882 -25.503   4.882
  446   1HH1  ARG  56          1HH1      ARG  56   4.446 -24.296   3.753
  447   2HH1  ARG  56          2HH1      ARG  56   3.886 -23.689   2.231
  448   1HH2  ARG  56          1HH2      ARG  56   0.531 -23.876   3.087
  449   2HH2  ARG  56          2HH2      ARG  56   1.669 -23.451   1.853
  450    HA   PRO  57           HA       PRO  57   8.006 -26.462   8.770
  451   1HB   PRO  57          1HB       PRO  57   7.664 -28.586  10.463
  452   2HB   PRO  57          2HB       PRO  57   8.257 -27.004  11.006
  453   1HG   PRO  57          1HG       PRO  57   5.537 -28.183  11.235
  454   2HG   PRO  57          2HG       PRO  57   6.433 -27.177  12.384
  455   1HD   PRO  57          1HD       PRO  57   4.441 -26.228  10.767
  456   2HD   PRO  57          2HD       PRO  57   5.770 -25.226  11.388
  457    H    ALA  58           H        ALA  58   8.461 -28.447   7.591
  458    HA   ALA  58           HA       ALA  58   6.022 -29.919   6.646
  459   1HB   ALA  58          3HB       ALA  58   6.514 -28.716   4.755
  460   2HB   ALA  58          1HB       ALA  58   8.188 -28.452   5.242
  461   3HB   ALA  58          2HB       ALA  58   7.712 -29.988   4.518
  462    HA   PRO  59           HA       PRO  59   8.345 -33.511   7.730
  463   1HB   PRO  59          1HB       PRO  59   7.112 -35.362   6.137
  464   2HB   PRO  59          2HB       PRO  59   6.356 -34.686   7.594
  465   1HG   PRO  59          1HG       PRO  59   5.907 -33.998   4.736
  466   2HG   PRO  59          2HG       PRO  59   4.748 -34.097   6.070
  467   1HD   PRO  59          1HD       PRO  59   5.758 -31.748   5.096
  468   2HD   PRO  59          2HD       PRO  59   5.162 -31.959   6.757
  469    H    ASP  60           H        ASP  60  10.436 -33.704   7.001
  470    HA   ASP  60           HA       ASP  60  12.265 -33.993   5.530
  471   1HB   ASP  60          1HB       ASP  60  10.070 -35.454   4.018
  472   2HB   ASP  60          2HB       ASP  60  11.801 -35.666   3.758
  473    H    ALA  61           H        ALA  61  11.677 -31.497   5.159
  474    HA   ALA  61           HA       ALA  61  10.386 -30.391   2.982
  475   1HB   ALA  61          1HB       ALA  61  12.117 -29.542   4.861
  476   2HB   ALA  61          3HB       ALA  61  11.715 -28.566   3.449
  477   3HB   ALA  61          2HB       ALA  61  13.197 -29.523   3.467
  478    HA   PRO  62           HA       PRO  62  12.798 -32.589  -0.163
  479   1HB   PRO  62          1HB       PRO  62  10.676 -33.208  -1.766
  480   2HB   PRO  62          2HB       PRO  62  11.107 -34.155  -0.335
  481   1HG   PRO  62          1HG       PRO  62   8.830 -32.383  -0.761
  482   2HG   PRO  62          2HG       PRO  62   9.077 -33.624   0.473
  483   1HD   PRO  62          1HD       PRO  62   9.392 -30.760   0.704
  484   2HD   PRO  62          2HD       PRO  62   9.501 -31.996   1.976
  485    H    GLU  63           H        GLU  63  13.303 -31.975  -2.387
  486    HA   GLU  63           HA       GLU  63  13.066 -29.158  -2.948
  487   1HB   GLU  63          1HB       GLU  63  14.178 -29.850  -5.075
  488   2HB   GLU  63          2HB       GLU  63  14.952 -30.555  -3.658
  489   1HG   GLU  63          1HG       GLU  63  12.987 -32.415  -4.302
  490   2HG   GLU  63          2HG       GLU  63  13.576 -31.880  -5.877
  491    H    ASP  64           H        ASP  64  10.631 -29.026  -2.831
  492    HA   ASP  64           HA       ASP  64   8.903 -30.325  -4.710
  493   1HB   ASP  64          1HB       ASP  64   8.338 -29.077  -2.571
  494   2HB   ASP  64          2HB       ASP  64   8.599 -27.578  -3.464
  495    H    THR  65           H        THR  65   9.217 -30.141  -6.905
  496    HA   THR  65           HA       THR  65   9.823 -27.415  -8.010
  497    HB   THR  65           HB       THR  65  10.517 -30.131  -9.169
  498    HG1  THR  65           HG1      THR  65  12.447 -29.934  -8.200
  499   1HG2  THR  65          1HG2      THR  65  10.944 -27.297  -9.947
  500   2HG2  THR  65          2HG2      THR  65  12.313 -28.386 -10.174
  501   3HG2  THR  65          3HG2      THR  65  10.773 -28.729 -10.960
  502    H    GLY  66           H        GLY  66   7.152 -28.088  -7.565
  503   1HA   GLY  66          2HA       GLY  66   5.965 -29.372  -9.888
  504   2HA   GLY  66          1HA       GLY  66   5.858 -27.613  -9.971
  505    H    ASP  67           H        ASP  67   3.558 -29.240  -9.781
  506    HA   ASP  67           HA       ASP  67   2.674 -29.151  -6.952
  507   1HB   ASP  67          1HB       ASP  67   1.880 -27.279  -9.155
  508   2HB   ASP  67          2HB       ASP  67   0.664 -27.733  -7.962
  509    H    SER  68           H        SER  68   2.642 -31.524  -7.685
  510    HA   SER  68           HA       SER  68   1.430 -33.434  -8.371
  511   1HB   SER  68          1HB       SER  68  -0.111 -31.930  -6.825
  512   2HB   SER  68          2HB       SER  68  -1.024 -31.706  -8.314
  513    HG   SER  68           HG       SER  68  -1.839 -33.513  -7.348
  514    H    ASP  69           H        ASP  69   2.526 -32.854 -10.576
  515    HA   ASP  69           HA       ASP  69   2.361 -32.738 -12.923
  516   1HB   ASP  69          1HB       ASP  69   0.923 -34.665 -12.470
  517   2HB   ASP  69          2HB       ASP  69  -0.449 -33.603 -12.159
  518    H    GLU  70           H        GLU  70  -1.035 -31.823 -12.509
  519    HA   GLU  70           HA       GLU  70  -0.792 -29.494 -14.167
  520   1HB   GLU  70          1HB       GLU  70  -2.825 -30.680 -12.295
  521   2HB   GLU  70          2HB       GLU  70  -3.109 -29.078 -12.978
  522   1HG   GLU  70          1HG       GLU  70  -2.224 -31.176 -14.887
  523   2HG   GLU  70          2HG       GLU  70  -3.852 -31.356 -14.231
  524    H    TRP  71           H        TRP  71  -1.990 -27.396 -12.939
  525    HA   TRP  71           HA       TRP  71  -0.068 -26.667 -10.758
  526   1HB   TRP  71          1HB       TRP  71   0.004 -25.468 -12.966
  527   2HB   TRP  71          2HB       TRP  71  -1.641 -24.910 -12.663
  528    HD1  TRP  71           HD1      TRP  71  -1.921 -22.824 -11.240
  529    HE1  TRP  71           HE1      TRP  71  -0.344 -21.348  -9.828
  530    HE3  TRP  71           HE3      TRP  71   2.302 -25.674 -11.392
  531    HZ2  TRP  71           HZ2      TRP  71   2.356 -21.385  -8.892
  532    HZ3  TRP  71           HZ3      TRP  71   4.361 -24.939 -10.232
  533    HH2  TRP  71           HH2      TRP  71   4.397 -22.797  -8.980
  534    H    VAL  72           H        VAL  72  -1.684 -27.759  -9.258
  535    HA   VAL  72           HA       VAL  72  -4.321 -26.534  -8.924
  536    HB   VAL  72           HB       VAL  72  -2.690 -28.428  -7.200
  537   1HG1  VAL  72          1HG1      VAL  72  -5.552 -27.491  -7.134
  538   2HG1  VAL  72          2HG1      VAL  72  -5.114 -29.077  -6.504
  539   3HG1  VAL  72          3HG1      VAL  72  -4.404 -27.624  -5.803
  540   1HG2  VAL  72          1HG2      VAL  72  -4.810 -28.944  -9.312
  541   2HG2  VAL  72          2HG2      VAL  72  -3.091 -29.305  -9.465
  542   3HG2  VAL  72          3HG2      VAL  72  -4.074 -30.178  -8.289
  543    H    PHE  73           H        PHE  73  -1.176 -25.640  -8.008
  544    HA   PHE  73           HA       PHE  73  -0.287 -24.272  -6.307
  545   1HB   PHE  73          1HB       PHE  73  -1.395 -22.093  -6.435
  546   2HB   PHE  73          2HB       PHE  73  -1.307 -22.830  -8.026
  547    HD1  PHE  73           HD1      PHE  73  -3.564 -22.145  -5.149
  548    HD2  PHE  73           HD2      PHE  73  -3.278 -23.411  -9.243
  549    HE1  PHE  73           HE1      PHE  73  -6.025 -21.966  -5.375
  550    HE2  PHE  73           HE2      PHE  73  -5.740 -23.232  -9.469
  551    HZ   PHE  73           HZ       PHE  73  -7.114 -22.509  -7.535
  552    H    ASP  74           H        ASP  74  -1.497 -22.563  -4.471
  553    HA   ASP  74           HA       ASP  74  -3.342 -24.217  -2.826
  554   1HB   ASP  74          1HB       ASP  74  -0.573 -23.289  -1.991
  555   2HB   ASP  74          2HB       ASP  74  -1.742 -24.056  -0.916
  556    H    LYS  75           H        LYS  75  -3.092 -22.714  -0.463
  557    HA   LYS  75           HA       LYS  75  -4.758 -20.481  -0.886
  558   1HB   LYS  75          1HB       LYS  75  -3.272 -21.747   1.234
  559   2HB   LYS  75          2HB       LYS  75  -3.107 -19.997   1.384
  560   1HG   LYS  75          1HG       LYS  75  -5.757 -20.176   0.828
  561   2HG   LYS  75          2HG       LYS  75  -5.517 -21.701   1.680
  562   1HD   LYS  75          1HD       LYS  75  -4.288 -20.325   3.467
  563   2HD   LYS  75          2HD       LYS  75  -4.978 -18.903   2.684
  564   1HE   LYS  75          1HE       LYS  75  -7.262 -20.064   2.922
  565   2HE   LYS  75          2HE       LYS  75  -6.447 -21.179   4.037
  566   1HZ   LYS  75          1HZ       LYS  75  -5.616 -19.252   5.269
  567   2HZ   LYS  75          2HZ       LYS  75  -6.475 -18.212   4.236
  568   3HZ   LYS  75          3HZ       LYS  75  -7.311 -19.288   5.252
  569    H    LYS  76           H        LYS  76  -3.963 -18.151  -0.139
  570    HA   LYS  76           HA       LYS  76  -2.706 -16.226  -0.682
  571   1HB   LYS  76          1HB       LYS  76  -1.022 -17.829   0.481
  572   2HB   LYS  76          2HB       LYS  76  -0.400 -18.121  -1.142
  573   1HG   LYS  76          1HG       LYS  76   0.791 -16.219  -1.012
  574   2HG   LYS  76          2HG       LYS  76  -0.710 -15.306  -0.865
  575   1HD   LYS  76          1HD       LYS  76  -0.699 -15.611   1.561
  576   2HD   LYS  76          2HD       LYS  76   0.748 -16.613   1.451
  577   1HE   LYS  76          1HE       LYS  76   0.799 -13.837   0.288
  578   2HE   LYS  76          2HE       LYS  76   1.019 -14.063   2.035
  579   1HZ   LYS  76          1HZ       LYS  76   2.687 -15.790   1.505
  580   2HZ   LYS  76          2HZ       LYS  76   2.563 -15.375  -0.139
  581   3HZ   LYS  76          3HZ       LYS  76   3.149 -14.242   0.978
  582    H    LEU  77           H        LEU  77  -1.821 -15.115  -2.568
  583    HA   LEU  77           HA       LEU  77  -1.292 -16.516  -5.059
  584   1HB   LEU  77          1HB       LEU  77  -3.376 -15.743  -6.193
  585   2HB   LEU  77          2HB       LEU  77  -3.715 -16.861  -4.873
  586    HG   LEU  77           HG       LEU  77  -3.690 -14.368  -3.629
  587   1HD1  LEU  77          1HD1      LEU  77  -4.717 -14.188  -6.442
  588   2HD1  LEU  77          2HD1      LEU  77  -5.534 -13.276  -5.173
  589   3HD1  LEU  77          3HD1      LEU  77  -3.824 -12.993  -5.502
  590   1HD2  LEU  77          1HD2      LEU  77  -5.836 -16.235  -4.618
  591   2HD2  LEU  77          2HD2      LEU  77  -5.304 -15.938  -2.962
  592   3HD2  LEU  77          3HD2      LEU  77  -6.278 -14.733  -3.805
  593    H    LEU  78           H        LEU  78  -1.571 -14.698  -6.938
  594    HA   LEU  78           HA       LEU  78   0.015 -12.386  -5.991
  595   1HB   LEU  78          1HB       LEU  78  -0.305 -13.990  -8.373
  596   2HB   LEU  78          2HB       LEU  78  -0.514 -12.286  -8.778
  597    HG   LEU  78           HG       LEU  78   1.630 -12.014  -7.227
  598   1HD1  LEU  78          1HD1      LEU  78   1.529 -14.551  -6.785
  599   2HD1  LEU  78          2HD1      LEU  78   2.123 -14.739  -8.436
  600   3HD1  LEU  78          3HD1      LEU  78   3.096 -13.881  -7.240
  601   1HD2  LEU  78          1HD2      LEU  78   1.402 -11.429  -9.652
  602   2HD2  LEU  78          2HD2      LEU  78   2.994 -12.073  -9.250
  603   3HD2  LEU  78          3HD2      LEU  78   1.806 -13.098 -10.057
  604    H    CYS  79           H        CYS  79  -0.918 -10.415  -5.626
  605    HA   CYS  79           HA       CYS  79  -3.737  -9.946  -5.863
  606   1HB   CYS  79          1HB       CYS  79  -1.674  -8.838  -4.528
  607   2HB   CYS  79          2HB       CYS  79  -1.793  -7.682  -5.854
  608    HG   CYS  79           HG       CYS  79  -4.551  -8.084  -4.819
  609    H    GLU  80           H        GLU  80  -4.325  -7.697  -7.103
  610    HA   GLU  80           HA       GLU  80  -3.392  -8.043  -9.936
  611   1HB   GLU  80          1HB       GLU  80  -5.887  -8.448  -8.859
  612   2HB   GLU  80          2HB       GLU  80  -6.008  -6.775  -9.404
  613   1HG   GLU  80          1HG       GLU  80  -4.856  -7.762 -11.586
  614   2HG   GLU  80          2HG       GLU  80  -5.578  -9.264 -11.008
  615    H    THR  81           H        THR  81  -4.200  -5.830 -11.143
  616    HA   THR  81           HA       THR  81  -3.984  -3.374  -9.639
  617    HB   THR  81           HB       THR  81  -1.707  -4.121  -9.332
  618    HG1  THR  81           HG1      THR  81  -0.999  -2.222  -9.823
  619   1HG2  THR  81          1HG2      THR  81  -1.976  -4.838 -12.213
  620   2HG2  THR  81          2HG2      THR  81  -0.388  -4.300 -11.663
  621   3HG2  THR  81          3HG2      THR  81  -1.154  -5.700 -10.912
  622    H    GLU  82           H        GLU  82  -2.691  -1.849 -11.728
  623    HA   GLU  82           HA       GLU  82  -3.164  -0.860 -13.824
  624   1HB   GLU  82          1HB       GLU  82  -3.173  -3.581 -14.210
  625   2HB   GLU  82          2HB       GLU  82  -4.792  -3.146 -14.758
  626   1HG   GLU  82          1HG       GLU  82  -3.997  -1.796 -16.478
  627   2HG   GLU  82          2HG       GLU  82  -2.456  -1.502 -15.672
  628    H    GLY  83           H        GLY  83  -6.008  -2.924 -13.161
  629   1HA   GLY  83          2HA       GLY  83  -8.286  -2.162 -13.591
  630   2HA   GLY  83          1HA       GLY  83  -7.724  -0.498 -13.399
  631    H    ARG  84           H        ARG  84  -6.543  -2.866 -11.149
  632    HA   ARG  84           HA       ARG  84  -8.646  -2.283  -9.145
  633   1HB   ARG  84          1HB       ARG  84  -6.401  -4.208  -9.556
  634   2HB   ARG  84          2HB       ARG  84  -6.881  -3.878  -7.890
  635   1HG   ARG  84          1HG       ARG  84  -9.323  -4.209  -8.994
  636   2HG   ARG  84          2HG       ARG  84  -8.381  -5.258 -10.053
  637   1HD   ARG  84          1HD       ARG  84  -7.520  -6.500  -8.120
  638   2HD   ARG  84          2HD       ARG  84  -8.386  -5.412  -7.016
  639    HE   ARG  84           HE       ARG  84 -10.508  -6.233  -8.005
  640   1HH1  ARG  84          1HH1      ARG  84  -9.662  -7.367 -10.559
  641   2HH1  ARG  84          2HH1      ARG  84  -9.554  -9.064 -10.236
  642   1HH2  ARG  84          1HH2      ARG  84  -9.481  -8.672  -6.791
  643   2HH2  ARG  84          2HH2      ARG  84  -9.452  -9.804  -8.102
  644    H    VAL  85           H        VAL  85  -5.138  -2.559  -8.566
  645    HA   VAL  85           HA       VAL  85  -5.238   0.139  -7.252
  646    HB   VAL  85           HB       VAL  85  -5.161  -1.699  -5.638
  647   1HG1  VAL  85          1HG1      VAL  85  -3.505  -2.906  -7.637
  648   2HG1  VAL  85          2HG1      VAL  85  -2.571  -2.801  -6.146
  649   3HG1  VAL  85          3HG1      VAL  85  -4.128  -3.628  -6.155
  650   1HG2  VAL  85          1HG2      VAL  85  -3.252   0.373  -5.839
  651   2HG2  VAL  85          2HG2      VAL  85  -3.718  -0.505  -4.383
  652   3HG2  VAL  85          3HG2      VAL  85  -2.349  -1.059  -5.346
  653    H    ARG  86           H        ARG  86  -3.917   1.564  -8.287
  654    HA   ARG  86           HA       ARG  86  -1.703   0.530  -9.992
  655   1HB   ARG  86          1HB       ARG  86  -3.652   2.643 -10.084
  656   2HB   ARG  86          2HB       ARG  86  -2.041   3.360 -10.148
  657   1HG   ARG  86          1HG       ARG  86  -1.521   2.356 -12.156
  658   2HG   ARG  86          2HG       ARG  86  -2.545   0.954 -11.842
  659   1HD   ARG  86          1HD       ARG  86  -4.389   1.941 -12.770
  660   2HD   ARG  86          2HD       ARG  86  -3.990   3.534 -12.094
  661    HE   ARG  86           HE       ARG  86  -2.431   3.877 -13.934
  662   1HH1  ARG  86          1HH1      ARG  86  -4.744   3.262 -15.581
  663   2HH1  ARG  86          2HH1      ARG  86  -4.208   1.946 -16.572
  664   1HH2  ARG  86          1HH2      ARG  86  -1.503   1.172 -14.544
  665   2HH2  ARG  86          2HH2      ARG  86  -2.373   0.763 -15.985
  666    H    VAL  87           H        VAL  87   0.265   0.435  -8.981
  667    HA   VAL  87           HA       VAL  87   0.977   2.644  -7.078
  668    HB   VAL  87           HB       VAL  87   1.644  -0.319  -6.976
  669   1HG1  VAL  87          1HG1      VAL  87   2.423   2.027  -5.232
  670   2HG1  VAL  87          2HG1      VAL  87   2.491   0.361  -4.657
  671   3HG1  VAL  87          3HG1      VAL  87   3.487   0.864  -6.024
  672   1HG2  VAL  87          1HG2      VAL  87  -0.284   1.452  -5.462
  673   2HG2  VAL  87          2HG2      VAL  87  -0.623  -0.059  -6.307
  674   3HG2  VAL  87          3HG2      VAL  87   0.286  -0.079  -4.796
  675    H    GLU  88           H        GLU  88   2.492   3.852  -8.172
  676    HA   GLU  88           HA       GLU  88   4.757   2.390  -9.480
  677   1HB   GLU  88          1HB       GLU  88   3.002   4.624 -10.518
  678   2HB   GLU  88          2HB       GLU  88   4.587   4.289 -11.215
  679   1HG   GLU  88          1HG       GLU  88   3.730   1.826 -11.358
  680   2HG   GLU  88          2HG       GLU  88   2.130   2.554 -11.201
  681    H    THR  89           H        THR  89   6.759   3.596  -9.475
  682    HA   THR  89           HA       THR  89   6.828   5.815  -7.457
  683    HB   THR  89           HB       THR  89   8.899   3.774  -8.335
  684    HG1  THR  89           HG1      THR  89   7.279   2.884  -7.067
  685   1HG2  THR  89          1HG2      THR  89   9.730   6.079  -7.557
  686   2HG2  THR  89          2HG2      THR  89   9.080   5.649  -5.975
  687   3HG2  THR  89          3HG2      THR  89  10.360   4.675  -6.695
  688    H    THR  90           H        THR  90   8.135   7.665  -7.961
  689    HA   THR  90           HA       THR  90   8.607   8.062 -10.876
  690    HB   THR  90           HB       THR  90   8.766  10.464 -10.129
  691    HG1  THR  90           HG1      THR  90   7.814   9.568  -7.640
  692   1HG2  THR  90          1HG2      THR  90   6.583   9.019 -10.632
  693   2HG2  THR  90          2HG2      THR  90   6.250   9.387  -8.940
  694   3HG2  THR  90          3HG2      THR  90   6.474  10.697 -10.099
  695    H    LYS  91           H        LYS  91  10.568   9.882 -10.983
  696    HA   LYS  91           HA       LYS  91  12.994   8.457 -10.748
  697   1HB   LYS  91          1HB       LYS  91  14.008  10.692 -11.121
  698   2HB   LYS  91          2HB       LYS  91  12.605  10.438 -12.159
  699   1HG   LYS  91          1HG       LYS  91  11.196  11.719 -10.614
  700   2HG   LYS  91          2HG       LYS  91  12.562  11.928  -9.517
  701   1HD   LYS  91          1HD       LYS  91  13.515  13.550 -10.804
  702   2HD   LYS  91          2HD       LYS  91  13.068  12.753 -12.312
  703   1HE   LYS  91          1HE       LYS  91  10.602  13.492 -11.335
  704   2HE   LYS  91          2HE       LYS  91  11.628  14.844 -10.814
  705   1HZ   LYS  91          1HZ       LYS  91  12.548  14.948 -13.058
  706   2HZ   LYS  91          2HZ       LYS  91  11.518  13.696 -13.555
  707   3HZ   LYS  91          3HZ       LYS  91  10.868  15.192 -13.078
  708    H    ASP  92           H        ASP  92  11.353  10.507  -8.373
  709    HA   ASP  92           HA       ASP  92  13.177   9.492  -6.275
  710   1HB   ASP  92          1HB       ASP  92  14.181  11.545  -7.403
  711   2HB   ASP  92          2HB       ASP  92  12.822  12.462  -6.752
  712    H    ARG  93           H        ARG  93  10.440   8.942  -6.537
  713    HA   ARG  93           HA       ARG  93   9.395   9.842  -4.002
  714   1HB   ARG  93          1HB       ARG  93   9.188  11.664  -6.134
  715   2HB   ARG  93          2HB       ARG  93   7.579  10.955  -5.990
  716   1HG   ARG  93          1HG       ARG  93   7.953  11.363  -3.413
  717   2HG   ARG  93          2HG       ARG  93   9.134  12.546  -3.975
  718   1HD   ARG  93          1HD       ARG  93   6.456  12.589  -5.300
  719   2HD   ARG  93          2HD       ARG  93   6.554  13.207  -3.639
  720    HE   ARG  93           HE       ARG  93   8.718  14.169  -5.349
  721   1HH1  ARG  93          1HH1      ARG  93   6.512  15.173  -3.141
  722   2HH1  ARG  93          2HH1      ARG  93   6.036  16.624  -3.959
  723   1HH2  ARG  93          1HH2      ARG  93   7.666  15.812  -6.909
  724   2HH2  ARG  93          2HH2      ARG  93   6.690  16.985  -6.093
  725    H    SER  94           H        SER  94   8.480   7.864  -3.528
  726    HA   SER  94           HA       SER  94   7.242   6.157  -5.533
  727   1HB   SER  94          1HB       SER  94   8.408   5.419  -3.438
  728   2HB   SER  94          2HB       SER  94   7.088   6.113  -2.503
  729    HG   SER  94           HG       SER  94   6.693   4.212  -4.565
  730    H    ILE  95           H        ILE  95   5.021   5.895  -5.943
  731    HA   ILE  95           HA       ILE  95   3.183   7.743  -4.466
  732    HB   ILE  95           HB       ILE  95   4.054   7.876  -7.131
  733   1HG1  ILE  95          1HG1      ILE  95   1.425   9.090  -6.439
  734   2HG1  ILE  95          2HG1      ILE  95   2.788   9.492  -5.392
  735   1HG2  ILE  95          1HG2      ILE  95   2.561   5.992  -7.712
  736   2HG2  ILE  95          2HG2      ILE  95   1.194   6.866  -7.022
  737   3HG2  ILE  95          3HG2      ILE  95   2.009   7.493  -8.454
  738   1HD1  ILE  95          1HD1      ILE  95   2.872   9.720  -8.410
  739   2HD1  ILE  95          2HD1      ILE  95   2.493  11.068  -7.337
  740   3HD1  ILE  95          3HD1      ILE  95   4.081  10.302  -7.265
  741    H    PHE  96           H        PHE  96   1.367   6.759  -3.670
  742    HA   PHE  96           HA       PHE  96   0.731   4.000  -4.667
  743   1HB   PHE  96          1HB       PHE  96   1.611   4.092  -2.360
  744   2HB   PHE  96          2HB       PHE  96   0.368   5.261  -1.924
  745    HD1  PHE  96           HD1      PHE  96   0.738   1.855  -3.433
  746    HD2  PHE  96           HD2      PHE  96  -1.661   4.501  -1.046
  747    HE1  PHE  96           HE1      PHE  96  -0.843   0.000  -2.968
  748    HE2  PHE  96           HE2      PHE  96  -3.242   2.645  -0.580
  749    HZ   PHE  96           HZ       PHE  96  -2.832   0.396  -1.543
  750    H    THR  97           H        THR  97  -0.830   4.659  -6.196
  751    HA   THR  97           HA       THR  97  -3.210   6.114  -5.091
  752    HB   THR  97           HB       THR  97  -2.236   7.519  -6.723
  753    HG1  THR  97           HG1      THR  97  -3.948   5.896  -8.283
  754   1HG2  THR  97          1HG2      THR  97  -1.711   4.998  -8.312
  755   2HG2  THR  97          2HG2      THR  97  -1.468   6.623  -8.951
  756   3HG2  THR  97          3HG2      THR  97  -0.517   6.065  -7.575
  757    H    VAL  98           H        VAL  98  -4.747   4.569  -4.702
  758    HA   VAL  98           HA       VAL  98  -5.110   2.419  -6.768
  759    HB   VAL  98           HB       VAL  98  -4.302   1.558  -4.649
  760   1HG1  VAL  98          1HG1      VAL  98  -6.600   3.113  -3.429
  761   2HG1  VAL  98          2HG1      VAL  98  -5.612   1.943  -2.555
  762   3HG1  VAL  98          3HG1      VAL  98  -4.879   3.414  -3.190
  763   1HG2  VAL  98          1HG2      VAL  98  -6.572   0.673  -5.890
  764   2HG2  VAL  98          2HG2      VAL  98  -5.794  -0.162  -4.545
  765   3HG2  VAL  98          3HG2      VAL  98  -7.158   0.914  -4.244
  766    H    GLU  99           H        GLU  99  -7.090   2.343  -7.744
  767    HA   GLU  99           HA       GLU  99  -9.203   4.207  -6.774
  768   1HB   GLU  99          1HB       GLU  99  -8.232   4.198  -9.143
  769   2HB   GLU  99          2HB       GLU  99  -9.051   2.651  -9.369
  770   1HG   GLU  99          1HG       GLU  99 -11.210   3.717  -8.802
  771   2HG   GLU  99          2HG       GLU  99 -10.388   5.266  -8.613
  772    H    GLY 100           H        GLY 100  -8.867   1.858  -5.262
  773   1HA   GLY 100          2HA       GLY 100 -10.372  -0.399  -5.988
  774   2HA   GLY 100          1HA       GLY 100 -11.523   0.761  -5.319
  775    H    ALA 101           H        ALA 101  -9.424   1.879  -3.500
  776    HA   ALA 101           HA       ALA 101  -8.440  -0.211  -1.773
  777   1HB   ALA 101          3HB       ALA 101  -7.368   1.894  -1.701
  778   2HB   ALA 101          1HB       ALA 101  -8.896   2.765  -1.581
  779   3HB   ALA 101          2HB       ALA 101  -8.292   1.850  -0.200
  780    H    GLU 102           H        GLU 102 -10.377  -1.520  -1.464
  781    HA   GLU 102           HA       GLU 102 -12.674  -0.336  -0.031
  782   1HB   GLU 102          1HB       GLU 102 -12.336  -2.329  -1.886
  783   2HB   GLU 102          2HB       GLU 102 -12.465  -3.261  -0.394
  784   1HG   GLU 102          1HG       GLU 102 -14.704  -3.025  -1.127
  785   2HG   GLU 102          2HG       GLU 102 -14.525  -1.797   0.128
  786    H    LYS 103           H        LYS 103 -13.487  -1.761   1.898
  787    HA   LYS 103           HA       LYS 103 -11.757  -1.556   4.103
  788   1HB   LYS 103          1HB       LYS 103 -13.403  -3.085   5.178
  789   2HB   LYS 103          2HB       LYS 103 -14.197  -1.845   4.209
  790   1HG   LYS 103          1HG       LYS 103 -14.458  -3.425   2.352
  791   2HG   LYS 103          2HG       LYS 103 -13.602  -4.665   3.265
  792   1HD   LYS 103          1HD       LYS 103 -15.522  -5.273   4.263
  793   2HD   LYS 103          2HD       LYS 103 -15.707  -3.645   4.916
  794   1HE   LYS 103          1HE       LYS 103 -16.395  -4.002   2.034
  795   2HE   LYS 103          2HE       LYS 103 -17.516  -4.696   3.222
  796   1HZ   LYS 103          1HZ       LYS 103 -17.402  -2.550   4.429
  797   2HZ   LYS 103          2HZ       LYS 103 -16.509  -1.903   3.141
  798   3HZ   LYS 103          3HZ       LYS 103 -18.109  -2.416   2.889
  799    H    GLU 104           H        GLU 104 -12.058  -4.163   1.749
  800    HA   GLU 104           HA       GLU 104 -10.574  -6.150   3.243
  801   1HB   GLU 104          1HB       GLU 104 -10.502  -7.257   1.011
  802   2HB   GLU 104          2HB       GLU 104 -12.119  -6.676   1.408
  803   1HG   GLU 104          1HG       GLU 104 -12.139  -5.281  -0.364
  804   2HG   GLU 104          2HG       GLU 104 -10.563  -4.615   0.064
  805    H    ASP 105           H        ASP 105  -9.665  -3.373   1.352
  806    HA   ASP 105           HA       ASP 105  -6.904  -4.301   0.888
  807   1HB   ASP 105          1HB       ASP 105  -8.603  -2.663  -0.435
  808   2HB   ASP 105          2HB       ASP 105  -7.734  -1.465   0.528
  809    H    GLU 106           H        GLU 106  -8.667  -2.139   3.067
  810    HA   GLU 106           HA       GLU 106  -6.576  -0.665   4.232
  811   1HB   GLU 106          1HB       GLU 106  -9.226  -0.895   4.587
  812   2HB   GLU 106          2HB       GLU 106  -8.694  -1.837   5.980
  813   1HG   GLU 106          1HG       GLU 106  -7.086   0.180   6.410
  814   2HG   GLU 106          2HG       GLU 106  -8.199   1.065   5.365
  815    H    GLY 107           H        GLY 107  -5.565  -1.053   6.417
  816   1HA   GLY 107          2HA       GLY 107  -4.601  -3.856   6.596
  817   2HA   GLY 107          1HA       GLY 107  -5.281  -3.117   8.048
  818    H    VAL 108           H        VAL 108  -2.415  -3.882   6.849
  819    HA   VAL 108           HA       VAL 108  -1.082  -1.310   7.610
  820    HB   VAL 108           HB       VAL 108  -0.603  -4.134   8.600
  821   1HG1  VAL 108          1HG1      VAL 108   1.140  -1.668   8.802
  822   2HG1  VAL 108          2HG1      VAL 108   1.275  -3.017   9.930
  823   3HG1  VAL 108          3HG1      VAL 108   1.593  -3.268   8.213
  824   1HG2  VAL 108          1HG2      VAL 108  -1.321  -1.497   9.905
  825   2HG2  VAL 108          2HG2      VAL 108  -2.310  -2.954   9.828
  826   3HG2  VAL 108          3HG2      VAL 108  -0.848  -2.933  10.813
  827    H    TYR 109           H        TYR 109   0.921  -0.955   6.556
  828    HA   TYR 109           HA       TYR 109   1.742  -2.977   4.502
  829   1HB   TYR 109          1HB       TYR 109   1.139  -0.025   4.178
  830   2HB   TYR 109          2HB       TYR 109   2.055  -0.940   2.985
  831    HD1  TYR 109           HD1      TYR 109  -1.211  -0.855   4.796
  832    HD2  TYR 109           HD2      TYR 109   0.971  -2.296   1.388
  833    HE1  TYR 109           HE1      TYR 109  -3.321  -1.697   3.801
  834    HE2  TYR 109           HE2      TYR 109  -1.139  -3.137   0.393
  835    HH   TYR 109           HH       TYR 109  -3.740  -2.403   0.709
  836    H    THR 110           H        THR 110   3.979  -2.689   3.798
  837    HA   THR 110           HA       THR 110   5.655  -0.909   5.515
  838    HB   THR 110           HB       THR 110   6.311  -3.803   4.901
  839    HG1  THR 110           HG1      THR 110   5.455  -4.309   6.875
  840   1HG2  THR 110          1HG2      THR 110   8.093  -2.099   5.588
  841   2HG2  THR 110          2HG2      THR 110   7.280  -2.033   7.151
  842   3HG2  THR 110          3HG2      THR 110   7.980  -3.550   6.584
  843    H    VAL 111           H        VAL 111   6.280   0.430   3.801
  844    HA   VAL 111           HA       VAL 111   7.052  -0.738   1.217
  845    HB   VAL 111           HB       VAL 111   5.737   1.363   1.529
  846   1HG1  VAL 111          1HG1      VAL 111   7.314   2.047   3.511
  847   2HG1  VAL 111          2HG1      VAL 111   8.285   2.769   2.227
  848   3HG1  VAL 111          3HG1      VAL 111   6.617   3.289   2.472
  849   1HG2  VAL 111          1HG2      VAL 111   8.330   1.304   0.025
  850   2HG2  VAL 111          2HG2      VAL 111   6.681   1.241  -0.597
  851   3HG2  VAL 111          3HG2      VAL 111   7.341   2.764  -0.002
  852    H    THR 112           H        THR 112   9.140  -1.124   0.570
  853    HA   THR 112           HA       THR 112  11.340  -0.273   2.430
  854    HB   THR 112           HB       THR 112  10.976  -2.747   0.703
  855    HG1  THR 112           HG1      THR 112   9.776  -3.026   2.471
  856   1HG2  THR 112          1HG2      THR 112  13.296  -1.636   2.213
  857   2HG2  THR 112          2HG2      THR 112  13.020  -3.375   2.321
  858   3HG2  THR 112          3HG2      THR 112  13.274  -2.619   0.749
  859    H    VAL 113           H        VAL 113  12.899   0.995   1.505
  860    HA   VAL 113           HA       VAL 113  12.945   1.276  -1.468
  861    HB   VAL 113           HB       VAL 113  14.009   3.413  -1.003
  862   1HG1  VAL 113          1HG1      VAL 113  11.785   2.867   0.984
  863   2HG1  VAL 113          2HG1      VAL 113  12.319   4.468   0.473
  864   3HG1  VAL 113          3HG1      VAL 113  11.580   3.371  -0.693
  865   1HG2  VAL 113          1HG2      VAL 113  14.405   2.179   1.704
  866   2HG2  VAL 113          2HG2      VAL 113  15.549   3.083   0.711
  867   3HG2  VAL 113          3HG2      VAL 113  14.268   3.932   1.576
  868    H    LYS 114           H        LYS 114  14.695   0.446  -2.597
  869    HA   LYS 114           HA       LYS 114  17.160  -0.236  -1.030
  870   1HB   LYS 114          1HB       LYS 114  15.289  -2.037  -1.810
  871   2HB   LYS 114          2HB       LYS 114  16.315  -2.023  -3.245
  872   1HG   LYS 114          1HG       LYS 114  18.182  -2.099  -1.231
  873   2HG   LYS 114          2HG       LYS 114  16.877  -3.068  -0.547
  874   1HD   LYS 114          1HD       LYS 114  16.937  -4.031  -3.099
  875   2HD   LYS 114          2HD       LYS 114  18.638  -3.638  -2.854
  876   1HE   LYS 114          1HE       LYS 114  17.326  -5.029  -0.581
  877   2HE   LYS 114          2HE       LYS 114  17.550  -5.996  -2.053
  878   1HZ   LYS 114          1HZ       LYS 114  19.854  -5.272  -2.141
  879   2HZ   LYS 114          2HZ       LYS 114  19.647  -4.365  -0.719
  880   3HZ   LYS 114          3HZ       LYS 114  19.539  -6.057  -0.667
  881    H    ASN 115           H        ASN 115  19.068  -0.574  -2.454
  882    HA   ASN 115           HA       ASN 115  19.055   0.268  -5.229
  883   1HB   ASN 115          1HB       ASN 115  19.043   2.256  -3.176
  884   2HB   ASN 115          2HB       ASN 115  20.636   2.280  -3.927
  885   1HD2  ASN 115          2HD2      ASN 115  18.876   4.464  -4.303
  886   2HD2  ASN 115          1HD2      ASN 115  18.349   4.484  -5.917
  887    HA   PRO 116           HA       PRO 116  23.043  -1.542  -5.107
  888   1HB   PRO 116          1HB       PRO 116  24.684   0.122  -6.530
  889   2HB   PRO 116          2HB       PRO 116  23.435  -0.892  -7.280
  890   1HG   PRO 116          1HG       PRO 116  23.378   2.010  -6.633
  891   2HG   PRO 116          2HG       PRO 116  22.726   1.154  -8.038
  892   1HD   PRO 116          1HD       PRO 116  21.200   2.007  -5.948
  893   2HD   PRO 116          2HD       PRO 116  20.777   0.613  -6.966
  894    H    VAL 117           H        VAL 117  22.624   1.402  -3.471
  895    HA   VAL 117           HA       VAL 117  25.416   1.324  -2.395
  896    HB   VAL 117           HB       VAL 117  23.276   3.468  -2.237
  897   1HG1  VAL 117          1HG1      VAL 117  24.928   3.509  -0.384
  898   2HG1  VAL 117          2HG1      VAL 117  26.234   3.532  -1.568
  899   3HG1  VAL 117          3HG1      VAL 117  25.119   4.894  -1.458
  900   1HG2  VAL 117          1HG2      VAL 117  24.194   2.971  -4.541
  901   2HG2  VAL 117          2HG2      VAL 117  24.523   4.605  -3.966
  902   3HG2  VAL 117          3HG2      VAL 117  25.794   3.384  -3.923
  903    H    GLY 118           H        GLY 118  21.980   1.167  -1.440
  904   1HA   GLY 118          2HA       GLY 118  22.254   1.358   1.355
  905   2HA   GLY 118          1HA       GLY 118  22.637  -0.313   0.948
  906    H    GLU 119           H        GLU 119  20.305   0.804   2.433
  907    HA   GLU 119           HA       GLU 119  17.966   0.596   0.717
  908   1HB   GLU 119          1HB       GLU 119  17.267  -1.635   1.539
  909   2HB   GLU 119          2HB       GLU 119  18.807  -1.727   0.686
  910   1HG   GLU 119          1HG       GLU 119  19.623  -1.211   3.261
  911   2HG   GLU 119          2HG       GLU 119  18.204  -2.223   3.525
  912    H    ASP 120           H        ASP 120  16.049   1.067   1.890
  913    HA   ASP 120           HA       ASP 120  16.316   1.453   4.846
  914   1HB   ASP 120          1HB       ASP 120  16.262   3.445   2.807
  915   2HB   ASP 120          2HB       ASP 120  14.718   3.527   3.654
  916    H    GLN 121           H        GLN 121  14.049   1.797   5.827
  917    HA   GLN 121           HA       GLN 121  11.879   0.575   4.188
  918   1HB   GLN 121          1HB       GLN 121  13.500  -0.782   6.092
  919   2HB   GLN 121          2HB       GLN 121  11.906  -0.592   6.820
  920   1HG   GLN 121          1HG       GLN 121  10.944  -1.452   4.614
  921   2HG   GLN 121          2HG       GLN 121  12.594  -1.911   4.187
  922   1HE2  GLN 121          2HE2      GLN 121  12.912  -4.094   4.617
  923   2HE2  GLN 121          1HE2      GLN 121  12.296  -4.924   5.963
  924    H    VAL 122           H        VAL 122   9.759   0.819   5.198
  925    HA   VAL 122           HA       VAL 122   9.438   2.485   7.583
  926    HB   VAL 122           HB       VAL 122   9.856   4.346   6.240
  927   1HG1  VAL 122          1HG1      VAL 122   9.144   2.496   4.071
  928   2HG1  VAL 122          2HG1      VAL 122   8.635   4.157   3.782
  929   3HG1  VAL 122          3HG1      VAL 122  10.332   3.795   4.095
  930   1HG2  VAL 122          1HG2      VAL 122   7.494   4.434   7.101
  931   2HG2  VAL 122          2HG2      VAL 122   7.745   5.390   5.641
  932   3HG2  VAL 122          3HG2      VAL 122   6.951   3.819   5.541
  933    H    ASN 123           H        ASN 123   7.110   2.683   8.120
  934    HA   ASN 123           HA       ASN 123   5.552   0.421   6.959
  935   1HB   ASN 123          1HB       ASN 123   5.100   2.092   9.449
  936   2HB   ASN 123          2HB       ASN 123   4.298   0.575   9.049
  937   1HD2  ASN 123          2HD2      ASN 123   5.943   1.014  11.442
  938   2HD2  ASN 123          1HD2      ASN 123   7.263  -0.047  11.333
  939    H    LEU 124           H        LEU 124   3.519   0.755   6.039
  940    HA   LEU 124           HA       LEU 124   2.685   3.607   5.662
  941   1HB   LEU 124          1HB       LEU 124   3.419   2.661   3.591
  942   2HB   LEU 124          2HB       LEU 124   2.575   1.149   3.900
  943    HG   LEU 124           HG       LEU 124   0.587   3.159   4.010
  944   1HD1  LEU 124          1HD1      LEU 124   2.645   4.293   2.631
  945   2HD1  LEU 124          2HD1      LEU 124   1.791   3.472   1.327
  946   3HD1  LEU 124          3HD1      LEU 124   0.947   4.652   2.328
  947   1HD2  LEU 124          1HD2      LEU 124   1.381   0.929   2.178
  948   2HD2  LEU 124          2HD2      LEU 124  -0.097   1.132   3.119
  949   3HD2  LEU 124          3HD2      LEU 124   0.132   2.048   1.629
  950    H    THR 125           H        THR 125   0.763   4.091   6.639
  951    HA   THR 125           HA       THR 125  -1.023   1.849   7.476
  952    HB   THR 125           HB       THR 125  -1.114   4.766   8.284
  953    HG1  THR 125           HG1      THR 125   0.438   4.386   9.704
  954   1HG2  THR 125          1HG2      THR 125  -2.427   2.261   9.101
  955   2HG2  THR 125          2HG2      THR 125  -1.782   3.205  10.444
  956   3HG2  THR 125          3HG2      THR 125  -2.943   3.931   9.333
  957    H    VAL 126           H        VAL 126  -3.045   1.652   6.558
  958    HA   VAL 126           HA       VAL 126  -3.964   3.861   4.748
  959    HB   VAL 126           HB       VAL 126  -3.175   1.888   3.535
  960   1HG1  VAL 126          1HG1      VAL 126  -4.914   0.485   5.535
  961   2HG1  VAL 126          2HG1      VAL 126  -4.671  -0.242   3.948
  962   3HG1  VAL 126          3HG1      VAL 126  -3.287   0.076   4.994
  963   1HG2  VAL 126          1HG2      VAL 126  -5.193   3.071   2.687
  964   2HG2  VAL 126          2HG2      VAL 126  -5.222   1.354   2.288
  965   3HG2  VAL 126          3HG2      VAL 126  -6.209   1.968   3.615
  966    H    LYS 127           H        LYS 127  -6.334   4.038   4.559
  967    HA   LYS 127           HA       LYS 127  -7.964   2.644   6.608
  968   1HB   LYS 127          1HB       LYS 127  -6.710   4.996   7.222
  969   2HB   LYS 127          2HB       LYS 127  -8.244   5.593   6.590
  970   1HG   LYS 127          1HG       LYS 127  -9.470   4.658   8.297
  971   2HG   LYS 127          2HG       LYS 127  -8.360   3.302   8.494
  972   1HD   LYS 127          1HD       LYS 127  -7.322   6.022   9.145
  973   2HD   LYS 127          2HD       LYS 127  -8.472   5.304  10.273
  974   1HE   LYS 127          1HE       LYS 127  -6.370   3.436   9.369
  975   2HE   LYS 127          2HE       LYS 127  -5.774   4.805  10.330
  976   1HZ   LYS 127          1HZ       LYS 127  -8.142   3.178  11.079
  977   2HZ   LYS 127          2HZ       LYS 127  -6.580   2.884  11.680
  978   3HZ   LYS 127          3HZ       LYS 127  -7.356   4.352  12.025
  979    H    VAL 128           H        VAL 128  -9.852   2.110   5.573
  980    HA   VAL 128           HA       VAL 128 -10.683   3.723   3.197
  981    HB   VAL 128           HB       VAL 128 -11.430   0.940   4.158
  982   1HG1  VAL 128          1HG1      VAL 128 -13.144   2.197   2.759
  983   2HG1  VAL 128          2HG1      VAL 128 -11.949   2.213   1.463
  984   3HG1  VAL 128          3HG1      VAL 128 -12.574   0.679   2.066
  985   1HG2  VAL 128          1HG2      VAL 128  -9.027   1.479   3.272
  986   2HG2  VAL 128          2HG2      VAL 128  -9.886   0.092   2.602
  987   3HG2  VAL 128          3HG2      VAL 128  -9.819   1.607   1.701
  988    H    ILE 129           H        ILE 129 -12.314   5.149   3.565
  989    HA   ILE 129           HA       ILE 129 -14.062   4.868   5.927
  990    HB   ILE 129           HB       ILE 129 -13.711   6.932   3.727
  991   1HG1  ILE 129          1HG1      ILE 129 -11.814   6.749   5.285
  992   2HG1  ILE 129          2HG1      ILE 129 -12.682   8.259   5.554
  993   1HG2  ILE 129          1HG2      ILE 129 -15.455   6.965   6.202
  994   2HG2  ILE 129          2HG2      ILE 129 -15.081   8.394   5.239
  995   3HG2  ILE 129          3HG2      ILE 129 -15.991   7.064   4.525
  996   1HD1  ILE 129          1HD1      ILE 129 -14.003   6.482   7.224
  997   2HD1  ILE 129          2HD1      ILE 129 -12.318   5.974   7.356
  998   3HD1  ILE 129          3HD1      ILE 129 -12.771   7.638   7.730
  999    H    ASP 130           H        ASP 130 -16.374   4.690   5.716
 1000    HA   ASP 130           HA       ASP 130 -17.312   3.770   3.014
 1001   1HB   ASP 130          1HB       ASP 130 -16.958   2.073   4.922
 1002   2HB   ASP 130          2HB       ASP 130 -18.347   2.835   5.699

  No H/Q in entry =        1002
  Start of MODEL    3
    1    H1   ARG   1          1H        ARG   1  29.872   7.944  -8.201
    2    H2   ARG   1          2H        ARG   1  30.517   6.372  -8.229
    3    H3   ARG   1          3H        ARG   1  29.045   6.704  -9.010
    4    HA   ARG   1           HA       ARG   1  28.573   5.577  -6.948
    5   1HB   ARG   1          1HB       ARG   1  30.568   7.637  -6.063
    6   2HB   ARG   1          2HB       ARG   1  29.396   7.033  -4.891
    7   1HG   ARG   1          1HG       ARG   1  30.819   5.020  -6.575
    8   2HG   ARG   1          2HG       ARG   1  31.738   5.802  -5.287
    9   1HD   ARG   1          1HD       ARG   1  30.586   4.707  -3.646
   10   2HD   ARG   1          2HD       ARG   1  29.035   4.891  -4.487
   11    HE   ARG   1           HE       ARG   1  29.598   2.954  -5.858
   12   1HH1  ARG   1          1HH1      ARG   1  29.877   0.913  -4.437
   13   2HH1  ARG   1          2HH1      ARG   1  31.528   0.619  -4.002
   14   1HH2  ARG   1          1HH2      ARG   1  32.596   3.808  -4.848
   15   2HH2  ARG   1          2HH2      ARG   1  33.067   2.258  -4.235
   16    H    GLN   2           H        GLN   2  26.452   6.027  -6.518
   17    HA   GLN   2           HA       GLN   2  25.396   8.725  -7.023
   18   1HB   GLN   2          1HB       GLN   2  23.244   7.555  -6.786
   19   2HB   GLN   2          2HB       GLN   2  24.326   6.635  -7.829
   20   1HG   GLN   2          1HG       GLN   2  24.752   5.026  -6.197
   21   2HG   GLN   2          2HG       GLN   2  24.268   6.089  -4.881
   22   1HE2  GLN   2          2HE2      GLN   2  22.122   5.940  -4.164
   23   2HE2  GLN   2          1HE2      GLN   2  20.904   5.070  -4.963
   24    H    GLU   3           H        GLU   3  23.207   8.142  -4.960
   25    HA   GLU   3           HA       GLU   3  24.734   9.054  -2.548
   26   1HB   GLU   3          1HB       GLU   3  22.165   9.860  -3.866
   27   2HB   GLU   3          2HB       GLU   3  22.317  10.067  -2.121
   28   1HG   GLU   3          1HG       GLU   3  23.046  12.118  -3.190
   29   2HG   GLU   3          2HG       GLU   3  24.465  11.311  -2.523
   30    HA   PRO   4           HA       PRO   4  23.151   5.560  -0.381
   31   1HB   PRO   4          1HB       PRO   4  22.852   6.639   2.129
   32   2HB   PRO   4          2HB       PRO   4  24.425   6.183   1.438
   33   1HG   PRO   4          1HG       PRO   4  23.115   8.871   1.535
   34   2HG   PRO   4          2HG       PRO   4  24.793   8.426   1.899
   35   1HD   PRO   4          1HD       PRO   4  24.156   9.515  -0.452
   36   2HD   PRO   4          2HD       PRO   4  25.366   8.212  -0.348
   37    HA   PRO   5           HA       PRO   5  18.782   6.282  -0.734
   38   1HB   PRO   5          1HB       PRO   5  17.987   3.761  -0.026
   39   2HB   PRO   5          2HB       PRO   5  18.662   4.148  -1.619
   40   1HG   PRO   5          1HG       PRO   5  19.990   2.946   0.763
   41   2HG   PRO   5          2HG       PRO   5  20.132   2.496  -0.943
   42   1HD   PRO   5          1HD       PRO   5  22.000   3.970   0.323
   43   2HD   PRO   5          2HD       PRO   5  21.622   4.185  -1.402
   44    H    LYS   6           H        LYS   6  17.055   6.662   0.729
   45    HA   LYS   6           HA       LYS   6  17.033   5.674   3.449
   46   1HB   LYS   6          1HB       LYS   6  17.553   7.865   4.518
   47   2HB   LYS   6          2HB       LYS   6  18.920   7.237   3.599
   48   1HG   LYS   6          1HG       LYS   6  18.588   8.766   1.832
   49   2HG   LYS   6          2HG       LYS   6  16.938   9.129   2.338
   50   1HD   LYS   6          1HD       LYS   6  18.124  11.006   3.092
   51   2HD   LYS   6          2HD       LYS   6  18.059   9.990   4.532
   52   1HE   LYS   6          1HE       LYS   6  20.334  10.417   4.526
   53   2HE   LYS   6          2HE       LYS   6  20.337   9.033   3.414
   54   1HZ   LYS   6          1HZ       LYS   6  20.051  11.883   2.616
   55   2HZ   LYS   6          2HZ       LYS   6  21.459  10.950   2.433
   56   3HZ   LYS   6          3HZ       LYS   6  20.055  10.554   1.562
   57    H    ILE   7           H        ILE   7  15.054   6.157   4.448
   58    HA   ILE   7           HA       ILE   7  12.895   7.095   2.730
   59    HB   ILE   7           HB       ILE   7  12.941   6.459   5.700
   60   1HG1  ILE   7          1HG1      ILE   7  13.929   4.573   4.566
   61   2HG1  ILE   7          2HG1      ILE   7  12.257   4.145   4.919
   62   1HG2  ILE   7          1HG2      ILE   7  10.836   6.906   3.664
   63   2HG2  ILE   7          2HG2      ILE   7  10.572   5.554   4.759
   64   3HG2  ILE   7          3HG2      ILE   7  10.796   7.180   5.403
   65   1HD1  ILE   7          1HD1      ILE   7  11.623   4.819   2.610
   66   2HD1  ILE   7          2HD1      ILE   7  13.318   5.162   2.265
   67   3HD1  ILE   7          3HD1      ILE   7  12.807   3.513   2.621
   68    H    HIS   8           H        HIS   8  14.698   9.225   3.006
   69    HA   HIS   8           HA       HIS   8  13.220  11.118   4.799
   70   1HB   HIS   8          1HB       HIS   8  15.294  10.720   5.833
   71   2HB   HIS   8          2HB       HIS   8  16.134  10.552   4.297
   72    HD1  HIS   8           HD1      HIS   8  15.811  12.845   6.996
   73    HD2  HIS   8           HD2      HIS   8  16.056  13.265   2.859
   74    HE1  HIS   8           HE1      HIS   8  16.572  15.222   6.566
   75    H    LEU   9           H        LEU   9  13.178  13.365   3.970
   76    HA   LEU   9           HA       LEU   9  13.618  13.531   1.005
   77   1HB   LEU   9          1HB       LEU   9  11.674  15.335   1.350
   78   2HB   LEU   9          2HB       LEU   9  11.325  13.634   1.138
   79    HG   LEU   9           HG       LEU   9  11.117  13.327   3.553
   80   1HD1  LEU   9          1HD1      LEU   9  12.809  15.175   4.091
   81   2HD1  LEU   9          2HD1      LEU   9  11.483  16.310   3.847
   82   3HD1  LEU   9          3HD1      LEU   9  11.385  15.099   5.124
   83   1HD2  LEU   9          1HD2      LEU   9   9.544  15.409   2.107
   84   2HD2  LEU   9          2HD2      LEU   9   9.010  13.868   2.773
   85   3HD2  LEU   9          3HD2      LEU   9   9.264  15.248   3.839
   86    H    ASP  10           H        ASP  10  12.551  16.505   2.186
   87    HA   ASP  10           HA       ASP  10  15.146  17.740   1.769
   88   1HB   ASP  10          1HB       ASP  10  12.547  18.512   1.587
   89   2HB   ASP  10          2HB       ASP  10  12.948  19.177   3.171
   90    H    CYS  11           H        CYS  11  13.076  17.084   4.582
   91    HA   CYS  11           HA       CYS  11  15.178  16.572   6.409
   92   1HB   CYS  11          1HB       CYS  11  14.776  19.357   5.751
   93   2HB   CYS  11          2HB       CYS  11  14.432  19.096   7.459
   94    HG   CYS  11           HG       CYS  11  17.127  18.084   6.240
   95    HA   PRO  12           HA       PRO  12  11.236  17.152   8.903
   96   1HB   PRO  12          1HB       PRO  12   9.281  18.866   8.084
   97   2HB   PRO  12          2HB       PRO  12  10.720  19.403   8.970
   98   1HG   PRO  12          1HG       PRO  12  10.023  19.762   6.144
   99   2HG   PRO  12          2HG       PRO  12  11.135  20.686   7.161
  100   1HD   PRO  12          1HD       PRO  12  11.779  18.679   5.236
  101   2HD   PRO  12          2HD       PRO  12  12.884  19.573   6.297
  102    H    GLY  13           H        GLY  13   9.214  15.991   8.963
  103   1HA   GLY  13          2HA       GLY  13   7.427  15.582   6.829
  104   2HA   GLY  13          1HA       GLY  13   7.638  14.451   8.162
  105    H    ARG  14           H        ARG  14  10.134  13.441   7.801
  106    HA   ARG  14           HA       ARG  14  11.342  12.796   5.472
  107   1HB   ARG  14          1HB       ARG  14  11.294  10.337   6.432
  108   2HB   ARG  14          2HB       ARG  14  12.076  11.624   7.346
  109   1HG   ARG  14          1HG       ARG  14  10.423  11.679   8.951
  110   2HG   ARG  14          2HG       ARG  14   9.161  11.189   7.821
  111   1HD   ARG  14          1HD       ARG  14   9.567   9.338   9.357
  112   2HD   ARG  14          2HD       ARG  14  10.230   8.884   7.774
  113    HE   ARG  14           HE       ARG  14  12.467   9.451   8.610
  114   1HH1  ARG  14          1HH1      ARG  14  12.942   7.769  10.464
  115   2HH1  ARG  14          2HH1      ARG  14  12.644   8.444  12.030
  116   1HH2  ARG  14          1HH2      ARG  14  10.763  11.094  10.824
  117   2HH2  ARG  14          2HH2      ARG  14  11.411  10.327  12.234
  118    H    ILE  15           H        ILE  15   9.177  10.092   6.171
  119    HA   ILE  15           HA       ILE  15   7.729  10.597   3.619
  120    HB   ILE  15           HB       ILE  15   9.623   8.397   4.357
  121   1HG1  ILE  15          1HG1      ILE  15   8.939   9.748   1.732
  122   2HG1  ILE  15          2HG1      ILE  15  10.216  10.283   2.824
  123   1HG2  ILE  15          1HG2      ILE  15   7.029   8.052   2.932
  124   2HG2  ILE  15          2HG2      ILE  15   8.439   7.258   2.231
  125   3HG2  ILE  15          3HG2      ILE  15   7.950   6.889   3.885
  126   1HD1  ILE  15          1HD1      ILE  15  10.156   7.426   1.899
  127   2HD1  ILE  15          2HD1      ILE  15  10.811   8.673   0.840
  128   3HD1  ILE  15          3HD1      ILE  15  11.529   8.397   2.424
  129    HA   PRO  16           HA       PRO  16   4.903   9.053   6.882
  130   1HB   PRO  16          1HB       PRO  16   2.877  10.806   6.328
  131   2HB   PRO  16          2HB       PRO  16   4.227  11.213   7.406
  132   1HG   PRO  16          1HG       PRO  16   3.746  12.014   4.592
  133   2HG   PRO  16          2HG       PRO  16   4.508  12.913   5.910
  134   1HD   PRO  16          1HD       PRO  16   5.870  11.638   3.872
  135   2HD   PRO  16          2HD       PRO  16   6.568  12.076   5.446
  136    H    ASP  17           H        ASP  17   5.226   7.451   4.822
  137    HA   ASP  17           HA       ASP  17   3.358   7.458   2.684
  138   1HB   ASP  17          1HB       ASP  17   4.030   5.098   2.481
  139   2HB   ASP  17          2HB       ASP  17   5.430   6.096   2.860
  140    H    THR  18           H        THR  18   1.367   8.138   3.838
  141    HA   THR  18           HA       THR  18  -0.150   5.774   4.871
  142    HB   THR  18           HB       THR  18  -0.199   8.566   6.065
  143    HG1  THR  18           HG1      THR  18   1.617   7.973   6.915
  144   1HG2  THR  18          1HG2      THR  18  -1.836   6.223   6.361
  145   2HG2  THR  18          2HG2      THR  18  -0.992   6.535   7.878
  146   3HG2  THR  18          3HG2      THR  18  -1.999   7.789   7.156
  147    H    ILE  19           H        ILE  19  -2.256   5.732   4.032
  148    HA   ILE  19           HA       ILE  19  -3.286   8.208   2.734
  149    HB   ILE  19           HB       ILE  19  -1.871   6.649   1.238
  150   1HG1  ILE  19          1HG1      ILE  19  -3.471   6.952  -0.658
  151   2HG1  ILE  19          2HG1      ILE  19  -4.713   7.396   0.514
  152   1HG2  ILE  19          1HG2      ILE  19  -3.014   4.567   2.147
  153   2HG2  ILE  19          2HG2      ILE  19  -4.437   5.042   1.219
  154   3HG2  ILE  19          3HG2      ILE  19  -2.926   4.671   0.390
  155   1HD1  ILE  19          1HD1      ILE  19  -2.369   8.923   1.098
  156   2HD1  ILE  19          2HD1      ILE  19  -2.698   9.068  -0.628
  157   3HD1  ILE  19          3HD1      ILE  19  -3.938   9.506   0.546
  158    H    VAL  20           H        VAL  20  -5.563   8.265   2.538
  159    HA   VAL  20           HA       VAL  20  -7.079   5.960   3.698
  160    HB   VAL  20           HB       VAL  20  -7.340   8.934   4.272
  161   1HG1  VAL  20          1HG1      VAL  20  -9.062   6.564   4.888
  162   2HG1  VAL  20          2HG1      VAL  20  -8.935   7.851   6.088
  163   3HG1  VAL  20          3HG1      VAL  20  -9.533   8.211   4.468
  164   1HG2  VAL  20          1HG2      VAL  20  -6.163   6.589   5.726
  165   2HG2  VAL  20          2HG2      VAL  20  -5.559   8.241   5.599
  166   3HG2  VAL  20          3HG2      VAL  20  -6.917   7.878   6.664
  167    H    VAL  21           H        VAL  21  -9.354   5.935   2.952
  168    HA   VAL  21           HA       VAL  21 -10.050   7.743   0.704
  169    HB   VAL  21           HB       VAL  21  -8.729   5.935  -0.290
  170   1HG1  VAL  21          1HG1      VAL  21 -10.312   4.334   1.596
  171   2HG1  VAL  21          2HG1      VAL  21 -10.224   3.628  -0.016
  172   3HG1  VAL  21          3HG1      VAL  21  -8.743   3.989   0.870
  173   1HG2  VAL  21          1HG2      VAL  21 -10.847   6.807  -1.414
  174   2HG2  VAL  21          2HG2      VAL  21 -10.297   5.220  -1.951
  175   3HG2  VAL  21          3HG2      VAL  21 -11.649   5.350  -0.826
  176    H    VAL  22           H        VAL  22 -12.351   7.518   0.108
  177    HA   VAL  22           HA       VAL  22 -13.993   6.696   2.430
  178    HB   VAL  22           HB       VAL  22 -15.758   7.929   1.181
  179   1HG1  VAL  22          1HG1      VAL  22 -13.877   9.013   2.622
  180   2HG1  VAL  22          2HG1      VAL  22 -13.243   9.583   1.078
  181   3HG1  VAL  22          3HG1      VAL  22 -14.860  10.059   1.599
  182   1HG2  VAL  22          1HG2      VAL  22 -14.679   7.234  -1.086
  183   2HG2  VAL  22          2HG2      VAL  22 -15.394   8.841  -0.961
  184   3HG2  VAL  22          3HG2      VAL  22 -13.645   8.643  -0.849
  185    H    ALA  23           H        ALA  23 -13.020   4.431   1.362
  186    HA   ALA  23           HA       ALA  23 -13.565   2.379   0.329
  187   1HB   ALA  23          2HB       ALA  23 -16.270   3.468   1.155
  188   2HB   ALA  23          1HB       ALA  23 -15.141   2.605   2.199
  189   3HB   ALA  23          3HB       ALA  23 -15.906   1.770   0.847
  190    H    GLY  24           H        GLY  24 -13.131   2.551  -1.897
  191   1HA   GLY  24          2HA       GLY  24 -15.474   2.683  -3.633
  192   2HA   GLY  24          1HA       GLY  24 -13.831   2.311  -4.142
  193    H    ASN  25           H        ASN  25 -12.389   4.529  -3.525
  194    HA   ASN  25           HA       ASN  25 -13.701   6.601  -5.228
  195   1HB   ASN  25          1HB       ASN  25 -13.275   6.726  -2.418
  196   2HB   ASN  25          2HB       ASN  25 -12.137   7.847  -3.162
  197   1HD2  ASN  25          2HD2      ASN  25 -15.488   6.907  -4.120
  198   2HD2  ASN  25          1HD2      ASN  25 -16.088   8.494  -4.122
  199    H    LYS  26           H        LYS  26 -12.071   8.165  -6.085
  200    HA   LYS  26           HA       LYS  26  -9.665   6.794  -7.006
  201   1HB   LYS  26          1HB       LYS  26 -10.714   9.635  -7.240
  202   2HB   LYS  26          2HB       LYS  26  -9.306   9.032  -8.113
  203   1HG   LYS  26          1HG       LYS  26 -10.590   7.538  -9.404
  204   2HG   LYS  26          2HG       LYS  26 -11.949   7.594  -8.281
  205   1HD   LYS  26          1HD       LYS  26 -11.839  10.202  -8.951
  206   2HD   LYS  26          2HD       LYS  26 -11.191   9.503 -10.434
  207   1HE   LYS  26          1HE       LYS  26 -13.771   8.554  -9.143
  208   2HE   LYS  26          2HE       LYS  26 -13.707   9.749 -10.454
  209   1HZ   LYS  26          1HZ       LYS  26 -12.478   7.045 -10.550
  210   2HZ   LYS  26          2HZ       LYS  26 -13.937   7.474 -11.307
  211   3HZ   LYS  26          3HZ       LYS  26 -12.476   8.188 -11.802
  212    H    LEU  27           H        LEU  27  -8.072   6.502  -5.435
  213    HA   LEU  27           HA       LEU  27  -7.428   8.850  -3.696
  214   1HB   LEU  27          1HB       LEU  27  -8.090   7.034  -2.355
  215   2HB   LEU  27          2HB       LEU  27  -7.300   5.855  -3.399
  216    HG   LEU  27           HG       LEU  27  -5.097   6.636  -2.664
  217   1HD1  LEU  27          1HD1      LEU  27  -6.399   8.996  -2.067
  218   2HD1  LEU  27          2HD1      LEU  27  -6.105   8.313  -0.472
  219   3HD1  LEU  27          3HD1      LEU  27  -4.757   8.591  -1.572
  220   1HD2  LEU  27          1HD2      LEU  27  -6.771   5.089  -1.229
  221   2HD2  LEU  27          2HD2      LEU  27  -5.146   5.489  -0.670
  222   3HD2  LEU  27          3HD2      LEU  27  -6.534   6.393  -0.064
  223    H    ARG  28           H        ARG  28  -5.307   9.582  -3.591
  224    HA   ARG  28           HA       ARG  28  -3.248   8.190  -5.252
  225   1HB   ARG  28          1HB       ARG  28  -2.605  10.440  -6.115
  226   2HB   ARG  28          2HB       ARG  28  -4.263  10.022  -6.546
  227   1HG   ARG  28          1HG       ARG  28  -4.991  11.285  -4.453
  228   2HG   ARG  28          2HG       ARG  28  -3.337  11.890  -4.354
  229   1HD   ARG  28          1HD       ARG  28  -4.931  12.153  -6.909
  230   2HD   ARG  28          2HD       ARG  28  -5.045  13.368  -5.621
  231    HE   ARG  28           HE       ARG  28  -2.287  12.680  -6.246
  232   1HH1  ARG  28          1HH1      ARG  28  -4.205  13.664  -8.623
  233   2HH1  ARG  28          2HH1      ARG  28  -3.642  15.298  -8.739
  234   1HH2  ARG  28          1HH2      ARG  28  -1.900  15.190  -5.742
  235   2HH2  ARG  28          2HH2      ARG  28  -2.337  16.162  -7.109
  236    H    LEU  29           H        LEU  29  -1.095   8.436  -4.419
  237    HA   LEU  29           HA       LEU  29  -0.806  10.024  -1.898
  238   1HB   LEU  29          1HB       LEU  29  -1.452   7.718  -1.329
  239   2HB   LEU  29          2HB       LEU  29  -0.144   7.098  -2.332
  240    HG   LEU  29           HG       LEU  29   1.509   8.200  -0.885
  241   1HD1  LEU  29          1HD1      LEU  29  -0.805   9.638   0.013
  242   2HD1  LEU  29          2HD1      LEU  29  -0.097   8.804   1.396
  243   3HD1  LEU  29          3HD1      LEU  29   0.884   9.912   0.438
  244   1HD2  LEU  29          1HD2      LEU  29  -0.387   6.142   0.022
  245   2HD2  LEU  29          2HD2      LEU  29   1.376   6.132   0.041
  246   3HD2  LEU  29          3HD2      LEU  29   0.484   6.927   1.338
  247    H    ASP  30           H        ASP  30   1.315  10.805  -1.576
  248    HA   ASP  30           HA       ASP  30   3.359  10.048  -3.635
  249   1HB   ASP  30          1HB       ASP  30   2.664  12.812  -2.585
  250   2HB   ASP  30          2HB       ASP  30   3.894  12.448  -3.794
  251    H    VAL  31           H        VAL  31   5.381   9.671  -2.763
  252    HA   VAL  31           HA       VAL  31   5.988  10.717  -0.030
  253    HB   VAL  31           HB       VAL  31   6.969   8.363   0.382
  254   1HG1  VAL  31          1HG1      VAL  31   4.068   9.103   0.247
  255   2HG1  VAL  31          2HG1      VAL  31   4.508   7.455   0.693
  256   3HG1  VAL  31          3HG1      VAL  31   5.084   8.814   1.659
  257   1HG2  VAL  31          1HG2      VAL  31   6.804   7.700  -2.051
  258   2HG2  VAL  31          2HG2      VAL  31   6.060   6.551  -0.941
  259   3HG2  VAL  31          3HG2      VAL  31   5.051   7.666  -1.862
  260    HA   PRO  32           HA       PRO  32   9.640  11.504  -2.539
  261   1HB   PRO  32          1HB       PRO  32  10.741  13.364  -0.871
  262   2HB   PRO  32          2HB       PRO  32   9.419  13.738  -1.994
  263   1HG   PRO  32          1HG       PRO  32   9.352  13.323   0.932
  264   2HG   PRO  32          2HG       PRO  32   8.343  14.358  -0.087
  265   1HD   PRO  32          1HD       PRO  32   7.604  11.886   0.963
  266   2HD   PRO  32          2HD       PRO  32   6.793  12.732  -0.371
  267    H    ILE  33           H        ILE  33  11.370  10.123  -2.450
  268    HA   ILE  33           HA       ILE  33  12.529   9.455   0.242
  269    HB   ILE  33           HB       ILE  33  12.859   7.511  -1.977
  270   1HG1  ILE  33          1HG1      ILE  33  10.129   7.697  -0.677
  271   2HG1  ILE  33          2HG1      ILE  33  10.459   8.427  -2.246
  272   1HG2  ILE  33          1HG2      ILE  33  13.053   7.540   0.807
  273   2HG2  ILE  33          2HG2      ILE  33  11.595   6.599   0.492
  274   3HG2  ILE  33          3HG2      ILE  33  13.130   6.114  -0.227
  275   1HD1  ILE  33          1HD1      ILE  33  11.322   5.604  -1.888
  276   2HD1  ILE  33          2HD1      ILE  33   9.587   5.895  -1.995
  277   3HD1  ILE  33          3HD1      ILE  33  10.649   6.406  -3.308
  278    H    SER  34           H        SER  34  14.885   8.668  -0.027
  279    HA   SER  34           HA       SER  34  16.314  10.620  -1.718
  280   1HB   SER  34          1HB       SER  34  16.944  10.191   0.623
  281   2HB   SER  34          2HB       SER  34  17.221   8.494   0.250
  282    HG   SER  34           HG       SER  34  18.620  10.767  -0.710
  283    H    GLY  35           H        GLY  35  18.664   8.847  -2.051
  284   1HA   GLY  35          2HA       GLY  35  17.684   6.730  -3.872
  285   2HA   GLY  35          1HA       GLY  35  19.359   6.958  -3.363
  286    H    ASP  36           H        ASP  36  20.161   6.972  -5.519
  287    HA   ASP  36           HA       ASP  36  19.119   9.015  -7.400
  288   1HB   ASP  36          1HB       ASP  36  20.901   9.848  -5.620
  289   2HB   ASP  36          2HB       ASP  36  22.039   9.070  -6.719
  290    HA   PRO  37           HA       PRO  37  19.074   9.455  -9.283
  291   1HB   PRO  37          1HB       PRO  37  17.752   8.439 -11.449
  292   2HB   PRO  37          2HB       PRO  37  19.355   9.186 -11.559
  293   1HG   PRO  37          1HG       PRO  37  18.603   6.320 -11.577
  294   2HG   PRO  37          2HG       PRO  37  19.906   7.154 -12.434
  295   1HD   PRO  37          1HD       PRO  37  20.246   5.642 -10.156
  296   2HD   PRO  37          2HD       PRO  37  21.365   6.903 -10.713
  297    H    ALA  38           H        ALA  38  17.711   6.191  -9.882
  298    HA   ALA  38           HA       ALA  38  15.372   6.957  -8.174
  299   1HB   ALA  38          2HB       ALA  38  15.575   4.845 -10.338
  300   2HB   ALA  38          1HB       ALA  38  15.041   6.499 -10.634
  301   3HB   ALA  38          3HB       ALA  38  14.101   5.444  -9.578
  302    HA   PRO  39           HA       PRO  39  16.888   3.668  -5.574
  303   1HB   PRO  39          1HB       PRO  39  14.982   3.888  -3.633
  304   2HB   PRO  39          2HB       PRO  39  16.319   5.042  -3.796
  305   1HG   PRO  39          1HG       PRO  39  13.473   5.341  -4.515
  306   2HG   PRO  39          2HG       PRO  39  14.647   6.562  -4.016
  307   1HD   PRO  39          1HD       PRO  39  13.785   6.054  -6.634
  308   2HD   PRO  39          2HD       PRO  39  15.178   7.045  -6.159
  309    H    THR  40           H        THR  40  15.247   1.990  -4.105
  310    HA   THR  40           HA       THR  40  13.411   0.785  -6.154
  311    HB   THR  40           HB       THR  40  14.851  -0.903  -4.148
  312    HG1  THR  40           HG1      THR  40  16.651  -0.948  -5.612
  313   1HG2  THR  40          1HG2      THR  40  13.756  -1.128  -6.921
  314   2HG2  THR  40          2HG2      THR  40  15.066  -2.211  -6.446
  315   3HG2  THR  40          3HG2      THR  40  13.550  -2.210  -5.543
  316    H    VAL  41           H        VAL  41  11.643   1.879  -5.035
  317    HA   VAL  41           HA       VAL  41  11.174   1.167  -2.201
  318    HB   VAL  41           HB       VAL  41  10.871   3.472  -3.039
  319   1HG1  VAL  41          1HG1      VAL  41   9.873   2.307  -5.306
  320   2HG1  VAL  41          2HG1      VAL  41   8.389   2.819  -4.507
  321   3HG1  VAL  41          3HG1      VAL  41   9.640   4.003  -4.882
  322   1HG2  VAL  41          1HG2      VAL  41   9.427   2.483  -1.190
  323   2HG2  VAL  41          2HG2      VAL  41   8.754   3.893  -2.008
  324   3HG2  VAL  41          3HG2      VAL  41   8.165   2.279  -2.406
  325    H    ILE  42           H        ILE  42  10.524  -1.001  -2.164
  326    HA   ILE  42           HA       ILE  42   8.446  -1.966  -4.036
  327    HB   ILE  42           HB       ILE  42  10.136  -3.199  -1.839
  328   1HG1  ILE  42          1HG1      ILE  42  11.383  -2.541  -3.848
  329   2HG1  ILE  42          2HG1      ILE  42  11.270  -4.297  -3.756
  330   1HG2  ILE  42          1HG2      ILE  42   8.013  -4.374  -3.621
  331   2HG2  ILE  42          2HG2      ILE  42   9.328  -5.368  -2.995
  332   3HG2  ILE  42          3HG2      ILE  42   8.222  -4.564  -1.881
  333   1HD1  ILE  42          1HD1      ILE  42   9.043  -3.818  -5.185
  334   2HD1  ILE  42          2HD1      ILE  42   9.989  -2.413  -5.676
  335   3HD1  ILE  42          3HD1      ILE  42  10.618  -4.038  -5.946
  336    H    TRP  43           H        TRP  43   6.335  -1.549  -3.443
  337    HA   TRP  43           HA       TRP  43   5.536  -0.951  -0.706
  338   1HB   TRP  43          1HB       TRP  43   4.108  -1.498  -3.322
  339   2HB   TRP  43          2HB       TRP  43   3.233  -1.125  -1.839
  340    HD1  TRP  43           HD1      TRP  43   4.804   0.494  -4.722
  341    HE1  TRP  43           HE1      TRP  43   5.081   3.024  -4.324
  342    HE3  TRP  43           HE3      TRP  43   3.897   0.706   0.299
  343    HZ2  TRP  43           HZ2      TRP  43   4.942   4.891  -2.160
  344    HZ3  TRP  43           HZ3      TRP  43   3.990   2.858   1.505
  345    HH2  TRP  43           HH2      TRP  43   4.504   4.958   0.283
  346    H    GLN  44           H        GLN  44   5.488  -2.604   0.802
  347    HA   GLN  44           HA       GLN  44   4.682  -5.341  -0.086
  348   1HB   GLN  44          1HB       GLN  44   6.809  -4.580   1.314
  349   2HB   GLN  44          2HB       GLN  44   5.671  -4.643   2.659
  350   1HG   GLN  44          1HG       GLN  44   5.081  -6.971   2.028
  351   2HG   GLN  44          2HG       GLN  44   6.279  -6.906   0.733
  352   1HE2  GLN  44          2HE2      GLN  44   8.375  -7.533   1.297
  353   2HE2  GLN  44          1HE2      GLN  44   8.950  -7.664   2.889
  354    H    LYS  45           H        LYS  45   3.121  -6.510   1.312
  355    HA   LYS  45           HA       LYS  45   1.253  -4.669   2.771
  356   1HB   LYS  45          1HB       LYS  45  -0.566  -6.073   1.801
  357   2HB   LYS  45          2HB       LYS  45   0.401  -5.286   0.553
  358   1HG   LYS  45          1HG       LYS  45   1.706  -7.349   0.243
  359   2HG   LYS  45          2HG       LYS  45   0.772  -8.140   1.513
  360   1HD   LYS  45          1HD       LYS  45  -1.278  -7.898   0.209
  361   2HD   LYS  45          2HD       LYS  45  -0.409  -7.001  -1.037
  362   1HE   LYS  45          1HE       LYS  45   1.135  -9.212  -0.972
  363   2HE   LYS  45          2HE       LYS  45  -0.413  -9.928  -0.478
  364   1HZ   LYS  45          1HZ       LYS  45  -1.431  -8.620  -2.348
  365   2HZ   LYS  45          2HZ       LYS  45   0.146  -8.309  -2.900
  366   3HZ   LYS  45          3HZ       LYS  45  -0.427  -9.903  -2.829
  367    H    ALA  46           H        ALA  46   0.055  -5.704   4.516
  368    HA   ALA  46           HA       ALA  46   1.148  -8.343   5.415
  369   1HB   ALA  46          1HB       ALA  46   1.980  -5.963   6.408
  370   2HB   ALA  46          2HB       ALA  46   0.579  -6.243   7.443
  371   3HB   ALA  46          3HB       ALA  46   1.887  -7.426   7.389
  372    H    ILE  47           H        ILE  47  -0.339  -9.576   6.676
  373    HA   ILE  47           HA       ILE  47  -3.183  -8.703   6.436
  374    HB   ILE  47           HB       ILE  47  -1.907 -11.395   7.036
  375   1HG1  ILE  47          1HG1      ILE  47  -3.152 -10.397   4.457
  376   2HG1  ILE  47          2HG1      ILE  47  -1.414 -10.409   4.759
  377   1HG2  ILE  47          1HG2      ILE  47  -4.729 -10.443   6.662
  378   2HG2  ILE  47          2HG2      ILE  47  -4.292 -12.067   6.133
  379   3HG2  ILE  47          3HG2      ILE  47  -4.090 -11.607   7.823
  380   1HD1  ILE  47          1HD1      ILE  47  -2.876 -12.948   5.281
  381   2HD1  ILE  47          2HD1      ILE  47  -2.686 -12.476   3.593
  382   3HD1  ILE  47          3HD1      ILE  47  -1.263 -12.695   4.612
  383    H    THR  48           H        THR  48  -1.180  -7.843   8.581
  384    HA   THR  48           HA       THR  48  -1.974  -9.154  11.053
  385    HB   THR  48           HB       THR  48  -0.671  -7.307  12.049
  386    HG1  THR  48           HG1      THR  48  -0.384  -6.283   9.437
  387   1HG2  THR  48          1HG2      THR  48   0.319  -9.292  10.559
  388   2HG2  THR  48          2HG2      THR  48   0.863  -7.938   9.570
  389   3HG2  THR  48          3HG2      THR  48   1.360  -8.052  11.258
  390    H    GLN  49           H        GLN  49  -3.632  -7.035   9.015
  391    HA   GLN  49           HA       GLN  49  -5.558  -5.702   9.311
  392   1HB   GLN  49          1HB       GLN  49  -5.702  -7.396  11.830
  393   2HB   GLN  49          2HB       GLN  49  -7.054  -6.561  11.068
  394   1HG   GLN  49          1HG       GLN  49  -6.808  -7.924   9.054
  395   2HG   GLN  49          2HG       GLN  49  -5.392  -8.721   9.739
  396   1HE2  GLN  49          2HE2      GLN  49  -8.706  -7.966  10.984
  397   2HE2  GLN  49          1HE2      GLN  49  -9.003  -9.538  11.551
  398    H    GLY  50           H        GLY  50  -6.636  -4.886  11.936
  399   1HA   GLY  50          2HA       GLY  50  -6.338  -3.200  13.541
  400   2HA   GLY  50          1HA       GLY  50  -5.298  -2.444  12.333
  401    H    ASN  51           H        ASN  51  -5.350  -4.676  15.078
  402    HA   ASN  51           HA       ASN  51  -3.647  -5.211  16.630
  403   1HB   ASN  51          1HB       ASN  51  -2.343  -5.307  13.907
  404   2HB   ASN  51          2HB       ASN  51  -1.450  -5.748  15.362
  405   1HD2  ASN  51          2HD2      ASN  51  -1.399  -7.998  14.407
  406   2HD2  ASN  51          1HD2      ASN  51  -2.757  -8.999  14.596
  407    H    LYS  52           H        LYS  52  -0.995  -4.518  16.835
  408    HA   LYS  52           HA       LYS  52   0.386  -2.734  17.553
  409   1HB   LYS  52          1HB       LYS  52  -0.541  -2.322  14.899
  410   2HB   LYS  52          2HB       LYS  52  -0.585  -0.751  15.698
  411   1HG   LYS  52          1HG       LYS  52   1.622  -0.703  15.101
  412   2HG   LYS  52          2HG       LYS  52   1.814  -1.645  16.580
  413   1HD   LYS  52          1HD       LYS  52   2.329  -3.546  15.447
  414   2HD   LYS  52          2HD       LYS  52   1.096  -3.257  14.219
  415   1HE   LYS  52          1HE       LYS  52   3.222  -3.091  13.094
  416   2HE   LYS  52          2HE       LYS  52   2.651  -1.423  13.304
  417   1HZ   LYS  52          1HZ       LYS  52   4.410  -2.856  15.224
  418   2HZ   LYS  52          2HZ       LYS  52   4.964  -1.741  14.068
  419   3HZ   LYS  52          3HZ       LYS  52   3.929  -1.229  15.309
  420    H    ALA  53           H        ALA  53  -0.091   0.026  17.543
  421    HA   ALA  53           HA       ALA  53  -1.688   0.389  19.895
  422   1HB   ALA  53          1HB       ALA  53   0.206   1.783  18.536
  423   2HB   ALA  53          2HB       ALA  53  -1.236   2.675  18.050
  424   3HB   ALA  53          3HB       ALA  53  -0.831   2.516  19.760
  425    HA   PRO  54           HA       PRO  54  -5.732   1.014  18.300
  426   1HB   PRO  54          1HB       PRO  54  -6.647   3.174  19.707
  427   2HB   PRO  54          2HB       PRO  54  -6.420   1.573  20.436
  428   1HG   PRO  54          1HG       PRO  54  -4.692   3.985  20.595
  429   2HG   PRO  54          2HG       PRO  54  -5.055   2.770  21.831
  430   1HD   PRO  54          1HD       PRO  54  -2.727   2.842  20.388
  431   2HD   PRO  54          2HD       PRO  54  -3.399   1.370  21.122
  432    H    ALA  55           H        ALA  55  -7.162   2.620  17.121
  433    HA   ALA  55           HA       ALA  55  -5.502   4.683  15.707
  434   1HB   ALA  55          3HB       ALA  55  -6.055   2.969  14.175
  435   2HB   ALA  55          1HB       ALA  55  -7.668   2.762  14.857
  436   3HB   ALA  55          2HB       ALA  55  -7.298   4.187  13.886
  437    H    ARG  56           H        ARG  56  -6.418   6.747  15.460
  438    HA   ARG  56           HA       ARG  56  -9.187   7.179  16.499
  439   1HB   ARG  56          1HB       ARG  56  -8.268   9.104  17.813
  440   2HB   ARG  56          2HB       ARG  56  -7.630   7.547  18.339
  441   1HG   ARG  56          1HG       ARG  56  -5.980   8.606  16.217
  442   2HG   ARG  56          2HG       ARG  56  -6.149   9.806  17.497
  443   1HD   ARG  56          1HD       ARG  56  -5.421   8.158  19.175
  444   2HD   ARG  56          2HD       ARG  56  -5.293   6.918  17.911
  445    HE   ARG  56           HE       ARG  56  -3.645   8.567  16.794
  446   1HH1  ARG  56          1HH1      ARG  56  -3.331   7.215  19.782
  447   2HH1  ARG  56          2HH1      ARG  56  -2.180   8.351  20.402
  448   1HH2  ARG  56          1HH2      ARG  56  -2.542  10.565  17.759
  449   2HH2  ARG  56          2HH2      ARG  56  -1.733  10.247  19.258
  450    HA   PRO  57           HA       PRO  57  -8.444   9.519  12.624
  451   1HB   PRO  57          1HB       PRO  57 -10.849   8.912  11.476
  452   2HB   PRO  57          2HB       PRO  57  -9.428   7.858  11.352
  453   1HG   PRO  57          1HG       PRO  57 -11.832   7.597  13.064
  454   2HG   PRO  57          2HG       PRO  57 -10.835   6.344  12.315
  455   1HD   PRO  57          1HD       PRO  57 -10.721   7.092  14.978
  456   2HD   PRO  57          2HD       PRO  57  -9.439   6.229  14.104
  457    H    ALA  58           H        ALA  58  -9.854  11.344  11.718
  458    HA   ALA  58           HA       ALA  58 -11.796  12.402  13.732
  459   1HB   ALA  58          3HB       ALA  58 -10.010  13.692  14.366
  460   2HB   ALA  58          2HB       ALA  58 -10.460  14.639  12.948
  461   3HB   ALA  58          1HB       ALA  58  -9.167  13.445  12.836
  462    HA   PRO  59           HA       PRO  59 -13.859  12.954   9.781
  463   1HB   PRO  59          1HB       PRO  59 -16.241  13.823  10.809
  464   2HB   PRO  59          2HB       PRO  59 -15.772  12.111  10.773
  465   1HG   PRO  59          1HG       PRO  59 -15.692  14.048  13.029
  466   2HG   PRO  59          2HG       PRO  59 -16.119  12.330  13.029
  467   1HD   PRO  59          1HD       PRO  59 -13.700  13.288  13.858
  468   2HD   PRO  59          2HD       PRO  59 -13.940  11.656  13.198
  469    H    ASP  60           H        ASP  60 -13.245  14.762   8.651
  470    HA   ASP  60           HA       ASP  60 -13.907  17.449   9.810
  471   1HB   ASP  60          1HB       ASP  60 -11.417  16.554   8.315
  472   2HB   ASP  60          2HB       ASP  60 -11.742  18.207   8.839
  473    H    ALA  61           H        ALA  61 -15.832  16.709   8.242
  474    HA   ALA  61           HA       ALA  61 -15.780  16.491   5.496
  475   1HB   ALA  61          1HB       ALA  61 -17.783  16.597   6.955
  476   2HB   ALA  61          2HB       ALA  61 -17.542  18.332   7.147
  477   3HB   ALA  61          3HB       ALA  61 -17.950  17.668   5.565
  478    HA   PRO  62           HA       PRO  62 -13.703  20.444   4.713
  479   1HB   PRO  62          1HB       PRO  62 -11.966  19.483   2.837
  480   2HB   PRO  62          2HB       PRO  62 -11.678  19.334   4.576
  481   1HG   PRO  62          1HG       PRO  62 -12.371  17.272   2.636
  482   2HG   PRO  62          2HG       PRO  62 -11.705  17.108   4.264
  483   1HD   PRO  62          1HD       PRO  62 -14.442  16.784   3.393
  484   2HD   PRO  62          2HD       PRO  62 -13.743  16.479   4.997
  485    H    GLU  63           H        GLU  63 -15.146  21.669   3.508
  486    HA   GLU  63           HA       GLU  63 -16.531  20.739   1.162
  487   1HB   GLU  63          1HB       GLU  63 -16.322  23.088   2.853
  488   2HB   GLU  63          2HB       GLU  63 -16.396  23.561   1.157
  489   1HG   GLU  63          1HG       GLU  63 -18.334  21.747   1.084
  490   2HG   GLU  63          2HG       GLU  63 -18.425  22.109   2.808
  491    H    ASP  64           H        ASP  64 -16.241  21.694  -1.043
  492    HA   ASP  64           HA       ASP  64 -13.336  22.072  -1.668
  493   1HB   ASP  64          1HB       ASP  64 -14.013  21.206  -3.898
  494   2HB   ASP  64          2HB       ASP  64 -14.453  20.086  -2.609
  495    H    THR  65           H        THR  65 -12.731  23.802  -3.047
  496    HA   THR  65           HA       THR  65 -14.851  25.879  -3.499
  497    HB   THR  65           HB       THR  65 -11.865  26.279  -3.174
  498    HG1  THR  65           HG1      THR  65 -12.126  26.147  -1.099
  499   1HG2  THR  65          1HG2      THR  65 -13.747  28.005  -4.084
  500   2HG2  THR  65          2HG2      THR  65 -13.864  28.305  -2.350
  501   3HG2  THR  65          3HG2      THR  65 -12.322  28.515  -3.180
  502    H    GLY  66           H        GLY  66 -14.064  23.669  -5.341
  503   1HA   GLY  66          2HA       GLY  66 -12.296  24.484  -7.386
  504   2HA   GLY  66          1HA       GLY  66 -13.874  25.173  -7.774
  505    H    ASP  67           H        ASP  67 -13.438  23.586  -9.675
  506    HA   ASP  67           HA       ASP  67 -13.895  20.739  -9.072
  507   1HB   ASP  67          1HB       ASP  67 -16.082  22.227  -8.966
  508   2HB   ASP  67          2HB       ASP  67 -15.985  22.123 -10.724
  509    H    SER  68           H        SER  68 -11.932  22.400 -10.574
  510    HA   SER  68           HA       SER  68 -10.791  22.349 -12.643
  511   1HB   SER  68          1HB       SER  68 -11.399  19.834 -11.873
  512   2HB   SER  68          2HB       SER  68 -12.286  19.882 -13.393
  513    HG   SER  68           HG       SER  68 -10.353  19.392 -14.131
  514    H    ASP  69           H        ASP  69 -11.748  24.115 -13.741
  515    HA   ASP  69           HA       ASP  69 -14.333  23.782 -15.120
  516   1HB   ASP  69          1HB       ASP  69 -13.924  26.157 -15.703
  517   2HB   ASP  69          2HB       ASP  69 -13.686  25.874 -13.978
  518    H    GLU  70           H        GLU  70 -12.691  21.880 -16.187
  519    HA   GLU  70           HA       GLU  70 -11.843  23.048 -18.820
  520   1HB   GLU  70          1HB       GLU  70 -10.570  21.218 -16.868
  521   2HB   GLU  70          2HB       GLU  70 -10.415  20.733 -18.557
  522   1HG   GLU  70          1HG       GLU  70  -9.646  23.105 -19.050
  523   2HG   GLU  70          2HG       GLU  70  -9.554  23.351 -17.305
  524    H    TRP  71           H        TRP  71 -11.503  20.719 -20.235
  525    HA   TRP  71           HA       TRP  71 -14.288  19.647 -20.372
  526   1HB   TRP  71          1HB       TRP  71 -13.202  20.825 -22.310
  527   2HB   TRP  71          2HB       TRP  71 -12.005  19.531 -22.364
  528    HD1  TRP  71           HD1      TRP  71 -12.620  17.430 -23.653
  529    HE1  TRP  71           HE1      TRP  71 -14.766  16.531 -24.769
  530    HE3  TRP  71           HE3      TRP  71 -15.977  20.882 -21.985
  531    HZ2  TRP  71           HZ2      TRP  71 -17.540  17.198 -24.923
  532    HZ3  TRP  71           HZ3      TRP  71 -18.363  20.730 -22.623
  533    HH2  TRP  71           HH2      TRP  71 -19.152  18.892 -24.091
  534    H    VAL  72           H        VAL  72 -14.630  17.554 -19.740
  535    HA   VAL  72           HA       VAL  72 -12.243  15.772 -19.398
  536    HB   VAL  72           HB       VAL  72 -14.993  15.791 -18.109
  537   1HG1  VAL  72          1HG1      VAL  72 -12.587  13.991 -17.781
  538   2HG1  VAL  72          2HG1      VAL  72 -13.819  14.145 -16.530
  539   3HG1  VAL  72          3HG1      VAL  72 -14.253  13.527 -18.123
  540   1HG2  VAL  72          1HG2      VAL  72 -12.263  16.763 -17.281
  541   2HG2  VAL  72          2HG2      VAL  72 -13.810  17.601 -17.175
  542   3HG2  VAL  72          3HG2      VAL  72 -13.445  16.280 -16.064
  543    H    PHE  73           H        PHE  73 -12.644  13.451 -19.880
  544    HA   PHE  73           HA       PHE  73 -14.878  12.926 -21.782
  545   1HB   PHE  73          1HB       PHE  73 -13.192  11.956 -23.345
  546   2HB   PHE  73          2HB       PHE  73 -12.927  13.674 -23.070
  547    HD1  PHE  73           HD1      PHE  73 -11.540  10.346 -22.763
  548    HD2  PHE  73           HD2      PHE  73 -11.175  14.397 -21.384
  549    HE1  PHE  73           HE1      PHE  73  -9.242   9.866 -21.965
  550    HE2  PHE  73           HE2      PHE  73  -8.877  13.918 -20.583
  551    HZ   PHE  73           HZ       PHE  73  -7.910  11.653 -20.875
  552    H    ASP  74           H        ASP  74 -13.561  10.332 -22.487
  553    HA   ASP  74           HA       ASP  74 -14.737   8.577 -20.647
  554   1HB   ASP  74          1HB       ASP  74 -12.515   8.457 -22.650
  555   2HB   ASP  74          2HB       ASP  74 -12.759   7.061 -21.599
  556    H    LYS  75           H        LYS  75 -11.197   9.162 -20.818
  557    HA   LYS  75           HA       LYS  75  -9.552   9.089 -19.123
  558   1HB   LYS  75          1HB       LYS  75 -11.615  10.743 -18.359
  559   2HB   LYS  75          2HB       LYS  75 -11.520   9.636 -16.990
  560   1HG   LYS  75          1HG       LYS  75  -9.459  10.389 -16.350
  561   2HG   LYS  75          2HG       LYS  75  -8.923  10.638 -18.011
  562   1HD   LYS  75          1HD       LYS  75  -9.810  12.768 -18.127
  563   2HD   LYS  75          2HD       LYS  75 -11.085  12.414 -16.962
  564   1HE   LYS  75          1HE       LYS  75  -8.320  12.262 -15.889
  565   2HE   LYS  75          2HE       LYS  75  -8.890  13.886 -16.328
  566   1HZ   LYS  75          1HZ       LYS  75 -10.460  11.945 -14.717
  567   2HZ   LYS  75          2HZ       LYS  75  -9.536  13.203 -14.047
  568   3HZ   LYS  75          3HZ       LYS  75 -10.865  13.559 -15.044
  569    H    LYS  76           H        LYS  76  -9.117   6.838 -19.096
  570    HA   LYS  76           HA       LYS  76 -10.836   4.912 -17.758
  571   1HB   LYS  76          1HB       LYS  76  -9.209   4.530 -19.668
  572   2HB   LYS  76          2HB       LYS  76  -7.901   4.707 -18.497
  573   1HG   LYS  76          1HG       LYS  76  -8.649   2.799 -17.246
  574   2HG   LYS  76          2HG       LYS  76 -10.154   2.713 -18.162
  575   1HD   LYS  76          1HD       LYS  76  -9.070   1.942 -20.109
  576   2HD   LYS  76          2HD       LYS  76  -7.487   2.484 -19.548
  577   1HE   LYS  76          1HE       LYS  76  -7.404   0.148 -19.183
  578   2HE   LYS  76          2HE       LYS  76  -7.888   0.768 -17.593
  579   1HZ   LYS  76          1HZ       LYS  76 -10.217   0.515 -18.272
  580   2HZ   LYS  76          2HZ       LYS  76  -9.713  -0.182 -19.738
  581   3HZ   LYS  76          3HZ       LYS  76  -9.398  -0.974 -18.270
  582    H    LEU  77           H        LEU  77 -11.004   4.769 -15.560
  583    HA   LEU  77           HA       LEU  77  -8.544   5.207 -13.911
  584   1HB   LEU  77          1HB       LEU  77 -11.259   6.487 -13.781
  585   2HB   LEU  77          2HB       LEU  77 -10.337   6.277 -12.293
  586    HG   LEU  77           HG       LEU  77  -8.881   7.408 -14.633
  587   1HD1  LEU  77          1HD1      LEU  77 -11.107   8.794 -13.147
  588   2HD1  LEU  77          2HD1      LEU  77  -9.747   9.714 -13.792
  589   3HD1  LEU  77          3HD1      LEU  77 -10.777   8.782 -14.880
  590   1HD2  LEU  77          1HD2      LEU  77  -8.157   6.933 -12.111
  591   2HD2  LEU  77          2HD2      LEU  77  -7.543   8.336 -12.985
  592   3HD2  LEU  77          3HD2      LEU  77  -8.883   8.519 -11.854
  593    H    LEU  78           H        LEU  78  -8.886   2.691 -14.253
  594    HA   LEU  78           HA       LEU  78  -9.958   1.626 -11.759
  595   1HB   LEU  78          1HB       LEU  78 -11.713   0.251 -12.872
  596   2HB   LEU  78          2HB       LEU  78 -12.020   1.977 -13.049
  597    HG   LEU  78           HG       LEU  78 -10.440   1.423 -15.250
  598   1HD1  LEU  78          1HD1      LEU  78 -12.111  -0.969 -14.524
  599   2HD1  LEU  78          2HD1      LEU  78 -11.843  -0.566 -16.219
  600   3HD1  LEU  78          3HD1      LEU  78 -10.471  -0.916 -15.169
  601   1HD2  LEU  78          1HD2      LEU  78 -12.722   2.671 -14.884
  602   2HD2  LEU  78          2HD2      LEU  78 -12.350   2.007 -16.474
  603   3HD2  LEU  78          3HD2      LEU  78 -13.432   1.138 -15.386
  604    H    CYS  79           H        CYS  79  -9.497  -0.709 -11.576
  605    HA   CYS  79           HA       CYS  79  -7.814  -1.885 -13.733
  606   1HB   CYS  79          1HB       CYS  79  -6.980  -0.956 -11.018
  607   2HB   CYS  79          2HB       CYS  79  -6.259  -2.449 -11.619
  608    HG   CYS  79           HG       CYS  79  -4.726  -0.687 -12.625
  609    H    GLU  80           H        GLU  80  -7.889  -4.156 -13.725
  610    HA   GLU  80           HA       GLU  80  -9.761  -5.382 -11.737
  611   1HB   GLU  80          1HB       GLU  80 -10.040  -7.090 -13.529
  612   2HB   GLU  80          2HB       GLU  80 -10.406  -5.466 -14.107
  613   1HG   GLU  80          1HG       GLU  80  -7.587  -6.000 -14.439
  614   2HG   GLU  80          2HG       GLU  80  -8.529  -7.289 -15.188
  615    H    THR  81           H        THR  81  -7.713  -5.370 -10.287
  616    HA   THR  81           HA       THR  81  -5.950  -7.709 -10.933
  617    HB   THR  81           HB       THR  81  -4.970  -5.383 -10.701
  618    HG1  THR  81           HG1      THR  81  -3.303  -6.476 -10.114
  619   1HG2  THR  81          1HG2      THR  81  -6.500  -4.610  -8.911
  620   2HG2  THR  81          2HG2      THR  81  -5.762  -5.764  -7.801
  621   3HG2  THR  81          3HG2      THR  81  -4.807  -4.431  -8.448
  622    H    GLU  82           H        GLU  82  -4.954  -8.111  -8.343
  623    HA   GLU  82           HA       GLU  82  -7.223  -9.495  -7.075
  624   1HB   GLU  82          1HB       GLU  82  -4.309  -9.595  -7.159
  625   2HB   GLU  82          2HB       GLU  82  -4.905  -9.724  -5.503
  626   1HG   GLU  82          1HG       GLU  82  -5.981 -11.720  -5.895
  627   2HG   GLU  82          2HG       GLU  82  -6.307 -11.333  -7.586
  628    H    GLY  83           H        GLY  83  -8.255  -7.272  -6.613
  629   1HA   GLY  83          2HA       GLY  83  -7.094  -6.074  -4.130
  630   2HA   GLY  83          1HA       GLY  83  -8.814  -6.440  -4.256
  631    H    ARG  84           H        ARG  84  -7.927  -5.493  -7.293
  632    HA   ARG  84           HA       ARG  84  -8.183  -3.488  -8.513
  633   1HB   ARG  84          1HB       ARG  84  -9.965  -2.951  -6.113
  634   2HB   ARG  84          2HB       ARG  84 -10.045  -2.089  -7.649
  635   1HG   ARG  84          1HG       ARG  84 -10.118  -4.984  -8.024
  636   2HG   ARG  84          2HG       ARG  84 -11.438  -4.420  -7.000
  637   1HD   ARG  84          1HD       ARG  84 -10.816  -2.916  -9.532
  638   2HD   ARG  84          2HD       ARG  84 -11.765  -4.414  -9.612
  639    HE   ARG  84           HE       ARG  84 -12.605  -2.479  -7.549
  640   1HH1  ARG  84          1HH1      ARG  84 -12.768  -2.237 -10.825
  641   2HH1  ARG  84          2HH1      ARG  84 -14.489  -2.367 -10.959
  642   1HH2  ARG  84          1HH2      ARG  84 -14.941  -3.324  -7.658
  643   2HH2  ARG  84          2HH2      ARG  84 -15.720  -2.982  -9.167
  644    H    VAL  85           H        VAL  85  -5.964  -2.774  -8.152
  645    HA   VAL  85           HA       VAL  85  -5.808  -0.274  -6.593
  646    HB   VAL  85           HB       VAL  85  -5.363  -2.063  -4.952
  647   1HG1  VAL  85          1HG1      VAL  85  -3.146  -2.848  -6.870
  648   2HG1  VAL  85          2HG1      VAL  85  -3.391  -3.532  -5.262
  649   3HG1  VAL  85          3HG1      VAL  85  -4.596  -3.790  -6.524
  650   1HG2  VAL  85          1HG2      VAL  85  -3.821   0.166  -5.398
  651   2HG2  VAL  85          2HG2      VAL  85  -3.670  -0.885  -3.990
  652   3HG2  VAL  85          3HG2      VAL  85  -2.602  -1.109  -5.375
  653    H    ARG  86           H        ARG  86  -4.035   1.040  -7.296
  654    HA   ARG  86           HA       ARG  86  -2.379  -0.086  -9.529
  655   1HB   ARG  86          1HB       ARG  86  -4.523   1.516  -9.906
  656   2HB   ARG  86          2HB       ARG  86  -3.288   2.747  -9.645
  657   1HG   ARG  86          1HG       ARG  86  -1.916   1.823 -11.426
  658   2HG   ARG  86          2HG       ARG  86  -3.030   0.472 -11.631
  659   1HD   ARG  86          1HD       ARG  86  -4.149   1.729 -13.151
  660   2HD   ARG  86          2HD       ARG  86  -4.613   2.817 -11.828
  661    HE   ARG  86           HE       ARG  86  -2.089   3.674 -12.322
  662   1HH1  ARG  86          1HH1      ARG  86  -4.864   4.645 -13.566
  663   2HH1  ARG  86          2HH1      ARG  86  -4.325   4.967 -15.180
  664   1HH2  ARG  86          1HH2      ARG  86  -1.301   3.318 -14.784
  665   2HH2  ARG  86          2HH2      ARG  86  -2.308   4.216 -15.869
  666    H    VAL  87           H        VAL  87  -0.499  -0.176  -8.191
  667    HA   VAL  87           HA       VAL  87   0.413   2.412  -6.992
  668    HB   VAL  87           HB       VAL  87   1.287  -0.462  -6.537
  669   1HG1  VAL  87          1HG1      VAL  87   2.149   2.191  -5.442
  670   2HG1  VAL  87          2HG1      VAL  87   2.150   0.794  -4.366
  671   3HG1  VAL  87          3HG1      VAL  87   3.123   0.775  -5.837
  672   1HG2  VAL  87          1HG2      VAL  87  -0.854   1.239  -5.397
  673   2HG2  VAL  87          2HG2      VAL  87  -0.720  -0.518  -5.445
  674   3HG2  VAL  87          3HG2      VAL  87   0.142   0.398  -4.209
  675    H    GLU  88           H        GLU  88   2.519   3.184  -7.520
  676    HA   GLU  88           HA       GLU  88   4.324   1.691  -9.259
  677   1HB   GLU  88          1HB       GLU  88   2.140   3.154 -10.382
  678   2HB   GLU  88          2HB       GLU  88   3.622   4.024 -10.782
  679   1HG   GLU  88          1HG       GLU  88   4.588   1.778 -11.512
  680   2HG   GLU  88          2HG       GLU  88   2.949   1.136 -11.386
  681    H    THR  89           H        THR  89   6.363   2.713  -9.355
  682    HA   THR  89           HA       THR  89   6.638   5.187  -7.690
  683    HB   THR  89           HB       THR  89   8.576   2.971  -8.442
  684    HG1  THR  89           HG1      THR  89   7.289   2.143  -6.939
  685   1HG2  THR  89          1HG2      THR  89   9.637   5.216  -8.078
  686   2HG2  THR  89          2HG2      THR  89   8.935   5.234  -6.460
  687   3HG2  THR  89          3HG2      THR  89  10.125   4.006  -6.892
  688    H    THR  90           H        THR  90   8.128   6.843  -8.469
  689    HA   THR  90           HA       THR  90   8.446   6.805 -11.446
  690    HB   THR  90           HB       THR  90   6.939   8.506 -10.431
  691    HG1  THR  90           HG1      THR  90   7.616   9.822 -11.904
  692   1HG2  THR  90          1HG2      THR  90   8.952   8.643  -8.485
  693   2HG2  THR  90          2HG2      THR  90   9.032  10.186  -9.336
  694   3HG2  THR  90          3HG2      THR  90   7.519   9.663  -8.595
  695    H    LYS  91           H        LYS  91  10.281   8.764 -11.807
  696    HA   LYS  91           HA       LYS  91  12.787   7.603 -11.593
  697   1HB   LYS  91          1HB       LYS  91  11.946  10.512 -11.530
  698   2HB   LYS  91          2HB       LYS  91  13.601   9.980 -11.833
  699   1HG   LYS  91          1HG       LYS  91  12.083   8.411 -13.562
  700   2HG   LYS  91          2HG       LYS  91  11.296   9.987 -13.633
  701   1HD   LYS  91          1HD       LYS  91  14.210  10.214 -13.679
  702   2HD   LYS  91          2HD       LYS  91  13.598   9.244 -15.018
  703   1HE   LYS  91          1HE       LYS  91  13.515  11.463 -15.857
  704   2HE   LYS  91          2HE       LYS  91  11.852  11.176 -15.305
  705   1HZ   LYS  91          1HZ       LYS  91  12.460  12.110 -13.147
  706   2HZ   LYS  91          2HZ       LYS  91  14.023  12.446 -13.720
  707   3HZ   LYS  91          3HZ       LYS  91  12.686  13.246 -14.390
  708    H    ASP  92           H        ASP  92  11.303   9.774  -9.141
  709    HA   ASP  92           HA       ASP  92  13.147   8.634  -7.118
  710   1HB   ASP  92          1HB       ASP  92  13.957  10.795  -8.528
  711   2HB   ASP  92          2HB       ASP  92  13.065  11.603  -7.239
  712    H    ARG  93           H        ARG  93  10.374   8.309  -7.172
  713    HA   ARG  93           HA       ARG  93   9.584   9.355  -4.602
  714   1HB   ARG  93          1HB       ARG  93   9.477  11.411  -6.040
  715   2HB   ARG  93          2HB       ARG  93   8.276  10.602  -7.043
  716   1HG   ARG  93          1HG       ARG  93   6.948  10.248  -4.863
  717   2HG   ARG  93          2HG       ARG  93   8.028  11.453  -4.160
  718   1HD   ARG  93          1HD       ARG  93   7.351  12.786  -6.397
  719   2HD   ARG  93          2HD       ARG  93   5.885  11.804  -6.206
  720    HE   ARG  93           HE       ARG  93   6.209  12.668  -3.672
  721   1HH1  ARG  93          1HH1      ARG  93   4.104  14.123  -4.840
  722   2HH1  ARG  93          2HH1      ARG  93   4.693  15.742  -5.015
  723   1HH2  ARG  93          1HH2      ARG  93   8.027  14.848  -4.688
  724   2HH2  ARG  93          2HH2      ARG  93   6.913  16.153  -4.929
  725    H    SER  94           H        SER  94   8.559   7.479  -3.995
  726    HA   SER  94           HA       SER  94   7.112   5.778  -5.853
  727   1HB   SER  94          1HB       SER  94   8.371   5.195  -3.689
  728   2HB   SER  94          2HB       SER  94   6.959   5.805  -2.830
  729    HG   SER  94           HG       SER  94   6.784   3.870  -4.891
  730    H    ILE  95           H        ILE  95   4.842   5.563  -6.062
  731    HA   ILE  95           HA       ILE  95   3.185   7.598  -4.615
  732    HB   ILE  95           HB       ILE  95   3.939   7.598  -7.307
  733   1HG1  ILE  95          1HG1      ILE  95   1.371   8.899  -6.519
  734   2HG1  ILE  95          2HG1      ILE  95   2.824   9.332  -5.617
  735   1HG2  ILE  95          1HG2      ILE  95   2.370   5.729  -7.747
  736   2HG2  ILE  95          2HG2      ILE  95   1.053   6.689  -7.072
  737   3HG2  ILE  95          3HG2      ILE  95   1.855   7.210  -8.553
  738   1HD1  ILE  95          1HD1      ILE  95   2.639   9.391  -8.639
  739   2HD1  ILE  95          2HD1      ILE  95   2.398  10.805  -7.612
  740   3HD1  ILE  95          3HD1      ILE  95   3.965   9.995  -7.645
  741    H    PHE  96           H        PHE  96   1.337   6.755  -3.719
  742    HA   PHE  96           HA       PHE  96   0.545   3.974  -4.526
  743   1HB   PHE  96          1HB       PHE  96   1.481   4.185  -2.248
  744   2HB   PHE  96          2HB       PHE  96   0.301   5.435  -1.870
  745    HD1  PHE  96           HD1      PHE  96   0.838   1.851  -2.406
  746    HD2  PHE  96           HD2      PHE  96  -2.092   4.892  -1.624
  747    HE1  PHE  96           HE1      PHE  96  -0.803   0.104  -1.766
  748    HE2  PHE  96           HE2      PHE  96  -3.733   3.145  -0.985
  749    HZ   PHE  96           HZ       PHE  96  -3.088   0.751  -1.055
  750    H    THR  97           H        THR  97  -1.025   4.594  -6.067
  751    HA   THR  97           HA       THR  97  -3.317   6.217  -5.007
  752    HB   THR  97           HB       THR  97  -2.285   7.503  -6.708
  753    HG1  THR  97           HG1      THR  97  -3.759   7.386  -8.409
  754   1HG2  THR  97          1HG2      THR  97  -1.968   4.906  -8.232
  755   2HG2  THR  97          2HG2      THR  97  -1.602   6.495  -8.902
  756   3HG2  THR  97          3HG2      THR  97  -0.683   5.885  -7.527
  757    H    VAL  98           H        VAL  98  -5.026   4.877  -4.645
  758    HA   VAL  98           HA       VAL  98  -5.507   2.661  -6.614
  759    HB   VAL  98           HB       VAL  98  -4.649   1.754  -4.541
  760   1HG1  VAL  98          1HG1      VAL  98  -6.801   3.395  -3.172
  761   2HG1  VAL  98          2HG1      VAL  98  -5.734   2.243  -2.371
  762   3HG1  VAL  98          3HG1      VAL  98  -5.066   3.702  -3.102
  763   1HG2  VAL  98          1HG2      VAL  98  -7.091   1.051  -5.621
  764   2HG2  VAL  98          2HG2      VAL  98  -6.219   0.120  -4.404
  765   3HG2  VAL  98          3HG2      VAL  98  -7.478   1.252  -3.912
  766    H    GLU  99           H        GLU  99  -7.474   2.830  -7.589
  767    HA   GLU  99           HA       GLU  99  -9.463   4.745  -6.500
  768   1HB   GLU  99          1HB       GLU  99  -9.234   3.197  -9.102
  769   2HB   GLU  99          2HB       GLU  99 -10.475   4.402  -8.760
  770   1HG   GLU  99          1HG       GLU  99  -9.061   6.121  -9.159
  771   2HG   GLU  99          2HG       GLU  99  -7.776   5.388  -8.200
  772    H    GLY 100           H        GLY 100  -9.237   2.443  -4.931
  773   1HA   GLY 100          2HA       GLY 100 -10.955   0.289  -5.638
  774   2HA   GLY 100          1HA       GLY 100 -11.922   1.509  -4.810
  775    H    ALA 101           H        ALA 101  -9.673   2.376  -3.097
  776    HA   ALA 101           HA       ALA 101  -8.651   0.129  -1.597
  777   1HB   ALA 101          1HB       ALA 101  -8.844   3.097  -1.349
  778   2HB   ALA 101          3HB       ALA 101  -7.419   2.057  -1.295
  779   3HB   ALA 101          2HB       ALA 101  -8.473   2.182   0.113
  780    H    GLU 102           H        GLU 102 -10.696  -1.088  -1.308
  781    HA   GLU 102           HA       GLU 102 -12.718   0.088   0.514
  782   1HB   GLU 102          1HB       GLU 102 -12.783  -1.612  -1.649
  783   2HB   GLU 102          2HB       GLU 102 -12.902  -2.743  -0.300
  784   1HG   GLU 102          1HG       GLU 102 -14.814  -1.538   0.604
  785   2HG   GLU 102          2HG       GLU 102 -14.652  -0.290  -0.631
  786    H    LYS 103           H        LYS 103 -13.524  -2.022   2.024
  787    HA   LYS 103           HA       LYS 103 -11.765  -2.132   4.225
  788   1HB   LYS 103          1HB       LYS 103 -14.012  -3.862   3.196
  789   2HB   LYS 103          2HB       LYS 103 -13.190  -4.260   4.705
  790   1HG   LYS 103          1HG       LYS 103 -13.631  -1.809   5.378
  791   2HG   LYS 103          2HG       LYS 103 -14.780  -1.784   4.040
  792   1HD   LYS 103          1HD       LYS 103 -16.060  -2.395   5.955
  793   2HD   LYS 103          2HD       LYS 103 -15.797  -3.897   5.068
  794   1HE   LYS 103          1HE       LYS 103 -13.570  -3.832   6.676
  795   2HE   LYS 103          2HE       LYS 103 -14.800  -3.106   7.729
  796   1HZ   LYS 103          1HZ       LYS 103 -15.168  -5.608   6.169
  797   2HZ   LYS 103          2HZ       LYS 103 -14.816  -5.551   7.830
  798   3HZ   LYS 103          3HZ       LYS 103 -16.283  -4.923   7.248
  799    H    GLU 104           H        GLU 104 -11.841  -4.092   1.308
  800    HA   GLU 104           HA       GLU 104 -10.150  -6.238   2.274
  801   1HB   GLU 104          1HB       GLU 104 -10.745  -5.183  -0.512
  802   2HB   GLU 104          2HB       GLU 104 -10.032  -6.756  -0.153
  803   1HG   GLU 104          1HG       GLU 104 -12.063  -7.333   1.176
  804   2HG   GLU 104          2HG       GLU 104 -12.782  -5.796   0.692
  805    H    ASP 105           H        ASP 105  -9.566  -3.034   0.973
  806    HA   ASP 105           HA       ASP 105  -6.722  -3.544   0.406
  807   1HB   ASP 105          1HB       ASP 105  -8.596  -1.866  -0.591
  808   2HB   ASP 105          2HB       ASP 105  -7.856  -0.799   0.604
  809    H    GLU 106           H        GLU 106  -8.677  -1.904   2.887
  810    HA   GLU 106           HA       GLU 106  -6.679  -0.581   4.359
  811   1HB   GLU 106          1HB       GLU 106  -9.391  -1.319   4.614
  812   2HB   GLU 106          2HB       GLU 106  -8.603  -1.923   6.070
  813   1HG   GLU 106          1HG       GLU 106  -7.900   0.835   5.175
  814   2HG   GLU 106          2HG       GLU 106  -9.490   0.593   5.901
  815    H    GLY 107           H        GLY 107  -5.410  -1.243   6.199
  816   1HA   GLY 107          2HA       GLY 107  -4.526  -4.057   6.065
  817   2HA   GLY 107          1HA       GLY 107  -5.163  -3.512   7.619
  818    H    VAL 108           H        VAL 108  -2.342  -4.209   6.461
  819    HA   VAL 108           HA       VAL 108  -0.962  -1.695   7.333
  820    HB   VAL 108           HB       VAL 108  -0.607  -4.561   8.245
  821   1HG1  VAL 108          1HG1      VAL 108   1.334  -2.289   8.213
  822   2HG1  VAL 108          2HG1      VAL 108   1.268  -3.282   9.670
  823   3HG1  VAL 108          3HG1      VAL 108   1.636  -4.024   8.113
  824   1HG2  VAL 108          1HG2      VAL 108  -2.210  -2.704   9.267
  825   2HG2  VAL 108          2HG2      VAL 108  -1.292  -3.783  10.319
  826   3HG2  VAL 108          3HG2      VAL 108  -0.711  -2.147  10.010
  827    H    TYR 109           H        TYR 109   1.007  -1.298   6.266
  828    HA   TYR 109           HA       TYR 109   1.897  -3.302   4.227
  829   1HB   TYR 109          1HB       TYR 109   1.249  -0.365   3.852
  830   2HB   TYR 109          2HB       TYR 109   2.096  -1.334   2.649
  831    HD1  TYR 109           HD1      TYR 109  -1.101  -0.955   4.500
  832    HD2  TYR 109           HD2      TYR 109   0.942  -2.918   1.272
  833    HE1  TYR 109           HE1      TYR 109  -3.268  -1.807   3.643
  834    HE2  TYR 109           HE2      TYR 109  -1.223  -3.771   0.417
  835    HH   TYR 109           HH       TYR 109  -3.934  -2.682   0.874
  836    H    THR 110           H        THR 110   4.116  -2.938   3.512
  837    HA   THR 110           HA       THR 110   5.744  -1.067   5.175
  838    HB   THR 110           HB       THR 110   6.410  -3.988   4.687
  839    HG1  THR 110           HG1      THR 110   5.534  -4.422   6.608
  840   1HG2  THR 110          1HG2      THR 110   7.690  -1.691   6.084
  841   2HG2  THR 110          2HG2      THR 110   7.798  -3.265   6.874
  842   3HG2  THR 110          3HG2      THR 110   8.432  -3.052   5.242
  843    H    VAL 111           H        VAL 111   6.346   0.224   3.410
  844    HA   VAL 111           HA       VAL 111   7.090  -0.995   0.853
  845    HB   VAL 111           HB       VAL 111   5.834   1.168   1.239
  846   1HG1  VAL 111          1HG1      VAL 111   7.380   1.958   3.069
  847   2HG1  VAL 111          2HG1      VAL 111   8.570   2.302   1.814
  848   3HG1  VAL 111          3HG1      VAL 111   7.028   3.157   1.825
  849   1HG2  VAL 111          1HG2      VAL 111   8.329   1.065  -0.445
  850   2HG2  VAL 111          2HG2      VAL 111   6.659   0.814  -0.952
  851   3HG2  VAL 111          3HG2      VAL 111   7.214   2.431  -0.516
  852    H    THR 112           H        THR 112   9.101  -1.791   0.471
  853    HA   THR 112           HA       THR 112  11.338  -1.039   2.270
  854    HB   THR 112           HB       THR 112  11.171  -3.089   0.042
  855    HG1  THR 112           HG1      THR 112  10.114  -4.311   1.379
  856   1HG2  THR 112          1HG2      THR 112  13.438  -2.425   0.951
  857   2HG2  THR 112          2HG2      THR 112  12.908  -3.034   2.519
  858   3HG2  THR 112          3HG2      THR 112  13.035  -4.130   1.145
  859    H    VAL 113           H        VAL 113  12.899   0.372   1.632
  860    HA   VAL 113           HA       VAL 113  13.057   1.141  -1.261
  861    HB   VAL 113           HB       VAL 113  13.882   2.547   1.299
  862   1HG1  VAL 113          1HG1      VAL 113  15.019   2.979  -1.105
  863   2HG1  VAL 113          2HG1      VAL 113  13.595   4.006  -1.273
  864   3HG1  VAL 113          3HG1      VAL 113  14.724   4.275   0.054
  865   1HG2  VAL 113          1HG2      VAL 113  11.483   2.735  -0.520
  866   2HG2  VAL 113          2HG2      VAL 113  11.521   2.577   1.237
  867   3HG2  VAL 113          3HG2      VAL 113  11.973   4.104   0.477
  868    H    LYS 114           H        LYS 114  14.871   0.365  -2.310
  869    HA   LYS 114           HA       LYS 114  17.331  -0.140  -0.657
  870   1HB   LYS 114          1HB       LYS 114  16.055  -1.804  -2.845
  871   2HB   LYS 114          2HB       LYS 114  17.641  -2.143  -2.149
  872   1HG   LYS 114          1HG       LYS 114  16.723  -3.112  -0.332
  873   2HG   LYS 114          2HG       LYS 114  15.650  -1.738  -0.067
  874   1HD   LYS 114          1HD       LYS 114  14.264  -3.671  -0.480
  875   2HD   LYS 114          2HD       LYS 114  14.178  -2.639  -1.909
  876   1HE   LYS 114          1HE       LYS 114  15.453  -4.099  -3.206
  877   2HE   LYS 114          2HE       LYS 114  16.275  -4.793  -1.794
  878   1HZ   LYS 114          1HZ       LYS 114  13.383  -5.099  -2.412
  879   2HZ   LYS 114          2HZ       LYS 114  14.565  -6.293  -2.669
  880   3HZ   LYS 114          3HZ       LYS 114  14.199  -5.781  -1.091
  881    H    ASN 115           H        ASN 115  19.333  -0.241  -2.025
  882    HA   ASN 115           HA       ASN 115  19.350   0.832  -4.722
  883   1HB   ASN 115          1HB       ASN 115  19.146   2.623  -2.499
  884   2HB   ASN 115          2HB       ASN 115  20.746   2.827  -3.209
  885   1HD2  ASN 115          2HD2      ASN 115  18.771   4.885  -3.432
  886   2HD2  ASN 115          1HD2      ASN 115  18.299   5.008  -5.057
  887    HA   PRO 116           HA       PRO 116  23.431  -0.751  -4.638
  888   1HB   PRO 116          1HB       PRO 116  24.980   1.117  -5.904
  889   2HB   PRO 116          2HB       PRO 116  23.813   0.082  -6.750
  890   1HG   PRO 116          1HG       PRO 116  23.545   2.915  -5.878
  891   2HG   PRO 116          2HG       PRO 116  22.994   2.137  -7.370
  892   1HD   PRO 116          1HD       PRO 116  21.341   2.703  -5.291
  893   2HD   PRO 116          2HD       PRO 116  21.071   1.344  -6.403
  894    H    VAL 117           H        VAL 117  23.077   2.447  -3.211
  895    HA   VAL 117           HA       VAL 117  25.737   2.287  -1.922
  896    HB   VAL 117           HB       VAL 117  23.491   4.314  -1.727
  897   1HG1  VAL 117          1HG1      VAL 117  26.384   4.353  -0.823
  898   2HG1  VAL 117          2HG1      VAL 117  25.352   5.783  -0.890
  899   3HG1  VAL 117          3HG1      VAL 117  24.954   4.458   0.205
  900   1HG2  VAL 117          1HG2      VAL 117  25.962   4.089  -3.457
  901   2HG2  VAL 117          2HG2      VAL 117  24.290   4.278  -3.979
  902   3HG2  VAL 117          3HG2      VAL 117  25.126   5.620  -3.199
  903    H    GLY 118           H        GLY 118  22.315   1.840  -1.067
  904   1HA   GLY 118          2HA       GLY 118  22.470   1.951   1.731
  905   2HA   GLY 118          1HA       GLY 118  23.040   0.341   1.292
  906    H    GLU 119           H        GLU 119  20.637   0.926   2.763
  907    HA   GLU 119           HA       GLU 119  18.410   0.456   0.862
  908   1HB   GLU 119          1HB       GLU 119  19.491  -1.514   2.891
  909   2HB   GLU 119          2HB       GLU 119  17.861  -1.645   2.230
  910   1HG   GLU 119          1HG       GLU 119  18.839  -1.671  -0.068
  911   2HG   GLU 119          2HG       GLU 119  20.449  -1.679   0.654
  912    H    ASP 120           H        ASP 120  16.315   0.129   2.266
  913    HA   ASP 120           HA       ASP 120  16.330   1.209   4.973
  914   1HB   ASP 120          1HB       ASP 120  16.355   2.976   2.707
  915   2HB   ASP 120          2HB       ASP 120  14.794   3.120   3.513
  916    H    GLN 121           H        GLN 121  14.069   1.419   5.802
  917    HA   GLN 121           HA       GLN 121  11.980   0.162   4.095
  918   1HB   GLN 121          1HB       GLN 121  13.181  -1.640   5.274
  919   2HB   GLN 121          2HB       GLN 121  12.906  -0.824   6.814
  920   1HG   GLN 121          1HG       GLN 121  10.491  -1.069   6.554
  921   2HG   GLN 121          2HG       GLN 121  10.713  -1.794   4.962
  922   1HE2  GLN 121          1HE2      GLN 121  12.716  -3.640   5.320
  923   2HE2  GLN 121          2HE2      GLN 121  12.291  -4.778   6.506
  924    H    VAL 122           H        VAL 122   9.863   0.707   4.761
  925    HA   VAL 122           HA       VAL 122   9.499   2.329   7.219
  926    HB   VAL 122           HB       VAL 122   9.915   4.142   5.808
  927   1HG1  VAL 122          1HG1      VAL 122   9.205   2.211   3.703
  928   2HG1  VAL 122          2HG1      VAL 122   8.788   3.884   3.345
  929   3HG1  VAL 122          3HG1      VAL 122  10.455   3.450   3.720
  930   1HG2  VAL 122          1HG2      VAL 122   7.534   4.243   6.621
  931   2HG2  VAL 122          2HG2      VAL 122   7.809   5.142   5.129
  932   3HG2  VAL 122          3HG2      VAL 122   7.029   3.562   5.074
  933    H    ASN 123           H        ASN 123   7.178   2.508   7.755
  934    HA   ASN 123           HA       ASN 123   5.632   0.215   6.634
  935   1HB   ASN 123          1HB       ASN 123   5.210   1.888   9.125
  936   2HB   ASN 123          2HB       ASN 123   4.395   0.375   8.736
  937   1HD2  ASN 123          2HD2      ASN 123   6.568  -1.170   7.787
  938   2HD2  ASN 123          1HD2      ASN 123   7.676  -1.408   9.051
  939    H    LEU 124           H        LEU 124   3.628   0.523   5.695
  940    HA   LEU 124           HA       LEU 124   2.747   3.358   5.295
  941   1HB   LEU 124          1HB       LEU 124   3.452   2.365   3.241
  942   2HB   LEU 124          2HB       LEU 124   2.642   0.847   3.608
  943    HG   LEU 124           HG       LEU 124   0.606   2.801   3.684
  944   1HD1  LEU 124          1HD1      LEU 124   2.627   3.974   2.287
  945   2HD1  LEU 124          2HD1      LEU 124   1.793   3.118   0.993
  946   3HD1  LEU 124          3HD1      LEU 124   0.920   4.286   1.984
  947   1HD2  LEU 124          1HD2      LEU 124   1.461   0.574   1.876
  948   2HD2  LEU 124          2HD2      LEU 124  -0.023   0.747   2.813
  949   3HD2  LEU 124          3HD2      LEU 124   0.182   1.649   1.312
  950    H    THR 125           H        THR 125   0.842   3.857   6.290
  951    HA   THR 125           HA       THR 125  -0.942   1.627   7.173
  952    HB   THR 125           HB       THR 125  -0.897   4.542   8.011
  953    HG1  THR 125           HG1      THR 125   1.030   3.866   8.662
  954   1HG2  THR 125          1HG2      THR 125  -2.176   2.021   9.047
  955   2HG2  THR 125          2HG2      THR 125  -1.857   3.378  10.128
  956   3HG2  THR 125          3HG2      THR 125  -2.919   3.590   8.738
  957    H    VAL 126           H        VAL 126  -3.049   1.534   6.399
  958    HA   VAL 126           HA       VAL 126  -3.938   3.761   4.598
  959    HB   VAL 126           HB       VAL 126  -3.216   1.813   3.319
  960   1HG1  VAL 126          1HG1      VAL 126  -4.774   0.391   5.426
  961   2HG1  VAL 126          2HG1      VAL 126  -4.799  -0.300   3.803
  962   3HG1  VAL 126          3HG1      VAL 126  -3.263  -0.071   4.642
  963   1HG2  VAL 126          1HG2      VAL 126  -5.345   3.040   2.678
  964   2HG2  VAL 126          2HG2      VAL 126  -5.237   1.385   2.076
  965   3HG2  VAL 126          3HG2      VAL 126  -6.243   1.750   3.478
  966    H    LYS 127           H        LYS 127  -6.323   3.969   4.461
  967    HA   LYS 127           HA       LYS 127  -7.910   2.563   6.540
  968   1HB   LYS 127          1HB       LYS 127  -6.674   4.696   7.395
  969   2HB   LYS 127          2HB       LYS 127  -7.869   5.578   6.444
  970   1HG   LYS 127          1HG       LYS 127  -9.687   4.441   7.663
  971   2HG   LYS 127          2HG       LYS 127  -8.496   3.552   8.614
  972   1HD   LYS 127          1HD       LYS 127  -7.629   6.115   8.976
  973   2HD   LYS 127          2HD       LYS 127  -9.369   6.370   8.842
  974   1HE   LYS 127          1HE       LYS 127  -9.289   5.884  11.099
  975   2HE   LYS 127          2HE       LYS 127  -9.342   4.214  10.500
  976   1HZ   LYS 127          1HZ       LYS 127  -6.871   4.342  10.313
  977   2HZ   LYS 127          2HZ       LYS 127  -6.929   5.814  11.153
  978   3HZ   LYS 127          3HZ       LYS 127  -7.452   4.386  11.909
  979    H    VAL 128           H        VAL 128 -10.101   2.463   5.959
  980    HA   VAL 128           HA       VAL 128 -10.888   3.942   3.467
  981    HB   VAL 128           HB       VAL 128 -11.646   1.151   4.398
  982   1HG1  VAL 128          1HG1      VAL 128 -13.362   2.431   3.053
  983   2HG1  VAL 128          2HG1      VAL 128 -12.182   2.516   1.747
  984   3HG1  VAL 128          3HG1      VAL 128 -12.790   0.951   2.284
  985   1HG2  VAL 128          1HG2      VAL 128  -9.671   2.198   2.361
  986   2HG2  VAL 128          2HG2      VAL 128  -9.393   1.028   3.652
  987   3HG2  VAL 128          3HG2      VAL 128 -10.345   0.573   2.240
  988    H    ILE 129           H        ILE 129 -12.479   5.379   3.943
  989    HA   ILE 129           HA       ILE 129 -14.270   4.890   6.269
  990    HB   ILE 129           HB       ILE 129 -13.606   7.292   4.535
  991   1HG1  ILE 129          1HG1      ILE 129 -11.814   6.593   6.080
  992   2HG1  ILE 129          2HG1      ILE 129 -12.524   8.120   6.600
  993   1HG2  ILE 129          1HG2      ILE 129 -15.538   6.945   6.825
  994   2HG2  ILE 129          2HG2      ILE 129 -14.859   8.519   6.411
  995   3HG2  ILE 129          3HG2      ILE 129 -15.841   7.645   5.235
  996   1HD1  ILE 129          1HD1      ILE 129 -14.038   6.759   8.129
  997   2HD1  ILE 129          2HD1      ILE 129 -13.028   5.366   7.749
  998   3HD1  ILE 129          3HD1      ILE 129 -12.331   6.764   8.567
  999    H    ASP 130           H        ASP 130 -16.623   5.498   5.869
 1000    HA   ASP 130           HA       ASP 130 -17.458   4.899   3.050
 1001   1HB   ASP 130          1HB       ASP 130 -17.616   2.986   4.707
 1002   2HB   ASP 130          2HB       ASP 130 -18.798   3.946   5.598

  No H/Q in entry =        1002
  Start of MODEL    4
    1    H1   ARG   1          1H        ARG   1  28.501   6.106  -9.046
    2    H2   ARG   1          2H        ARG   1  29.782   7.134  -8.608
    3    H3   ARG   1          3H        ARG   1  29.996   5.451  -8.573
    4    HA   ARG   1           HA       ARG   1  28.543   5.199  -6.720
    5   1HB   ARG   1          1HB       ARG   1  30.788   7.112  -6.810
    6   2HB   ARG   1          2HB       ARG   1  29.771   7.267  -5.377
    7   1HG   ARG   1          1HG       ARG   1  29.967   4.636  -5.322
    8   2HG   ARG   1          2HG       ARG   1  31.417   4.930  -6.284
    9   1HD   ARG   1          1HD       ARG   1  31.082   6.647  -3.872
   10   2HD   ARG   1          2HD       ARG   1  31.473   4.939  -3.586
   11    HE   ARG   1           HE       ARG   1  33.215   5.581  -5.591
   12   1HH1  ARG   1          1HH1      ARG   1  32.406   8.244  -3.889
   13   2HH1  ARG   1          2HH1      ARG   1  33.929   8.473  -3.097
   14   1HH2  ARG   1          1HH2      ARG   1  35.178   5.374  -4.024
   15   2HH2  ARG   1          2HH2      ARG   1  35.499   6.848  -3.174
   16    H    GLN   2           H        GLN   2  26.406   5.735  -6.452
   17    HA   GLN   2           HA       GLN   2  25.509   8.525  -6.876
   18   1HB   GLN   2          1HB       GLN   2  23.284   7.469  -6.794
   19   2HB   GLN   2          2HB       GLN   2  24.346   6.578  -7.881
   20   1HG   GLN   2          1HG       GLN   2  24.609   4.808  -6.401
   21   2HG   GLN   2          2HG       GLN   2  24.193   5.784  -4.998
   22   1HE2  GLN   2          2HE2      GLN   2  21.997   5.884  -4.370
   23   2HE2  GLN   2          1HE2      GLN   2  20.742   5.120  -5.217
   24    H    GLU   3           H        GLU   3  23.225   7.924  -4.928
   25    HA   GLU   3           HA       GLU   3  24.727   8.551  -2.411
   26   1HB   GLU   3          1HB       GLU   3  22.063   9.463  -3.531
   27   2HB   GLU   3          2HB       GLU   3  22.571   9.797  -1.875
   28   1HG   GLU   3          1HG       GLU   3  24.718  10.771  -2.926
   29   2HG   GLU   3          2HG       GLU   3  23.822  10.763  -4.446
   30    HA   PRO   4           HA       PRO   4  22.921   4.977  -0.582
   31   1HB   PRO   4          1HB       PRO   4  22.639   5.843   2.009
   32   2HB   PRO   4          2HB       PRO   4  24.197   5.373   1.297
   33   1HG   PRO   4          1HG       PRO   4  23.023   8.103   1.631
   34   2HG   PRO   4          2HG       PRO   4  24.673   7.542   1.958
   35   1HD   PRO   4          1HD       PRO   4  24.093   8.877  -0.286
   36   2HD   PRO   4          2HD       PRO   4  25.259   7.533  -0.291
   37    HA   PRO   5           HA       PRO   5  18.591   5.930  -0.890
   38   1HB   PRO   5          1HB       PRO   5  17.673   3.407  -0.357
   39   2HB   PRO   5          2HB       PRO   5  18.374   3.866  -1.920
   40   1HG   PRO   5          1HG       PRO   5  19.629   2.453   0.384
   41   2HG   PRO   5          2HG       PRO   5  19.757   2.102  -1.346
   42   1HD   PRO   5          1HD       PRO   5  21.692   3.397   0.010
   43   2HD   PRO   5          2HD       PRO   5  21.328   3.748  -1.695
   44    H    LYS   6           H        LYS   6  17.133   6.628   0.661
   45    HA   LYS   6           HA       LYS   6  16.911   5.320   3.275
   46   1HB   LYS   6          1HB       LYS   6  18.459   7.834   2.789
   47   2HB   LYS   6          2HB       LYS   6  17.503   7.728   4.269
   48   1HG   LYS   6          1HG       LYS   6  18.676   5.301   4.337
   49   2HG   LYS   6          2HG       LYS   6  19.922   6.198   3.466
   50   1HD   LYS   6          1HD       LYS   6  19.895   7.923   5.262
   51   2HD   LYS   6          2HD       LYS   6  18.721   6.948   6.149
   52   1HE   LYS   6          1HE       LYS   6  21.112   5.440   5.293
   53   2HE   LYS   6          2HE       LYS   6  21.440   6.728   6.470
   54   1HZ   LYS   6          1HZ       LYS   6  19.518   5.905   7.765
   55   2HZ   LYS   6          2HZ       LYS   6  19.393   4.587   6.700
   56   3HZ   LYS   6          3HZ       LYS   6  20.779   4.771   7.660
   57    H    ILE   7           H        ILE   7  15.018   5.998   4.366
   58    HA   ILE   7           HA       ILE   7  12.971   7.268   2.733
   59    HB   ILE   7           HB       ILE   7  12.877   6.577   5.680
   60   1HG1  ILE   7          1HG1      ILE   7  13.796   4.610   4.604
   61   2HG1  ILE   7          2HG1      ILE   7  12.091   4.305   4.915
   62   1HG2  ILE   7          1HG2      ILE   7  10.988   7.779   4.301
   63   2HG2  ILE   7          2HG2      ILE   7  10.683   6.156   3.681
   64   3HG2  ILE   7          3HG2      ILE   7  10.570   6.473   5.412
   65   1HD1  ILE   7          1HD1      ILE   7  11.564   4.950   2.575
   66   2HD1  ILE   7          2HD1      ILE   7  13.285   5.183   2.270
   67   3HD1  ILE   7          3HD1      ILE   7  12.667   3.576   2.649
   68    H    HIS   8           H        HIS   8  14.911   9.236   2.985
   69    HA   HIS   8           HA       HIS   8  13.690  11.097   4.987
   70   1HB   HIS   8          1HB       HIS   8  15.863  11.906   5.518
   71   2HB   HIS   8          2HB       HIS   8  16.040  10.157   5.443
   72    HD1  HIS   8           HD1      HIS   8  18.118   9.525   4.245
   73    HD2  HIS   8           HD2      HIS   8  16.458  12.996   2.642
   74    HE1  HIS   8           HE1      HIS   8  19.636  10.235   2.348
   75    H    LEU   9           H        LEU   9  14.299  13.485   4.327
   76    HA   LEU   9           HA       LEU   9  14.076  13.740   1.355
   77   1HB   LEU   9          1HB       LEU   9  12.680  15.905   2.361
   78   2HB   LEU   9          2HB       LEU   9  11.961  14.419   1.769
   79    HG   LEU   9           HG       LEU   9  12.150  13.491   4.117
   80   1HD1  LEU   9          1HD1      LEU   9  13.910  15.247   4.752
   81   2HD1  LEU   9          2HD1      LEU   9  12.568  16.380   4.892
   82   3HD1  LEU   9          3HD1      LEU   9  12.633  14.958   5.927
   83   1HD2  LEU   9          1HD2      LEU   9  10.057  14.470   3.163
   84   2HD2  LEU   9          2HD2      LEU   9  10.179  14.684   4.910
   85   3HD2  LEU   9          3HD2      LEU   9  10.526  16.034   3.829
   86    H    ASP  10           H        ASP  10  13.983  16.605   3.375
   87    HA   ASP  10           HA       ASP  10  16.787  17.192   2.497
   88   1HB   ASP  10          1HB       ASP  10  14.724  18.361   1.464
   89   2HB   ASP  10          2HB       ASP  10  14.609  19.214   3.005
   90    H    CYS  11           H        CYS  11  14.707  16.937   5.269
   91    HA   CYS  11           HA       CYS  11  16.936  17.986   6.934
   92   1HB   CYS  11          1HB       CYS  11  14.324  19.282   6.446
   93   2HB   CYS  11          2HB       CYS  11  14.837  19.240   8.132
   94    HG   CYS  11           HG       CYS  11  16.651  20.869   7.632
   95    HA   PRO  12           HA       PRO  12  14.084  15.861  10.062
   96   1HB   PRO  12          1HB       PRO  12  11.561  15.086   9.304
   97   2HB   PRO  12          2HB       PRO  12  11.927  16.671  10.013
   98   1HG   PRO  12          1HG       PRO  12  11.535  15.928   7.152
   99   2HG   PRO  12          2HG       PRO  12  10.975  17.356   8.034
  100   1HD   PRO  12          1HD       PRO  12  13.128  17.420   6.400
  101   2HD   PRO  12          2HD       PRO  12  12.996  18.435   7.853
  102    H    GLY  13           H        GLY  13  12.239  14.221   7.521
  103   1HA   GLY  13          2HA       GLY  13  14.136  11.922   7.766
  104   2HA   GLY  13          1HA       GLY  13  13.344  12.343   6.247
  105    H    ARG  14           H        ARG  14  10.761  12.770   6.963
  106    HA   ARG  14           HA       ARG  14   9.925  10.099   8.027
  107   1HB   ARG  14          1HB       ARG  14   9.788  12.233   9.568
  108   2HB   ARG  14          2HB       ARG  14   8.376  12.617   8.582
  109   1HG   ARG  14          1HG       ARG  14   7.582  10.224   9.072
  110   2HG   ARG  14          2HG       ARG  14   8.828  10.187  10.320
  111   1HD   ARG  14          1HD       ARG  14   7.122  11.040  11.618
  112   2HD   ARG  14          2HD       ARG  14   7.639  12.575  10.892
  113    HE   ARG  14           HE       ARG  14   5.933  11.644   8.990
  114   1HH1  ARG  14          1HH1      ARG  14   4.067  10.093  10.041
  115   2HH1  ARG  14          2HH1      ARG  14   3.069  11.033  11.098
  116   1HH2  ARG  14          1HH2      ARG  14   5.354  13.625  11.386
  117   2HH2  ARG  14          2HH2      ARG  14   3.797  13.033  11.861
  118    H    ILE  15           H        ILE  15   9.109   9.185   6.154
  119    HA   ILE  15           HA       ILE  15   7.740  10.770   4.111
  120    HB   ILE  15           HB       ILE  15   8.636   7.966   4.597
  121   1HG1  ILE  15          1HG1      ILE  15   8.660   9.759   2.150
  122   2HG1  ILE  15          2HG1      ILE  15   9.956   9.670   3.342
  123   1HG2  ILE  15          1HG2      ILE  15   6.250   8.688   2.919
  124   2HG2  ILE  15          2HG2      ILE  15   7.338   7.415   2.367
  125   3HG2  ILE  15          3HG2      ILE  15   6.517   7.261   3.920
  126   1HD1  ILE  15          1HD1      ILE  15   9.302   7.002   2.531
  127   2HD1  ILE  15          2HD1      ILE  15   9.537   7.981   1.085
  128   3HD1  ILE  15          3HD1      ILE  15  10.814   7.877   2.294
  129    HA   PRO  16           HA       PRO  16   3.795  10.377   6.141
  130   1HB   PRO  16          1HB       PRO  16   2.246  11.359   4.112
  131   2HB   PRO  16          2HB       PRO  16   3.227  12.396   5.166
  132   1HG   PRO  16          1HG       PRO  16   3.772  11.454   2.400
  133   2HG   PRO  16          2HG       PRO  16   4.122  13.019   3.151
  134   1HD   PRO  16          1HD       PRO  16   5.994  11.060   2.758
  135   2HD   PRO  16          2HD       PRO  16   6.103  12.299   4.029
  136    H    ASP  17           H        ASP  17   4.671   7.939   5.333
  137    HA   ASP  17           HA       ASP  17   3.236   6.696   3.177
  138   1HB   ASP  17          1HB       ASP  17   3.908   4.601   4.514
  139   2HB   ASP  17          2HB       ASP  17   5.220   5.671   4.026
  140    H    THR  18           H        THR  18   1.046   7.626   3.655
  141    HA   THR  18           HA       THR  18  -0.463   5.814   5.488
  142    HB   THR  18           HB       THR  18  -1.049   8.768   5.311
  143    HG1  THR  18           HG1      THR  18   1.004   8.808   6.025
  144   1HG2  THR  18          1HG2      THR  18  -1.681   6.479   7.152
  145   2HG2  THR  18          2HG2      THR  18  -1.745   8.136   7.753
  146   3HG2  THR  18          3HG2      THR  18  -2.779   7.643   6.411
  147    H    ILE  19           H        ILE  19  -1.280   4.752   3.591
  148    HA   ILE  19           HA       ILE  19  -2.571   6.312   1.474
  149    HB   ILE  19           HB       ILE  19  -1.294   4.176   1.165
  150   1HG1  ILE  19          1HG1      ILE  19  -2.949   3.133  -0.363
  151   2HG1  ILE  19          2HG1      ILE  19  -4.217   4.109   0.377
  152   1HG2  ILE  19          1HG2      ILE  19  -2.579   3.268   3.348
  153   2HG2  ILE  19          2HG2      ILE  19  -3.646   2.612   2.106
  154   3HG2  ILE  19          3HG2      ILE  19  -1.936   2.184   2.113
  155   1HD1  ILE  19          1HD1      ILE  19  -1.753   5.255  -0.969
  156   2HD1  ILE  19          2HD1      ILE  19  -3.329   5.105  -1.745
  157   3HD1  ILE  19          3HD1      ILE  19  -3.131   6.164  -0.350
  158    H    VAL  20           H        VAL  20  -4.640   7.074   1.668
  159    HA   VAL  20           HA       VAL  20  -6.552   5.548   3.404
  160    HB   VAL  20           HB       VAL  20  -6.269   8.541   2.968
  161   1HG1  VAL  20          1HG1      VAL  20  -8.586   7.425   3.487
  162   2HG1  VAL  20          2HG1      VAL  20  -7.918   7.223   5.107
  163   3HG1  VAL  20          3HG1      VAL  20  -8.080   8.836   4.413
  164   1HG2  VAL  20          1HG2      VAL  20  -5.623   6.798   5.370
  165   2HG2  VAL  20          2HG2      VAL  20  -4.440   7.578   4.321
  166   3HG2  VAL  20          3HG2      VAL  20  -5.511   8.557   5.323
  167    H    VAL  21           H        VAL  21  -8.547   5.131   2.469
  168    HA   VAL  21           HA       VAL  21  -9.175   6.471  -0.139
  169    HB   VAL  21           HB       VAL  21  -8.231   4.280  -0.576
  170   1HG1  VAL  21          1HG1      VAL  21 -10.013   3.502   1.701
  171   2HG1  VAL  21          2HG1      VAL  21  -9.684   2.302   0.450
  172   3HG1  VAL  21          3HG1      VAL  21  -8.353   3.013   1.362
  173   1HG2  VAL  21          1HG2      VAL  21 -10.276   4.976  -1.856
  174   2HG2  VAL  21          2HG2      VAL  21 -10.079   3.226  -1.745
  175   3HG2  VAL  21          3HG2      VAL  21 -11.249   4.049  -0.715
  176    H    VAL  22           H        VAL  22 -11.455   6.658  -0.560
  177    HA   VAL  22           HA       VAL  22 -13.120   6.699   1.888
  178    HB   VAL  22           HB       VAL  22 -13.603   7.581  -0.978
  179   1HG1  VAL  22          1HG1      VAL  22 -15.237   7.693   1.526
  180   2HG1  VAL  22          2HG1      VAL  22 -15.319   9.059   0.413
  181   3HG1  VAL  22          3HG1      VAL  22 -15.759   7.443  -0.140
  182   1HG2  VAL  22          1HG2      VAL  22 -11.769   8.676   0.578
  183   2HG2  VAL  22          2HG2      VAL  22 -12.859   9.702  -0.356
  184   3HG2  VAL  22          3HG2      VAL  22 -13.168   9.417   1.356
  185    H    ALA  23           H        ALA  23 -12.663   4.116   1.472
  186    HA   ALA  23           HA       ALA  23 -13.612   2.017   0.957
  187   1HB   ALA  23          2HB       ALA  23 -16.242   3.462   0.973
  188   2HB   ALA  23          3HB       ALA  23 -15.809   1.931   1.734
  189   3HB   ALA  23          1HB       ALA  23 -15.250   3.452   2.431
  190    H    GLY  24           H        GLY  24 -12.800   1.951  -1.273
  191   1HA   GLY  24          2HA       GLY  24 -14.905   1.585  -3.216
  192   2HA   GLY  24          1HA       GLY  24 -13.176   1.471  -3.542
  193    H    ASN  25           H        ASN  25 -12.214   3.951  -3.055
  194    HA   ASN  25           HA       ASN  25 -13.680   5.618  -5.059
  195   1HB   ASN  25          1HB       ASN  25 -14.294   6.280  -2.743
  196   2HB   ASN  25          2HB       ASN  25 -12.587   6.541  -2.382
  197   1HD2  ASN  25          2HD2      ASN  25 -11.485   8.335  -3.532
  198   2HD2  ASN  25          1HD2      ASN  25 -12.391   9.603  -4.203
  199    H    LYS  26           H        LYS  26 -12.228   7.401  -5.898
  200    HA   LYS  26           HA       LYS  26  -9.686   6.419  -6.752
  201   1HB   LYS  26          1HB       LYS  26 -11.078   9.091  -6.665
  202   2HB   LYS  26          2HB       LYS  26  -9.425   8.971  -7.271
  203   1HG   LYS  26          1HG       LYS  26 -10.043   7.719  -9.117
  204   2HG   LYS  26          2HG       LYS  26 -11.454   7.033  -8.310
  205   1HD   LYS  26          1HD       LYS  26 -12.795   8.818  -8.835
  206   2HD   LYS  26          2HD       LYS  26 -11.470   9.977  -8.730
  207   1HE   LYS  26          1HE       LYS  26 -10.735   9.536 -10.917
  208   2HE   LYS  26          2HE       LYS  26 -11.529   7.948 -10.961
  209   1HZ   LYS  26          1HZ       LYS  26 -13.000  10.510 -10.680
  210   2HZ   LYS  26          2HZ       LYS  26 -12.753   9.738 -12.172
  211   3HZ   LYS  26          3HZ       LYS  26 -13.658   8.970 -10.961
  212    H    LEU  27           H        LEU  27  -7.946   6.102  -5.413
  213    HA   LEU  27           HA       LEU  27  -7.512   8.071  -3.192
  214   1HB   LEU  27          1HB       LEU  27  -7.866   6.111  -2.057
  215   2HB   LEU  27          2HB       LEU  27  -7.461   5.116  -3.450
  216    HG   LEU  27           HG       LEU  27  -5.060   5.560  -3.068
  217   1HD1  LEU  27          1HD1      LEU  27  -6.154   7.604  -1.333
  218   2HD1  LEU  27          2HD1      LEU  27  -5.066   6.554  -0.424
  219   3HD1  LEU  27          3HD1      LEU  27  -4.489   7.382  -1.869
  220   1HD2  LEU  27          1HD2      LEU  27  -6.680   3.846  -1.696
  221   2HD2  LEU  27          2HD2      LEU  27  -4.925   3.874  -1.540
  222   3HD2  LEU  27          3HD2      LEU  27  -5.927   4.724  -0.364
  223    H    ARG  28           H        ARG  28  -5.506   9.056  -3.104
  224    HA   ARG  28           HA       ARG  28  -3.382   8.102  -4.995
  225   1HB   ARG  28          1HB       ARG  28  -4.888  10.609  -4.841
  226   2HB   ARG  28          2HB       ARG  28  -3.146  10.876  -4.796
  227   1HG   ARG  28          1HG       ARG  28  -2.839  10.133  -6.935
  228   2HG   ARG  28          2HG       ARG  28  -4.091   8.900  -6.795
  229   1HD   ARG  28          1HD       ARG  28  -5.097  11.684  -6.691
  230   2HD   ARG  28          2HD       ARG  28  -4.406  11.191  -8.250
  231    HE   ARG  28           HE       ARG  28  -6.155   9.165  -7.079
  232   1HH1  ARG  28          1HH1      ARG  28  -6.597   8.720  -9.626
  233   2HH1  ARG  28          2HH1      ARG  28  -7.761   9.852 -10.229
  234   1HH2  ARG  28          1HH2      ARG  28  -7.378  12.059  -7.581
  235   2HH2  ARG  28          2HH2      ARG  28  -8.203  11.742  -9.071
  236    H    LEU  29           H        LEU  29  -1.232   8.376  -4.204
  237    HA   LEU  29           HA       LEU  29  -0.868   9.643  -1.536
  238   1HB   LEU  29          1HB       LEU  29  -1.503   7.318  -1.117
  239   2HB   LEU  29          2HB       LEU  29  -0.275   6.756  -2.243
  240    HG   LEU  29           HG       LEU  29   1.473   7.789  -0.807
  241   1HD1  LEU  29          1HD1      LEU  29  -0.867   8.258   1.063
  242   2HD1  LEU  29          2HD1      LEU  29   0.830   8.513   1.468
  243   3HD1  LEU  29          3HD1      LEU  29   0.057   9.513   0.237
  244   1HD2  LEU  29          1HD2      LEU  29  -0.405   5.735   0.362
  245   2HD2  LEU  29          2HD2      LEU  29   1.144   5.466  -0.438
  246   3HD2  LEU  29          3HD2      LEU  29   1.095   6.184   1.171
  247    H    ASP  30           H        ASP  30   1.080  10.701  -1.484
  248    HA   ASP  30           HA       ASP  30   3.206   9.873  -3.431
  249   1HB   ASP  30          1HB       ASP  30   2.145  12.632  -2.745
  250   2HB   ASP  30          2HB       ASP  30   3.593  12.351  -3.713
  251    H    VAL  31           H        VAL  31   5.140   9.542  -2.406
  252    HA   VAL  31           HA       VAL  31   5.693  11.032   0.128
  253    HB   VAL  31           HB       VAL  31   6.647   8.824   0.965
  254   1HG1  VAL  31          1HG1      VAL  31   4.242   9.848   1.328
  255   2HG1  VAL  31          2HG1      VAL  31   3.733   8.466   0.358
  256   3HG1  VAL  31          3HG1      VAL  31   4.597   8.209   1.874
  257   1HG2  VAL  31          1HG2      VAL  31   6.307   8.032  -1.657
  258   2HG2  VAL  31          2HG2      VAL  31   6.544   6.937  -0.297
  259   3HG2  VAL  31          3HG2      VAL  31   4.914   7.301  -0.863
  260    HA   PRO  32           HA       PRO  32   9.461  11.587  -2.188
  261   1HB   PRO  32          1HB       PRO  32  10.706  13.241  -0.409
  262   2HB   PRO  32          2HB       PRO  32   9.405  13.786  -1.484
  263   1HG   PRO  32          1HG       PRO  32   9.337  13.185   1.408
  264   2HG   PRO  32          2HG       PRO  32   8.384  14.340   0.468
  265   1HD   PRO  32          1HD       PRO  32   7.514  11.846   1.369
  266   2HD   PRO  32          2HD       PRO  32   6.728  12.839   0.124
  267    H    ILE  33           H        ILE  33  11.598  10.759  -2.083
  268    HA   ILE  33           HA       ILE  33  12.527   9.544   0.471
  269    HB   ILE  33           HB       ILE  33  12.851   7.810  -1.904
  270   1HG1  ILE  33          1HG1      ILE  33  10.087   8.198  -0.699
  271   2HG1  ILE  33          2HG1      ILE  33  10.556   8.703  -2.319
  272   1HG2  ILE  33          1HG2      ILE  33  12.271   7.606   1.013
  273   2HG2  ILE  33          2HG2      ILE  33  11.757   6.265  -0.007
  274   3HG2  ILE  33          3HG2      ILE  33  13.457   6.737   0.041
  275   1HD1  ILE  33          1HD1      ILE  33  10.820   5.845  -1.365
  276   2HD1  ILE  33          2HD1      ILE  33   9.375   6.452  -2.176
  277   3HD1  ILE  33          3HD1      ILE  33  10.923   6.446  -3.020
  278    H    SER  34           H        SER  34  14.830   8.476  -0.102
  279    HA   SER  34           HA       SER  34  16.368  10.608  -1.496
  280   1HB   SER  34          1HB       SER  34  16.672   9.344   0.892
  281   2HB   SER  34          2HB       SER  34  17.691   8.328  -0.123
  282    HG   SER  34           HG       SER  34  19.105   9.867  -0.059
  283    H    GLY  35           H        GLY  35  18.606   8.592  -1.874
  284   1HA   GLY  35          2HA       GLY  35  17.530   6.762  -3.917
  285   2HA   GLY  35          1HA       GLY  35  19.208   6.846  -3.381
  286    H    ASP  36           H        ASP  36  20.005   6.967  -5.536
  287    HA   ASP  36           HA       ASP  36  19.136   9.226  -7.243
  288   1HB   ASP  36          1HB       ASP  36  20.968   9.770  -5.403
  289   2HB   ASP  36          2HB       ASP  36  22.047   8.998  -6.564
  290    HA   PRO  37           HA       PRO  37  18.928   9.672  -9.097
  291   1HB   PRO  37          1HB       PRO  37  17.418   8.706 -11.163
  292   2HB   PRO  37          2HB       PRO  37  19.017   9.439 -11.390
  293   1HG   PRO  37          1HG       PRO  37  18.237   6.577 -11.375
  294   2HG   PRO  37          2HG       PRO  37  19.459   7.412 -12.341
  295   1HD   PRO  37          1HD       PRO  37  20.018   5.873 -10.137
  296   2HD   PRO  37          2HD       PRO  37  21.068   7.167 -10.750
  297    H    ALA  38           H        ALA  38  17.365   6.488  -9.699
  298    HA   ALA  38           HA       ALA  38  15.299   7.250  -7.662
  299   1HB   ALA  38          2HB       ALA  38  14.864   5.309  -9.917
  300   2HB   ALA  38          1HB       ALA  38  14.822   7.043 -10.234
  301   3HB   ALA  38          3HB       ALA  38  13.685   6.328  -9.091
  302    HA   PRO  39           HA       PRO  39  16.715   3.508  -5.707
  303   1HB   PRO  39          1HB       PRO  39  15.033   3.604  -3.559
  304   2HB   PRO  39          2HB       PRO  39  16.462   4.648  -3.706
  305   1HG   PRO  39          1HG       PRO  39  13.608   5.299  -4.054
  306   2HG   PRO  39          2HG       PRO  39  14.949   6.327  -3.540
  307   1HD   PRO  39          1HD       PRO  39  13.772   6.267  -6.087
  308   2HD   PRO  39          2HD       PRO  39  15.297   7.063  -5.647
  309    H    THR  40           H        THR  40  15.212   1.701  -4.387
  310    HA   THR  40           HA       THR  40  13.090   0.902  -6.349
  311    HB   THR  40           HB       THR  40  14.245  -1.177  -4.619
  312    HG1  THR  40           HG1      THR  40  16.281  -0.989  -5.192
  313   1HG2  THR  40          1HG2      THR  40  12.889  -1.169  -6.924
  314   2HG2  THR  40          2HG2      THR  40  14.524  -1.144  -7.586
  315   3HG2  THR  40          3HG2      THR  40  14.024  -2.455  -6.517
  316    H    VAL  41           H        VAL  41  11.492   2.063  -5.067
  317    HA   VAL  41           HA       VAL  41  11.072   1.279  -2.260
  318    HB   VAL  41           HB       VAL  41  10.783   3.591  -3.066
  319   1HG1  VAL  41          1HG1      VAL  41   9.583   2.352  -5.274
  320   2HG1  VAL  41          2HG1      VAL  41   8.251   3.165  -4.454
  321   3HG1  VAL  41          3HG1      VAL  41   9.664   4.086  -4.965
  322   1HG2  VAL  41          1HG2      VAL  41   9.398   2.692  -1.174
  323   2HG2  VAL  41          2HG2      VAL  41   8.632   4.023  -2.036
  324   3HG2  VAL  41          3HG2      VAL  41   8.108   2.366  -2.332
  325    H    ILE  42           H        ILE  42  10.243  -0.777  -2.036
  326    HA   ILE  42           HA       ILE  42   8.188  -1.764  -3.941
  327    HB   ILE  42           HB       ILE  42   9.880  -2.985  -1.743
  328   1HG1  ILE  42          1HG1      ILE  42   9.931  -3.435  -4.738
  329   2HG1  ILE  42          2HG1      ILE  42  10.974  -2.276  -3.912
  330   1HG2  ILE  42          1HG2      ILE  42   7.733  -4.163  -3.497
  331   2HG2  ILE  42          2HG2      ILE  42   9.041  -5.160  -2.860
  332   3HG2  ILE  42          3HG2      ILE  42   7.947  -4.329  -1.754
  333   1HD1  ILE  42          1HD1      ILE  42  10.873  -5.079  -2.872
  334   2HD1  ILE  42          2HD1      ILE  42  11.790  -4.768  -4.346
  335   3HD1  ILE  42          3HD1      ILE  42  12.206  -3.926  -2.853
  336    H    TRP  43           H        TRP  43   6.150  -0.958  -3.266
  337    HA   TRP  43           HA       TRP  43   5.363  -0.617  -0.501
  338   1HB   TRP  43          1HB       TRP  43   3.848  -0.955  -3.115
  339   2HB   TRP  43          2HB       TRP  43   3.061  -0.547  -1.592
  340    HD1  TRP  43           HD1      TRP  43   4.743   0.980  -4.493
  341    HE1  TRP  43           HE1      TRP  43   5.180   3.487  -4.080
  342    HE3  TRP  43           HE3      TRP  43   3.783   1.240   0.526
  343    HZ2  TRP  43           HZ2      TRP  43   5.136   5.349  -1.916
  344    HZ3  TRP  43           HZ3      TRP  43   4.011   3.380   1.733
  345    HH2  TRP  43           HH2      TRP  43   4.676   5.442   0.522
  346    H    GLN  44           H        GLN  44   5.560  -2.522   0.756
  347    HA   GLN  44           HA       GLN  44   4.489  -5.067  -0.362
  348   1HB   GLN  44          1HB       GLN  44   6.736  -4.381   1.085
  349   2HB   GLN  44          2HB       GLN  44   5.673  -5.030   2.333
  350   1HG   GLN  44          1HG       GLN  44   5.301  -6.873   0.364
  351   2HG   GLN  44          2HG       GLN  44   6.973  -6.408   0.055
  352   1HE2  GLN  44          2HE2      GLN  44   7.050  -8.884   0.859
  353   2HE2  GLN  44          1HE2      GLN  44   7.341  -9.078   2.520
  354    H    LYS  45           H        LYS  45   3.205  -6.437   1.227
  355    HA   LYS  45           HA       LYS  45   1.103  -4.760   2.489
  356   1HB   LYS  45          1HB       LYS  45   1.337  -7.717   1.840
  357   2HB   LYS  45          2HB       LYS  45  -0.110  -6.947   2.490
  358   1HG   LYS  45          1HG       LYS  45   0.389  -5.310   0.383
  359   2HG   LYS  45          2HG       LYS  45   1.024  -6.831  -0.248
  360   1HD   LYS  45          1HD       LYS  45  -1.681  -6.720   1.081
  361   2HD   LYS  45          2HD       LYS  45  -1.494  -6.314  -0.626
  362   1HE   LYS  45          1HE       LYS  45  -1.721  -8.559  -0.984
  363   2HE   LYS  45          2HE       LYS  45  -0.049  -8.675  -0.399
  364   1HZ   LYS  45          1HZ       LYS  45  -2.420  -8.635   1.388
  365   2HZ   LYS  45          2HZ       LYS  45  -1.666 -10.066   0.867
  366   3HZ   LYS  45          3HZ       LYS  45  -0.810  -8.957   1.823
  367    H    ALA  46           H        ALA  46   0.428  -5.167   4.684
  368    HA   ALA  46           HA       ALA  46   2.351  -6.730   6.366
  369   1HB   ALA  46          1HB       ALA  46   2.843  -4.275   6.313
  370   2HB   ALA  46          2HB       ALA  46   1.223  -3.971   6.936
  371   3HB   ALA  46          3HB       ALA  46   2.397  -4.841   7.921
  372    H    ILE  47           H        ILE  47   1.375  -7.795   8.108
  373    HA   ILE  47           HA       ILE  47  -0.368  -8.820   9.319
  374    HB   ILE  47           HB       ILE  47  -1.439  -6.011   8.934
  375   1HG1  ILE  47          1HG1      ILE  47  -0.481  -5.991  11.415
  376   2HG1  ILE  47          2HG1      ILE  47   0.545  -7.280  10.784
  377   1HG2  ILE  47          1HG2      ILE  47  -2.345  -8.350  10.544
  378   2HG2  ILE  47          2HG2      ILE  47  -2.381  -6.775  11.338
  379   3HG2  ILE  47          3HG2      ILE  47  -3.290  -7.033   9.849
  380   1HD1  ILE  47          1HD1      ILE  47   0.281  -4.885   9.055
  381   2HD1  ILE  47          2HD1      ILE  47   1.164  -4.648  10.563
  382   3HD1  ILE  47          3HD1      ILE  47   1.701  -5.869   9.410
  383    H    THR  48           H        THR  48  -0.464  -8.795   6.280
  384    HA   THR  48           HA       THR  48  -3.400  -8.899   5.784
  385    HB   THR  48           HB       THR  48  -2.399  -9.306   3.393
  386    HG1  THR  48           HG1      THR  48  -0.310  -9.712   3.870
  387   1HG2  THR  48          1HG2      THR  48  -3.408  -7.168   4.438
  388   2HG2  THR  48          2HG2      THR  48  -1.736  -6.646   4.644
  389   3HG2  THR  48          3HG2      THR  48  -2.364  -6.975   3.029
  390    H    GLN  49           H        GLN  49  -0.484 -10.940   5.687
  391    HA   GLN  49           HA       GLN  49  -2.212 -13.337   5.211
  392   1HB   GLN  49          1HB       GLN  49   0.562 -12.479   4.559
  393   2HB   GLN  49          2HB       GLN  49   0.341 -14.193   4.913
  394   1HG   GLN  49          1HG       GLN  49  -0.160 -14.250   2.670
  395   2HG   GLN  49          2HG       GLN  49  -1.763 -13.839   3.281
  396   1HE2  GLN  49          1HE2      GLN  49   0.550 -12.875   1.036
  397   2HE2  GLN  49          2HE2      GLN  49   0.061 -11.263   0.833
  398    H    GLY  50           H        GLY  50  -2.145 -15.057   6.702
  399   1HA   GLY  50          2HA       GLY  50  -2.205 -15.317   9.192
  400   2HA   GLY  50          1HA       GLY  50  -0.637 -14.512   9.229
  401    H    ASN  51           H        ASN  51  -2.192 -17.515   9.133
  402    HA   ASN  51           HA       ASN  51   0.345 -18.879   8.285
  403   1HB   ASN  51          1HB       ASN  51  -0.114 -18.754  10.767
  404   2HB   ASN  51          2HB       ASN  51  -1.580 -19.695  10.484
  405   1HD2  ASN  51          2HD2      ASN  51  -1.336 -21.957   9.874
  406   2HD2  ASN  51          1HD2      ASN  51   0.152 -22.760  10.015
  407    H    LYS  52           H        LYS  52   0.049 -20.908   7.213
  408    HA   LYS  52           HA       LYS  52  -2.769 -21.596   6.456
  409   1HB   LYS  52          1HB       LYS  52  -2.040 -21.812   4.160
  410   2HB   LYS  52          2HB       LYS  52  -1.492 -20.242   4.742
  411   1HG   LYS  52          1HG       LYS  52   0.572 -22.030   5.416
  412   2HG   LYS  52          2HG       LYS  52   0.077 -22.494   3.789
  413   1HD   LYS  52          1HD       LYS  52   1.206 -20.734   2.961
  414   2HD   LYS  52          2HD       LYS  52   0.143 -19.648   3.857
  415   1HE   LYS  52          1HE       LYS  52   1.751 -20.385   5.885
  416   2HE   LYS  52          2HE       LYS  52   2.892 -20.584   4.539
  417   1HZ   LYS  52          1HZ       LYS  52   1.169 -18.191   4.851
  418   2HZ   LYS  52          2HZ       LYS  52   2.744 -18.273   5.483
  419   3HZ   LYS  52          3HZ       LYS  52   2.491 -18.390   3.808
  420    H    ALA  53           H        ALA  53  -2.014 -23.749   4.784
  421    HA   ALA  53           HA       ALA  53  -1.598 -25.850   6.725
  422   1HB   ALA  53          1HB       ALA  53  -2.702 -25.639   4.261
  423   2HB   ALA  53          2HB       ALA  53  -1.142 -26.338   3.827
  424   3HB   ALA  53          3HB       ALA  53  -2.204 -27.183   4.954
  425    HA   PRO  54           HA       PRO  54   2.783 -26.175   6.588
  426   1HB   PRO  54          1HB       PRO  54   3.148 -28.858   6.949
  427   2HB   PRO  54          2HB       PRO  54   2.587 -27.779   8.241
  428   1HG   PRO  54          1HG       PRO  54   1.063 -29.707   6.594
  429   2HG   PRO  54          2HG       PRO  54   0.807 -29.196   8.267
  430   1HD   PRO  54          1HD       PRO  54  -0.641 -28.311   6.064
  431   2HD   PRO  54          2HD       PRO  54  -0.579 -27.512   7.648
  432    H    ALA  55           H        ALA  55   4.619 -27.251   5.379
  433    HA   ALA  55           HA       ALA  55   5.625 -27.801   3.313
  434   1HB   ALA  55          1HB       ALA  55   4.100 -29.842   4.219
  435   2HB   ALA  55          3HB       ALA  55   5.026 -29.941   2.722
  436   3HB   ALA  55          2HB       ALA  55   3.308 -29.553   2.670
  437    H    ARG  56           H        ARG  56   4.879 -28.203   0.823
  438    HA   ARG  56           HA       ARG  56   2.734 -26.245   0.118
  439   1HB   ARG  56          1HB       ARG  56   4.389 -25.327  -1.583
  440   2HB   ARG  56          2HB       ARG  56   4.785 -24.992   0.101
  441   1HG   ARG  56          1HG       ARG  56   6.349 -26.894   0.127
  442   2HG   ARG  56          2HG       ARG  56   5.943 -27.261  -1.549
  443   1HD   ARG  56          1HD       ARG  56   7.785 -25.939  -1.968
  444   2HD   ARG  56          2HD       ARG  56   6.606 -24.626  -1.781
  445    HE   ARG  56           HE       ARG  56   7.255 -24.822   0.752
  446   1HH1  ARG  56          1HH1      ARG  56   9.097 -23.681  -1.670
  447   2HH1  ARG  56          2HH1      ARG  56  10.641 -24.013  -0.958
  448   1HH2  ARG  56          1HH2      ARG  56   9.347 -26.001   1.570
  449   2HH2  ARG  56          2HH2      ARG  56  10.782 -25.325   0.876
  450    HA   PRO  57           HA       PRO  57   2.646 -30.107  -2.428
  451   1HB   PRO  57          1HB       PRO  57   0.003 -30.672  -2.014
  452   2HB   PRO  57          2HB       PRO  57   1.292 -31.223  -0.925
  453   1HG   PRO  57          1HG       PRO  57  -0.631 -28.989  -0.602
  454   2HG   PRO  57          2HG       PRO  57   0.067 -30.067   0.615
  455   1HD   PRO  57          1HD       PRO  57   0.888 -27.472   0.143
  456   2HD   PRO  57          2HD       PRO  57   1.871 -28.717   0.941
  457    H    ALA  58           H        ALA  58   0.401 -30.541  -3.971
  458    HA   ALA  58           HA       ALA  58   0.540 -28.587  -6.017
  459   1HB   ALA  58          2HB       ALA  58  -1.754 -29.738  -6.599
  460   2HB   ALA  58          1HB       ALA  58  -1.372 -30.769  -5.219
  461   3HB   ALA  58          3HB       ALA  58  -0.279 -30.706  -6.602
  462    HA   PRO  59           HA       PRO  59  -2.062 -25.360  -4.526
  463   1HB   PRO  59          1HB       PRO  59  -2.953 -24.314  -6.892
  464   2HB   PRO  59          2HB       PRO  59  -1.297 -24.082  -6.296
  465   1HG   PRO  59          1HG       PRO  59  -2.319 -25.962  -8.361
  466   2HG   PRO  59          2HG       PRO  59  -0.802 -25.051  -8.314
  467   1HD   PRO  59          1HD       PRO  59  -1.001 -27.710  -7.705
  468   2HD   PRO  59          2HD       PRO  59   0.260 -26.636  -7.059
  469    H    ASP  60           H        ASP  60  -3.852 -26.338  -3.525
  470    HA   ASP  60           HA       ASP  60  -6.207 -26.903  -5.294
  471   1HB   ASP  60          1HB       ASP  60  -5.225 -28.442  -2.864
  472   2HB   ASP  60          2HB       ASP  60  -6.693 -28.808  -3.772
  473    H    ALA  61           H        ALA  61  -6.366 -24.471  -4.423
  474    HA   ALA  61           HA       ALA  61  -6.879 -23.629  -1.850
  475   1HB   ALA  61          3HB       ALA  61  -7.070 -22.103  -3.655
  476   2HB   ALA  61          1HB       ALA  61  -8.272 -23.099  -4.476
  477   3HB   ALA  61          2HB       ALA  61  -8.710 -22.213  -3.014
  478    HA   PRO  62           HA       PRO  62 -10.324 -26.469  -1.068
  479   1HB   PRO  62          1HB       PRO  62  -9.533 -27.187   1.445
  480   2HB   PRO  62          2HB       PRO  62  -8.867 -27.925  -0.018
  481   1HG   PRO  62          1HG       PRO  62  -7.607 -26.092   1.867
  482   2HG   PRO  62          2HG       PRO  62  -6.869 -27.137   0.648
  483   1HD   PRO  62          1HD       PRO  62  -7.405 -24.302   0.507
  484   2HD   PRO  62          2HD       PRO  62  -6.541 -25.328  -0.658
  485    H    GLU  63           H        GLU  63 -11.993 -26.419   0.761
  486    HA   GLU  63           HA       GLU  63 -12.101 -23.716   2.061
  487   1HB   GLU  63          1HB       GLU  63 -14.554 -23.826   1.586
  488   2HB   GLU  63          2HB       GLU  63 -13.581 -23.853   0.114
  489   1HG   GLU  63          1HG       GLU  63 -13.808 -26.275  -0.044
  490   2HG   GLU  63          2HG       GLU  63 -14.666 -26.326   1.495
  491    H    ASP  64           H        ASP  64 -13.047 -23.685   4.160
  492    HA   ASP  64           HA       ASP  64 -13.435 -26.386   5.411
  493   1HB   ASP  64          1HB       ASP  64 -12.321 -23.762   6.448
  494   2HB   ASP  64          2HB       ASP  64 -12.644 -25.153   7.483
  495    H    THR  65           H        THR  65 -15.748 -26.387   5.077
  496    HA   THR  65           HA       THR  65 -17.213 -24.479   6.859
  497    HB   THR  65           HB       THR  65 -18.964 -24.465   4.990
  498    HG1  THR  65           HG1      THR  65 -17.982 -26.312   3.940
  499   1HG2  THR  65          1HG2      THR  65 -16.526 -22.999   5.290
  500   2HG2  THR  65          2HG2      THR  65 -16.840 -23.201   3.567
  501   3HG2  THR  65          3HG2      THR  65 -18.053 -22.449   4.602
  502    H    GLY  66           H        GLY  66 -16.477 -27.173   7.493
  503   1HA   GLY  66          2HA       GLY  66 -19.186 -28.373   7.708
  504   2HA   GLY  66          1HA       GLY  66 -17.796 -28.795   8.710
  505    H    ASP  67           H        ASP  67 -18.254 -28.630   5.164
  506    HA   ASP  67           HA       ASP  67 -16.730 -31.090   4.768
  507   1HB   ASP  67          1HB       ASP  67 -19.310 -31.424   5.592
  508   2HB   ASP  67          2HB       ASP  67 -19.531 -31.391   3.843
  509    H    SER  68           H        SER  68 -16.935 -31.753   2.352
  510    HA   SER  68           HA       SER  68 -16.520 -29.411   0.698
  511   1HB   SER  68          1HB       SER  68 -16.731 -32.391   0.255
  512   2HB   SER  68          2HB       SER  68 -16.472 -31.281  -1.088
  513    HG   SER  68           HG       SER  68 -14.478 -31.909  -0.332
  514    H    ASP  69           H        ASP  69 -18.425 -28.174   0.508
  515    HA   ASP  69           HA       ASP  69 -21.052 -29.278   0.071
  516   1HB   ASP  69          1HB       ASP  69 -21.569 -26.898  -0.493
  517   2HB   ASP  69          2HB       ASP  69 -20.635 -27.047   0.995
  518    H    GLU  70           H        GLU  70 -22.074 -27.935  -2.118
  519    HA   GLU  70           HA       GLU  70 -21.019 -29.545  -4.350
  520   1HB   GLU  70          1HB       GLU  70 -23.054 -28.668  -5.470
  521   2HB   GLU  70          2HB       GLU  70 -23.432 -29.340  -3.885
  522   1HG   GLU  70          1HG       GLU  70 -22.716 -26.515  -3.717
  523   2HG   GLU  70          2HG       GLU  70 -24.093 -26.780  -4.786
  524    H    TRP  71           H        TRP  71 -21.514 -27.921  -6.527
  525    HA   TRP  71           HA       TRP  71 -19.339 -25.886  -6.289
  526   1HB   TRP  71          1HB       TRP  71 -19.215 -27.800  -7.917
  527   2HB   TRP  71          2HB       TRP  71 -20.639 -27.140  -8.725
  528    HD1  TRP  71           HD1      TRP  71 -20.257 -25.308 -10.445
  529    HE1  TRP  71           HE1      TRP  71 -18.231 -23.899 -11.196
  530    HE3  TRP  71           HE3      TRP  71 -16.881 -26.675  -6.881
  531    HZ2  TRP  71           HZ2      TRP  71 -15.535 -23.421 -10.379
  532    HZ3  TRP  71           HZ3      TRP  71 -14.593 -25.728  -6.883
  533    HH2  TRP  71           HH2      TRP  71 -13.912 -24.102  -8.629
  534    H    VAL  72           H        VAL  72 -19.860 -23.731  -6.475
  535    HA   VAL  72           HA       VAL  72 -22.641 -23.047  -7.356
  536    HB   VAL  72           HB       VAL  72 -20.706 -21.704  -5.440
  537   1HG1  VAL  72          1HG1      VAL  72 -23.299 -20.839  -6.655
  538   2HG1  VAL  72          2HG1      VAL  72 -23.009 -20.446  -4.961
  539   3HG1  VAL  72          3HG1      VAL  72 -21.896 -19.871  -6.202
  540   1HG2  VAL  72          1HG2      VAL  72 -23.119 -23.469  -5.156
  541   2HG2  VAL  72          2HG2      VAL  72 -21.602 -23.501  -4.256
  542   3HG2  VAL  72          3HG2      VAL  72 -22.799 -22.250  -3.923
  543    H    PHE  73           H        PHE  73 -20.186 -20.600  -6.920
  544    HA   PHE  73           HA       PHE  73 -19.256 -20.489  -9.660
  545   1HB   PHE  73          1HB       PHE  73 -21.713 -19.917  -9.824
  546   2HB   PHE  73          2HB       PHE  73 -21.389 -18.498  -8.829
  547    HD1  PHE  73           HD1      PHE  73 -21.077 -16.507  -9.982
  548    HD2  PHE  73           HD2      PHE  73 -19.855 -20.195 -11.813
  549    HE1  PHE  73           HE1      PHE  73 -20.333 -15.262 -11.993
  550    HE2  PHE  73           HE2      PHE  73 -19.111 -18.950 -13.825
  551    HZ   PHE  73           HZ       PHE  73 -19.349 -16.484 -13.915
  552    H    ASP  74           H        ASP  74 -20.285 -18.030  -7.259
  553    HA   ASP  74           HA       ASP  74 -17.690 -16.661  -7.487
  554   1HB   ASP  74          1HB       ASP  74 -20.193 -15.801  -7.156
  555   2HB   ASP  74          2HB       ASP  74 -19.784 -16.000  -5.451
  556    H    LYS  75           H        LYS  75 -15.975 -17.225  -6.215
  557    HA   LYS  75           HA       LYS  75 -16.285 -17.785  -3.370
  558   1HB   LYS  75          1HB       LYS  75 -16.728 -19.885  -5.134
  559   2HB   LYS  75          2HB       LYS  75 -15.042 -20.106  -4.668
  560   1HG   LYS  75          1HG       LYS  75 -15.571 -20.633  -2.515
  561   2HG   LYS  75          2HG       LYS  75 -16.872 -19.446  -2.441
  562   1HD   LYS  75          1HD       LYS  75 -17.892 -21.236  -4.243
  563   2HD   LYS  75          2HD       LYS  75 -16.972 -22.302  -3.182
  564   1HE   LYS  75          1HE       LYS  75 -18.831 -20.207  -2.040
  565   2HE   LYS  75          2HE       LYS  75 -19.422 -21.816  -2.501
  566   1HZ   LYS  75          1HZ       LYS  75 -17.517 -22.736  -1.194
  567   2HZ   LYS  75          2HZ       LYS  75 -17.246 -21.171  -0.589
  568   3HZ   LYS  75          3HZ       LYS  75 -18.708 -21.972  -0.258
  569    H    LYS  76           H        LYS  76 -14.708 -16.049  -5.220
  570    HA   LYS  76           HA       LYS  76 -12.054 -16.533  -4.016
  571   1HB   LYS  76          1HB       LYS  76 -12.562 -17.772  -6.345
  572   2HB   LYS  76          2HB       LYS  76 -12.100 -16.193  -6.983
  573   1HG   LYS  76          1HG       LYS  76  -9.924 -16.384  -6.271
  574   2HG   LYS  76          2HG       LYS  76 -10.361 -17.347  -4.858
  575   1HD   LYS  76          1HD       LYS  76  -9.206 -18.822  -6.357
  576   2HD   LYS  76          2HD       LYS  76 -10.917 -19.240  -6.458
  577   1HE   LYS  76          1HE       LYS  76 -11.097 -18.507  -8.624
  578   2HE   LYS  76          2HE       LYS  76  -9.988 -17.147  -8.358
  579   1HZ   LYS  76          1HZ       LYS  76  -9.138 -19.991  -8.394
  580   2HZ   LYS  76          2HZ       LYS  76  -9.035 -18.964  -9.744
  581   3HZ   LYS  76          3HZ       LYS  76  -8.135 -18.620  -8.348
  582    H    LEU  77           H        LEU  77 -11.892 -14.480  -3.129
  583    HA   LEU  77           HA       LEU  77 -12.671 -12.114  -4.751
  584   1HB   LEU  77          1HB       LEU  77 -12.860 -12.865  -2.069
  585   2HB   LEU  77          2HB       LEU  77 -11.557 -11.676  -2.080
  586    HG   LEU  77           HG       LEU  77 -14.220 -11.207  -3.439
  587   1HD1  LEU  77          1HD1      LEU  77 -14.500 -11.548  -0.981
  588   2HD1  LEU  77          2HD1      LEU  77 -13.321 -10.268  -0.698
  589   3HD1  LEU  77          3HD1      LEU  77 -14.856  -9.895  -1.480
  590   1HD2  LEU  77          1HD2      LEU  77 -11.844  -9.487  -2.689
  591   2HD2  LEU  77          2HD2      LEU  77 -12.518  -9.761  -4.296
  592   3HD2  LEU  77          3HD2      LEU  77 -13.411  -8.799  -3.117
  593    H    LEU  78           H        LEU  78 -10.466 -13.298  -5.887
  594    HA   LEU  78           HA       LEU  78  -7.900 -12.578  -4.892
  595   1HB   LEU  78          1HB       LEU  78  -9.124 -13.113  -7.590
  596   2HB   LEU  78          2HB       LEU  78  -7.432 -12.631  -7.476
  597    HG   LEU  78           HG       LEU  78  -8.550 -14.886  -5.809
  598   1HD1  LEU  78          1HD1      LEU  78  -8.697 -15.040  -8.476
  599   2HD1  LEU  78          2HD1      LEU  78  -6.990 -15.441  -8.295
  600   3HD1  LEU  78          3HD1      LEU  78  -8.217 -16.425  -7.497
  601   1HD2  LEU  78          1HD2      LEU  78  -5.804 -13.942  -6.659
  602   2HD2  LEU  78          2HD2      LEU  78  -6.433 -14.120  -5.021
  603   3HD2  LEU  78          3HD2      LEU  78  -6.075 -15.551  -5.988
  604    H    CYS  79           H        CYS  79  -6.734 -10.661  -4.984
  605    HA   CYS  79           HA       CYS  79  -8.050  -8.151  -5.275
  606   1HB   CYS  79          1HB       CYS  79  -5.711  -7.278  -5.215
  607   2HB   CYS  79          2HB       CYS  79  -5.991  -8.514  -3.989
  608    HG   CYS  79           HG       CYS  79  -4.888 -10.211  -5.872
  609    H    GLU  80           H        GLU  80  -8.468  -6.908  -7.067
  610    HA   GLU  80           HA       GLU  80  -7.830  -7.976  -9.732
  611   1HB   GLU  80          1HB       GLU  80  -9.882  -6.536  -8.575
  612   2HB   GLU  80          2HB       GLU  80  -9.015  -5.288  -9.470
  613   1HG   GLU  80          1HG       GLU  80 -10.614  -6.189 -11.001
  614   2HG   GLU  80          2HG       GLU  80  -9.060  -6.881 -11.467
  615    H    THR  81           H        THR  81  -7.323  -5.803 -11.277
  616    HA   THR  81           HA       THR  81  -5.455  -3.887 -10.282
  617    HB   THR  81           HB       THR  81  -3.976  -5.649  -9.763
  618    HG1  THR  81           HG1      THR  81  -2.343  -5.420 -11.337
  619   1HG2  THR  81          1HG2      THR  81  -5.220  -6.913 -12.132
  620   2HG2  THR  81          2HG2      THR  81  -3.505  -7.257 -11.914
  621   3HG2  THR  81          3HG2      THR  81  -4.652  -7.648 -10.632
  622    H    GLU  82           H        GLU  82  -6.637  -5.812 -12.980
  623    HA   GLU  82           HA       GLU  82  -5.475  -4.299 -15.126
  624   1HB   GLU  82          1HB       GLU  82  -6.559  -6.538 -15.291
  625   2HB   GLU  82          2HB       GLU  82  -8.118  -5.791 -14.943
  626   1HG   GLU  82          1HG       GLU  82  -8.135  -4.598 -16.983
  627   2HG   GLU  82          2HG       GLU  82  -6.405  -4.836 -17.236
  628    H    GLY  83           H        GLY  83  -5.784  -2.107 -14.053
  629   1HA   GLY  83          2HA       GLY  83  -8.374  -0.934 -14.922
  630   2HA   GLY  83          1HA       GLY  83  -6.887  -0.027 -14.633
  631    H    ARG  84           H        ARG  84  -6.965  -2.132 -12.128
  632    HA   ARG  84           HA       ARG  84  -8.817  -0.501 -10.445
  633   1HB   ARG  84          1HB       ARG  84  -7.667  -3.279 -10.377
  634   2HB   ARG  84          2HB       ARG  84  -8.285  -2.556  -8.893
  635   1HG   ARG  84          1HG       ARG  84 -10.038  -2.278 -11.266
  636   2HG   ARG  84          2HG       ARG  84  -9.843  -3.921 -10.656
  637   1HD   ARG  84          1HD       ARG  84 -10.903  -3.450  -8.655
  638   2HD   ARG  84          2HD       ARG  84 -10.363  -1.759  -8.651
  639    HE   ARG  84           HE       ARG  84 -12.544  -2.813 -10.412
  640   1HH1  ARG  84          1HH1      ARG  84 -12.114  -0.552 -11.804
  641   2HH1  ARG  84          2HH1      ARG  84 -12.718   0.782 -10.879
  642   1HH2  ARG  84          1HH2      ARG  84 -12.792  -0.982  -7.893
  643   2HH2  ARG  84          2HH2      ARG  84 -13.102   0.539  -8.664
  644    H    VAL  85           H        VAL  85  -5.909  -2.345  -9.493
  645    HA   VAL  85           HA       VAL  85  -5.061  -0.108  -7.781
  646    HB   VAL  85           HB       VAL  85  -5.004  -2.462  -7.048
  647   1HG1  VAL  85          1HG1      VAL  85  -3.922  -2.872  -9.645
  648   2HG1  VAL  85          2HG1      VAL  85  -2.682  -3.354  -8.489
  649   3HG1  VAL  85          3HG1      VAL  85  -4.282  -4.090  -8.422
  650   1HG2  VAL  85          1HG2      VAL  85  -2.314  -1.107  -7.372
  651   2HG2  VAL  85          2HG2      VAL  85  -3.402  -1.005  -5.989
  652   3HG2  VAL  85          3HG2      VAL  85  -2.570  -2.518  -6.347
  653    H    ARG  86           H        ARG  86  -3.429   1.317  -8.253
  654    HA   ARG  86           HA       ARG  86  -1.653   0.730 -10.595
  655   1HB   ARG  86          1HB       ARG  86  -3.773   2.407 -10.707
  656   2HB   ARG  86          2HB       ARG  86  -2.554   3.524 -10.092
  657   1HG   ARG  86          1HG       ARG  86  -1.730   1.770 -12.350
  658   2HG   ARG  86          2HG       ARG  86  -2.882   3.052 -12.725
  659   1HD   ARG  86          1HD       ARG  86  -0.531   3.801 -11.038
  660   2HD   ARG  86          2HD       ARG  86  -0.241   3.512 -12.765
  661    HE   ARG  86           HE       ARG  86  -1.775   5.725 -11.654
  662   1HH1  ARG  86          1HH1      ARG  86  -3.907   4.719 -13.263
  663   2HH1  ARG  86          2HH1      ARG  86  -3.546   5.261 -14.868
  664   1HH2  ARG  86          1HH2      ARG  86  -0.214   5.930 -14.177
  665   2HH2  ARG  86          2HH2      ARG  86  -1.454   5.946 -15.386
  666    H    VAL  87           H        VAL  87   0.138   0.301  -9.199
  667    HA   VAL  87           HA       VAL  87   1.001   2.581  -7.449
  668    HB   VAL  87           HB       VAL  87   1.616  -0.393  -7.350
  669   1HG1  VAL  87          1HG1      VAL  87   2.378   1.916  -5.540
  670   2HG1  VAL  87          2HG1      VAL  87   2.522   0.223  -5.070
  671   3HG1  VAL  87          3HG1      VAL  87   3.469   0.847  -6.420
  672   1HG2  VAL  87          1HG2      VAL  87  -0.296   1.398  -5.843
  673   2HG2  VAL  87          2HG2      VAL  87  -0.644  -0.115  -6.679
  674   3HG2  VAL  87          3HG2      VAL  87   0.263  -0.131  -5.167
  675    H    GLU  88           H        GLU  88   2.624   3.730  -8.420
  676    HA   GLU  88           HA       GLU  88   4.857   2.238  -9.712
  677   1HB   GLU  88          1HB       GLU  88   2.947   3.040 -11.302
  678   2HB   GLU  88          2HB       GLU  88   3.616   4.650 -11.029
  679   1HG   GLU  88          1HG       GLU  88   5.902   3.530 -11.615
  680   2HG   GLU  88          2HG       GLU  88   4.906   2.270 -12.345
  681    H    THR  89           H        THR  89   6.840   3.254  -9.365
  682    HA   THR  89           HA       THR  89   6.798   5.711  -7.679
  683    HB   THR  89           HB       THR  89   7.948   3.578  -6.974
  684    HG1  THR  89           HG1      THR  89   9.647   5.802  -7.431
  685   1HG2  THR  89          1HG2      THR  89   8.817   3.479  -9.562
  686   2HG2  THR  89          2HG2      THR  89  10.238   4.137  -8.751
  687   3HG2  THR  89          3HG2      THR  89   9.566   2.592  -8.233
  688    H    THR  90           H        THR  90   8.277   7.463  -8.198
  689    HA   THR  90           HA       THR  90   8.751   7.734 -11.133
  690    HB   THR  90           HB       THR  90   8.902  10.169 -10.493
  691    HG1  THR  90           HG1      THR  90   9.453  10.226  -8.426
  692   1HG2  THR  90          1HG2      THR  90   6.741   8.807 -11.052
  693   2HG2  THR  90          2HG2      THR  90   6.377   9.021  -9.340
  694   3HG2  THR  90          3HG2      THR  90   6.582  10.429 -10.382
  695    H    LYS  91           H        LYS  91  10.709   9.573 -11.262
  696    HA   LYS  91           HA       LYS  91  13.136   8.165 -10.953
  697   1HB   LYS  91          1HB       LYS  91  12.221  10.933 -11.489
  698   2HB   LYS  91          2HB       LYS  91  13.894  10.780 -10.951
  699   1HG   LYS  91          1HG       LYS  91  12.946   8.878 -13.047
  700   2HG   LYS  91          2HG       LYS  91  13.224  10.550 -13.532
  701   1HD   LYS  91          1HD       LYS  91  15.422  10.083 -13.665
  702   2HD   LYS  91          2HD       LYS  91  15.429   9.864 -11.915
  703   1HE   LYS  91          1HE       LYS  91  16.209   7.772 -12.606
  704   2HE   LYS  91          2HE       LYS  91  14.462   7.457 -12.575
  705   1HZ   LYS  91          1HZ       LYS  91  14.376   8.211 -14.909
  706   2HZ   LYS  91          2HZ       LYS  91  16.068   8.321 -14.921
  707   3HZ   LYS  91          3HZ       LYS  91  15.318   6.811 -14.708
  708    H    ASP  92           H        ASP  92  11.463  10.282  -8.646
  709    HA   ASP  92           HA       ASP  92  13.308   9.353  -6.524
  710   1HB   ASP  92          1HB       ASP  92  13.724  11.745  -7.950
  711   2HB   ASP  92          2HB       ASP  92  13.036  12.243  -6.405
  712    H    ARG  93           H        ARG  93  10.542   8.810  -6.804
  713    HA   ARG  93           HA       ARG  93   9.528   9.711  -4.255
  714   1HB   ARG  93          1HB       ARG  93   9.359  11.796  -5.641
  715   2HB   ARG  93          2HB       ARG  93   8.276  10.938  -6.734
  716   1HG   ARG  93          1HG       ARG  93   6.531  10.961  -5.248
  717   2HG   ARG  93          2HG       ARG  93   7.591  10.836  -3.843
  718   1HD   ARG  93          1HD       ARG  93   6.547  13.066  -3.894
  719   2HD   ARG  93          2HD       ARG  93   8.285  13.224  -4.222
  720    HE   ARG  93           HE       ARG  93   7.722  13.342  -6.644
  721   1HH1  ARG  93          1HH1      ARG  93   5.998  15.191  -4.605
  722   2HH1  ARG  93          2HH1      ARG  93   4.563  15.318  -5.567
  723   1HH2  ARG  93          1HH2      ARG  93   5.515  12.833  -7.790
  724   2HH2  ARG  93          2HH2      ARG  93   4.289  13.981  -7.370
  725    H    SER  94           H        SER  94   8.616   7.747  -3.761
  726    HA   SER  94           HA       SER  94   7.337   6.044  -5.756
  727   1HB   SER  94          1HB       SER  94   7.026   4.584  -3.840
  728   2HB   SER  94          2HB       SER  94   8.620   5.320  -3.710
  729    HG   SER  94           HG       SER  94   7.148   5.337  -1.793
  730    H    ILE  95           H        ILE  95   5.233   6.278  -6.422
  731    HA   ILE  95           HA       ILE  95   3.374   7.811  -4.640
  732    HB   ILE  95           HB       ILE  95   4.143   8.009  -7.405
  733   1HG1  ILE  95          1HG1      ILE  95   2.321   9.929  -7.138
  734   2HG1  ILE  95          2HG1      ILE  95   2.450   9.487  -5.435
  735   1HG2  ILE  95          1HG2      ILE  95   1.204   7.407  -6.940
  736   2HG2  ILE  95          2HG2      ILE  95   1.847   8.149  -8.405
  737   3HG2  ILE  95          3HG2      ILE  95   2.313   6.505  -7.973
  738   1HD1  ILE  95          1HD1      ILE  95   5.029   9.771  -6.866
  739   2HD1  ILE  95          2HD1      ILE  95   4.114  11.264  -6.655
  740   3HD1  ILE  95          3HD1      ILE  95   4.575  10.306  -5.248
  741    H    PHE  96           H        PHE  96   1.689   6.689  -3.810
  742    HA   PHE  96           HA       PHE  96   0.997   4.037  -5.023
  743   1HB   PHE  96          1HB       PHE  96   1.860   4.138  -2.663
  744   2HB   PHE  96          2HB       PHE  96   0.477   5.143  -2.241
  745    HD1  PHE  96           HD1      PHE  96  -1.881   4.200  -2.763
  746    HD2  PHE  96           HD2      PHE  96   1.676   1.803  -2.621
  747    HE1  PHE  96           HE1      PHE  96  -3.266   2.167  -2.460
  748    HE2  PHE  96           HE2      PHE  96   0.290  -0.235  -2.323
  749    HZ   PHE  96           HZ       PHE  96  -2.185  -0.049  -2.244
  750    H    THR  97           H        THR  97  -0.560   4.753  -6.547
  751    HA   THR  97           HA       THR  97  -2.921   6.191  -5.385
  752    HB   THR  97           HB       THR  97  -1.902   7.700  -6.874
  753    HG1  THR  97           HG1      THR  97  -3.351   7.838  -8.509
  754   1HG2  THR  97          1HG2      THR  97  -1.393   5.320  -8.678
  755   2HG2  THR  97          2HG2      THR  97  -1.072   6.993  -9.136
  756   3HG2  THR  97          3HG2      THR  97  -0.189   6.261  -7.797
  757    H    VAL  98           H        VAL  98  -4.329   4.510  -5.026
  758    HA   VAL  98           HA       VAL  98  -4.933   2.690  -7.334
  759    HB   VAL  98           HB       VAL  98  -3.934   1.574  -5.381
  760   1HG1  VAL  98          1HG1      VAL  98  -6.218   2.885  -3.881
  761   2HG1  VAL  98          2HG1      VAL  98  -5.203   1.608  -3.211
  762   3HG1  VAL  98          3HG1      VAL  98  -4.493   3.163  -3.640
  763   1HG2  VAL  98          1HG2      VAL  98  -6.338   0.880  -6.608
  764   2HG2  VAL  98          2HG2      VAL  98  -5.343  -0.182  -5.609
  765   3HG2  VAL  98          3HG2      VAL  98  -6.685   0.707  -4.888
  766    H    GLU  99           H        GLU  99  -7.167   2.401  -7.827
  767    HA   GLU  99           HA       GLU  99  -8.971   4.459  -6.624
  768   1HB   GLU  99          1HB       GLU  99  -8.402   4.303  -9.117
  769   2HB   GLU  99          2HB       GLU  99  -9.358   2.821  -9.139
  770   1HG   GLU  99          1HG       GLU  99 -10.699   5.082  -7.809
  771   2HG   GLU  99          2HG       GLU  99 -10.378   5.351  -9.523
  772    H    GLY 100           H        GLY 100  -9.019   2.672  -4.759
  773   1HA   GLY 100          2HA       GLY 100 -11.249   0.791  -5.415
  774   2HA   GLY 100          1HA       GLY 100 -11.130   1.637  -3.873
  775    H    ALA 101           H        ALA 101  -8.417   1.295  -3.292
  776    HA   ALA 101           HA       ALA 101  -7.297  -1.268  -3.651
  777   1HB   ALA 101          3HB       ALA 101  -5.788  -0.076  -2.454
  778   2HB   ALA 101          1HB       ALA 101  -7.037   1.032  -1.884
  779   3HB   ALA 101          2HB       ALA 101  -6.725  -0.471  -1.016
  780    H    GLU 102           H        GLU 102  -8.593  -0.454  -0.450
  781    HA   GLU 102           HA       GLU 102 -10.306  -2.904  -0.534
  782   1HB   GLU 102          1HB       GLU 102  -7.832  -2.584   0.812
  783   2HB   GLU 102          2HB       GLU 102  -9.083  -2.526   2.052
  784   1HG   GLU 102          1HG       GLU 102  -8.745  -4.697  -0.036
  785   2HG   GLU 102          2HG       GLU 102  -8.393  -4.847   1.685
  786    H    LYS 103           H        LYS 103 -12.282  -2.602   0.519
  787    HA   LYS 103           HA       LYS 103 -12.800   0.135   1.563
  788   1HB   LYS 103          1HB       LYS 103 -14.573  -2.198   0.789
  789   2HB   LYS 103          2HB       LYS 103 -15.173  -0.626   1.313
  790   1HG   LYS 103          1HG       LYS 103 -15.089  -0.048  -0.875
  791   2HG   LYS 103          2HG       LYS 103 -13.343   0.051  -0.648
  792   1HD   LYS 103          1HD       LYS 103 -13.254  -2.437  -1.186
  793   2HD   LYS 103          2HD       LYS 103 -14.941  -2.301  -1.686
  794   1HE   LYS 103          1HE       LYS 103 -12.963  -0.340  -2.806
  795   2HE   LYS 103          2HE       LYS 103 -13.014  -1.983  -3.476
  796   1HZ   LYS 103          1HZ       LYS 103 -15.436  -0.324  -3.039
  797   2HZ   LYS 103          2HZ       LYS 103 -14.613  -0.381  -4.520
  798   3HZ   LYS 103          3HZ       LYS 103 -15.326  -1.790  -3.891
  799    H    GLU 104           H        GLU 104 -13.892  -3.142   2.517
  800    HA   GLU 104           HA       GLU 104 -14.102  -2.215   5.330
  801   1HB   GLU 104          1HB       GLU 104 -15.015  -4.682   3.825
  802   2HB   GLU 104          2HB       GLU 104 -15.347  -4.390   5.532
  803   1HG   GLU 104          1HG       GLU 104 -16.182  -2.033   4.502
  804   2HG   GLU 104          2HG       GLU 104 -16.512  -3.089   3.128
  805    H    ASP 105           H        ASP 105 -11.719  -3.716   3.475
  806    HA   ASP 105           HA       ASP 105 -10.762  -5.282   5.854
  807   1HB   ASP 105          1HB       ASP 105 -11.395  -6.113   3.289
  808   2HB   ASP 105          2HB       ASP 105  -9.639  -5.956   3.229
  809    H    GLU 106           H        GLU 106 -10.065  -2.585   3.880
  810    HA   GLU 106           HA       GLU 106  -7.966  -1.548   3.309
  811   1HB   GLU 106          1HB       GLU 106  -7.210  -0.577   5.505
  812   2HB   GLU 106          2HB       GLU 106  -8.934  -0.460   5.221
  813   1HG   GLU 106          1HG       GLU 106  -7.918  -2.871   6.661
  814   2HG   GLU 106          2HG       GLU 106  -7.992  -1.343   7.537
  815    H    GLY 107           H        GLY 107  -6.085  -2.041   5.961
  816   1HA   GLY 107          2HA       GLY 107  -4.597  -4.273   4.632
  817   2HA   GLY 107          1HA       GLY 107  -4.711  -4.138   6.388
  818    H    VAL 108           H        VAL 108  -2.559  -3.746   6.898
  819    HA   VAL 108           HA       VAL 108  -1.500  -1.084   6.221
  820    HB   VAL 108           HB       VAL 108  -0.520  -3.393   7.930
  821   1HG1  VAL 108          1HG1      VAL 108   0.504  -0.547   7.684
  822   2HG1  VAL 108          2HG1      VAL 108   1.022  -1.704   8.911
  823   3HG1  VAL 108          3HG1      VAL 108   1.371  -2.008   7.209
  824   1HG2  VAL 108          1HG2      VAL 108  -2.126  -0.895   8.413
  825   2HG2  VAL 108          2HG2      VAL 108  -2.431  -2.536   8.983
  826   3HG2  VAL 108          3HG2      VAL 108  -1.145  -1.574   9.712
  827    H    TYR 109           H        TYR 109   0.702  -0.829   5.351
  828    HA   TYR 109           HA       TYR 109   1.666  -3.156   3.717
  829   1HB   TYR 109          1HB       TYR 109   1.155  -0.293   2.849
  830   2HB   TYR 109          2HB       TYR 109   1.981  -1.490   1.855
  831    HD1  TYR 109           HD1      TYR 109  -1.240  -0.414   3.240
  832    HD2  TYR 109           HD2      TYR 109   0.779  -3.450   0.971
  833    HE1  TYR 109           HE1      TYR 109  -3.427  -1.282   2.454
  834    HE2  TYR 109           HE2      TYR 109  -1.407  -4.318   0.186
  835    HH   TYR 109           HH       TYR 109  -3.786  -3.291  -0.126
  836    H    THR 110           H        THR 110   3.940  -3.239   3.521
  837    HA   THR 110           HA       THR 110   5.453  -1.130   5.028
  838    HB   THR 110           HB       THR 110   6.255  -3.989   4.403
  839    HG1  THR 110           HG1      THR 110   4.935  -2.870   6.646
  840   1HG2  THR 110          1HG2      THR 110   8.011  -2.249   5.018
  841   2HG2  THR 110          2HG2      THR 110   7.224  -2.141   6.593
  842   3HG2  THR 110          3HG2      THR 110   7.943  -3.664   6.069
  843    H    VAL 111           H        VAL 111   6.243   0.272   3.481
  844    HA   VAL 111           HA       VAL 111   6.999  -0.709   0.816
  845    HB   VAL 111           HB       VAL 111   5.789   1.458   1.452
  846   1HG1  VAL 111          1HG1      VAL 111   7.315   2.127   3.271
  847   2HG1  VAL 111          2HG1      VAL 111   8.619   2.312   2.097
  848   3HG1  VAL 111          3HG1      VAL 111   7.210   3.369   2.024
  849   1HG2  VAL 111          1HG2      VAL 111   8.230   1.426  -0.320
  850   2HG2  VAL 111          2HG2      VAL 111   6.552   1.172  -0.793
  851   3HG2  VAL 111          3HG2      VAL 111   7.092   2.773  -0.290
  852    H    THR 112           H        THR 112   9.060  -1.230   0.205
  853    HA   THR 112           HA       THR 112  11.283  -0.611   2.126
  854    HB   THR 112           HB       THR 112  10.633  -2.925   0.292
  855    HG1  THR 112           HG1      THR 112   9.847  -2.857   2.460
  856   1HG2  THR 112          1HG2      THR 112  13.283  -2.157   1.506
  857   2HG2  THR 112          2HG2      THR 112  12.885  -3.842   1.171
  858   3HG2  THR 112          3HG2      THR 112  12.938  -2.670  -0.146
  859    H    VAL 113           H        VAL 113  12.780   0.810   1.335
  860    HA   VAL 113           HA       VAL 113  12.913   1.295  -1.605
  861    HB   VAL 113           HB       VAL 113  13.972   3.386  -0.954
  862   1HG1  VAL 113          1HG1      VAL 113  11.486   3.165  -0.649
  863   2HG1  VAL 113          2HG1      VAL 113  11.776   2.805   1.053
  864   3HG1  VAL 113          3HG1      VAL 113  12.226   4.379   0.394
  865   1HG2  VAL 113          1HG2      VAL 113  14.020   2.223   1.851
  866   2HG2  VAL 113          2HG2      VAL 113  15.427   2.492   0.821
  867   3HG2  VAL 113          3HG2      VAL 113  14.497   3.865   1.418
  868    H    LYS 114           H        LYS 114  14.759   0.728  -2.766
  869    HA   LYS 114           HA       LYS 114  17.164  -0.158  -1.216
  870   1HB   LYS 114          1HB       LYS 114  15.352  -1.655  -3.029
  871   2HB   LYS 114          2HB       LYS 114  17.076  -1.954  -3.251
  872   1HG   LYS 114          1HG       LYS 114  17.300  -2.457  -0.845
  873   2HG   LYS 114          2HG       LYS 114  15.575  -2.164  -0.622
  874   1HD   LYS 114          1HD       LYS 114  15.666  -4.495  -0.865
  875   2HD   LYS 114          2HD       LYS 114  15.280  -3.954  -2.500
  876   1HE   LYS 114          1HE       LYS 114  17.476  -4.331  -3.279
  877   2HE   LYS 114          2HE       LYS 114  18.153  -4.326  -1.637
  878   1HZ   LYS 114          1HZ       LYS 114  16.799  -6.301  -1.150
  879   2HZ   LYS 114          2HZ       LYS 114  16.286  -6.344  -2.769
  880   3HZ   LYS 114          3HZ       LYS 114  17.921  -6.591  -2.393
  881    H    ASN 115           H        ASN 115  19.123  -0.279  -2.592
  882    HA   ASN 115           HA       ASN 115  19.153   0.855  -5.271
  883   1HB   ASN 115          1HB       ASN 115  19.099   2.586  -2.988
  884   2HB   ASN 115          2HB       ASN 115  20.688   2.721  -3.737
  885   1HD2  ASN 115          2HD2      ASN 115  18.590   4.794  -3.789
  886   2HD2  ASN 115          1HD2      ASN 115  18.184   5.033  -5.419
  887    HA   PRO 116           HA       PRO 116  23.169  -0.905  -5.271
  888   1HB   PRO 116          1HB       PRO 116  24.797   0.932  -6.482
  889   2HB   PRO 116          2HB       PRO 116  23.578  -0.018  -7.357
  890   1HG   PRO 116          1HG       PRO 116  23.456   2.797  -6.402
  891   2HG   PRO 116          2HG       PRO 116  22.843   2.085  -7.902
  892   1HD   PRO 116          1HD       PRO 116  21.267   2.680  -5.761
  893   2HD   PRO 116          2HD       PRO 116  20.890   1.396  -6.930
  894    H    VAL 117           H        VAL 117  22.670   1.868  -3.368
  895    HA   VAL 117           HA       VAL 117  25.435   1.727  -2.237
  896    HB   VAL 117           HB       VAL 117  23.246   3.806  -1.936
  897   1HG1  VAL 117          1HG1      VAL 117  26.119   3.647  -0.999
  898   2HG1  VAL 117          2HG1      VAL 117  25.246   5.174  -1.120
  899   3HG1  VAL 117          3HG1      VAL 117  24.677   3.916  -0.021
  900   1HG2  VAL 117          1HG2      VAL 117  25.634   3.525  -3.757
  901   2HG2  VAL 117          2HG2      VAL 117  23.976   3.949  -4.177
  902   3HG2  VAL 117          3HG2      VAL 117  24.998   5.116  -3.340
  903    H    GLY 118           H        GLY 118  21.984   1.402  -1.387
  904   1HA   GLY 118          2HA       GLY 118  22.191   1.326   1.418
  905   2HA   GLY 118          1HA       GLY 118  22.627  -0.289   0.860
  906    H    GLU 119           H        GLU 119  20.234   0.664   2.379
  907    HA   GLU 119           HA       GLU 119  17.938   0.538   0.598
  908   1HB   GLU 119          1HB       GLU 119  17.269  -1.763   1.246
  909   2HB   GLU 119          2HB       GLU 119  18.822  -1.762   0.412
  910   1HG   GLU 119          1HG       GLU 119  19.683  -1.461   2.957
  911   2HG   GLU 119          2HG       GLU 119  18.202  -2.371   3.252
  912    H    ASP 120           H        ASP 120  15.973   0.837   1.781
  913    HA   ASP 120           HA       ASP 120  16.200   1.020   4.755
  914   1HB   ASP 120          1HB       ASP 120  16.281   3.171   2.952
  915   2HB   ASP 120          2HB       ASP 120  14.632   3.172   3.577
  916    H    GLN 121           H        GLN 121  13.918   1.337   5.712
  917    HA   GLN 121           HA       GLN 121  11.762   0.229   3.986
  918   1HB   GLN 121          1HB       GLN 121  12.981  -1.648   5.058
  919   2HB   GLN 121          2HB       GLN 121  12.672  -0.930   6.640
  920   1HG   GLN 121          1HG       GLN 121  10.372  -1.354   6.527
  921   2HG   GLN 121          2HG       GLN 121  10.389  -1.500   4.769
  922   1HE2  GLN 121          2HE2      GLN 121  11.698  -3.462   3.918
  923   2HE2  GLN 121          1HE2      GLN 121  11.637  -4.889   4.835
  924    H    VAL 122           H        VAL 122   9.629   0.351   5.131
  925    HA   VAL 122           HA       VAL 122   9.349   1.959   7.538
  926    HB   VAL 122           HB       VAL 122   9.777   3.897   6.351
  927   1HG1  VAL 122          1HG1      VAL 122   9.160   2.188   4.014
  928   2HG1  VAL 122          2HG1      VAL 122   8.838   3.909   3.808
  929   3HG1  VAL 122          3HG1      VAL 122  10.456   3.359   4.243
  930   1HG2  VAL 122          1HG2      VAL 122   7.365   3.971   7.019
  931   2HG2  VAL 122          2HG2      VAL 122   7.718   4.964   5.605
  932   3HG2  VAL 122          3HG2      VAL 122   6.937   3.394   5.408
  933    H    ASN 123           H        ASN 123   6.991   2.297   8.010
  934    HA   ASN 123           HA       ASN 123   5.378   0.129   6.734
  935   1HB   ASN 123          1HB       ASN 123   5.753  -0.100   9.107
  936   2HB   ASN 123          2HB       ASN 123   5.246   1.560   9.401
  937   1HD2  ASN 123          2HD2      ASN 123   3.348   1.181  10.641
  938   2HD2  ASN 123          1HD2      ASN 123   2.014   0.304  10.065
  939    H    LEU 124           H        LEU 124   3.352   0.564   5.931
  940    HA   LEU 124           HA       LEU 124   2.560   3.450   5.691
  941   1HB   LEU 124          1HB       LEU 124   3.313   2.415   3.600
  942   2HB   LEU 124          2HB       LEU 124   2.207   1.065   3.843
  943    HG   LEU 124           HG       LEU 124   0.532   3.271   4.027
  944   1HD1  LEU 124          1HD1      LEU 124   2.827   4.300   2.926
  945   2HD1  LEU 124          2HD1      LEU 124   1.921   3.836   1.487
  946   3HD1  LEU 124          3HD1      LEU 124   1.211   4.949   2.655
  947   1HD2  LEU 124          1HD2      LEU 124   1.258   1.389   1.774
  948   2HD2  LEU 124          2HD2      LEU 124  -0.146   1.329   2.841
  949   3HD2  LEU 124          3HD2      LEU 124  -0.035   2.577   1.600
  950    H    THR 125           H        THR 125   0.865   3.749   7.128
  951    HA   THR 125           HA       THR 125  -0.965   1.548   7.801
  952    HB   THR 125           HB       THR 125  -1.083   4.494   8.524
  953    HG1  THR 125           HG1      THR 125   0.357   2.345   9.681
  954   1HG2  THR 125          1HG2      THR 125  -2.188   1.959   9.746
  955   2HG2  THR 125          2HG2      THR 125  -2.100   3.483  10.629
  956   3HG2  THR 125          3HG2      THR 125  -3.087   3.363   9.172
  957    H    VAL 126           H        VAL 126  -3.321   1.738   7.469
  958    HA   VAL 126           HA       VAL 126  -4.089   3.561   5.223
  959    HB   VAL 126           HB       VAL 126  -3.542   1.286   4.417
  960   1HG1  VAL 126          1HG1      VAL 126  -5.608   0.510   6.484
  961   2HG1  VAL 126          2HG1      VAL 126  -5.169  -0.550   5.147
  962   3HG1  VAL 126          3HG1      VAL 126  -3.952  -0.075   6.330
  963   1HG2  VAL 126          1HG2      VAL 126  -6.503   1.952   4.416
  964   2HG2  VAL 126          2HG2      VAL 126  -5.307   2.511   3.249
  965   3HG2  VAL 126          3HG2      VAL 126  -5.734   0.803   3.323
  966    H    LYS 127           H        LYS 127  -6.440   3.930   5.094
  967    HA   LYS 127           HA       LYS 127  -8.112   3.076   7.374
  968   1HB   LYS 127          1HB       LYS 127  -6.529   5.340   7.592
  969   2HB   LYS 127          2HB       LYS 127  -8.072   6.004   7.054
  970   1HG   LYS 127          1HG       LYS 127  -9.175   5.365   8.972
  971   2HG   LYS 127          2HG       LYS 127  -8.153   3.948   9.214
  972   1HD   LYS 127          1HD       LYS 127  -7.680   5.625  10.942
  973   2HD   LYS 127          2HD       LYS 127  -6.280   5.436   9.885
  974   1HE   LYS 127          1HE       LYS 127  -6.575   7.521   8.892
  975   2HE   LYS 127          2HE       LYS 127  -8.323   7.533   9.202
  976   1HZ   LYS 127          1HZ       LYS 127  -6.230   7.652  11.308
  977   2HZ   LYS 127          2HZ       LYS 127  -7.087   8.997  10.731
  978   3HZ   LYS 127          3HZ       LYS 127  -7.909   7.754  11.547
  979    H    VAL 128           H        VAL 128  -9.871   2.422   6.143
  980    HA   VAL 128           HA       VAL 128 -10.580   3.776   3.649
  981    HB   VAL 128           HB       VAL 128 -12.085   1.693   5.269
  982   1HG1  VAL 128          1HG1      VAL 128 -12.996   3.127   3.165
  983   2HG1  VAL 128          2HG1      VAL 128 -12.169   1.833   2.300
  984   3HG1  VAL 128          3HG1      VAL 128 -13.454   1.449   3.444
  985   1HG2  VAL 128          1HG2      VAL 128  -9.640   1.162   4.579
  986   2HG2  VAL 128          2HG2      VAL 128 -10.883   0.007   4.104
  987   3HG2  VAL 128          3HG2      VAL 128 -10.249   1.156   2.927
  988    H    ILE 129           H        ILE 129 -11.713   5.655   3.643
  989    HA   ILE 129           HA       ILE 129 -13.427   6.379   5.953
  990    HB   ILE 129           HB       ILE 129 -12.416   7.829   3.484
  991   1HG1  ILE 129          1HG1      ILE 129 -10.681   7.294   5.154
  992   2HG1  ILE 129          2HG1      ILE 129 -10.999   9.028   5.120
  993   1HG2  ILE 129          1HG2      ILE 129 -14.153   8.735   5.778
  994   2HG2  ILE 129          2HG2      ILE 129 -13.203   9.872   4.821
  995   3HG2  ILE 129          3HG2      ILE 129 -14.456   8.899   4.048
  996   1HD1  ILE 129          1HD1      ILE 129 -12.627   8.646   7.042
  997   2HD1  ILE 129          2HD1      ILE 129 -11.968   7.014   7.161
  998   3HD1  ILE 129          3HD1      ILE 129 -10.924   8.409   7.434
  999    H    ASP 130           H        ASP 130 -15.617   7.322   5.380
 1000    HA   ASP 130           HA       ASP 130 -16.822   5.863   3.049
 1001   1HB   ASP 130          1HB       ASP 130 -17.353   5.204   5.485
 1002   2HB   ASP 130          2HB       ASP 130 -18.222   6.736   5.585

  No H/Q in entry =        1002
  Start of MODEL    5
    1    H1   ARG   1          1H        ARG   1  26.146   2.465  -9.761
    2    H2   ARG   1          2H        ARG   1  27.148   1.332  -8.988
    3    H3   ARG   1          3H        ARG   1  25.809   1.976  -8.169
    4    HA   ARG   1           HA       ARG   1  27.838   3.026  -7.375
    5   1HB   ARG   1          1HB       ARG   1  28.226   3.002 -10.300
    6   2HB   ARG   1          2HB       ARG   1  28.734   4.501  -9.521
    7   1HG   ARG   1          1HG       ARG   1  30.174   3.282  -7.991
    8   2HG   ARG   1          2HG       ARG   1  29.578   1.739  -8.603
    9   1HD   ARG   1          1HD       ARG   1  30.406   2.667 -10.933
   10   2HD   ARG   1          2HD       ARG   1  31.434   3.701  -9.920
   11    HE   ARG   1           HE       ARG   1  31.415   0.711  -9.764
   12   1HH1  ARG   1          1HH1      ARG   1  32.471   2.125  -7.350
   13   2HH1  ARG   1          2HH1      ARG   1  34.163   2.236  -7.701
   14   1HH2  ARG   1          1HH2      ARG   1  33.775   1.572 -11.083
   15   2HH2  ARG   1          2HH2      ARG   1  34.901   1.924  -9.815
   16    H    GLN   2           H        GLN   2  25.945   4.095  -6.409
   17    HA   GLN   2           HA       GLN   2  25.481   6.795  -7.571
   18   1HB   GLN   2          1HB       GLN   2  23.038   6.466  -7.353
   19   2HB   GLN   2          2HB       GLN   2  23.735   5.265  -8.440
   20   1HG   GLN   2          1HG       GLN   2  23.690   3.574  -6.741
   21   2HG   GLN   2          2HG       GLN   2  23.292   4.752  -5.493
   22   1HE2  GLN   2          2HE2      GLN   2  21.101   5.126  -5.095
   23   2HE2  GLN   2          1HE2      GLN   2  19.836   4.573  -6.082
   24    H    GLU   3           H        GLU   3  23.366   7.397  -5.700
   25    HA   GLU   3           HA       GLU   3  24.984   7.765  -3.251
   26   1HB   GLU   3          1HB       GLU   3  22.567   8.927  -4.553
   27   2HB   GLU   3          2HB       GLU   3  22.648   9.039  -2.794
   28   1HG   GLU   3          1HG       GLU   3  23.779  10.977  -3.387
   29   2HG   GLU   3          2HG       GLU   3  25.125   9.842  -3.287
   30    HA   PRO   4           HA       PRO   4  23.045   4.542  -0.970
   31   1HB   PRO   4          1HB       PRO   4  22.951   5.684   1.530
   32   2HB   PRO   4          2HB       PRO   4  24.437   5.035   0.805
   33   1HG   PRO   4          1HG       PRO   4  23.466   7.861   0.904
   34   2HG   PRO   4          2HG       PRO   4  25.089   7.219   1.216
   35   1HD   PRO   4          1HD       PRO   4  24.489   8.361  -1.126
   36   2HD   PRO   4          2HD       PRO   4  25.559   6.941  -1.044
   37    HA   PRO   5           HA       PRO   5  18.785   5.759  -1.189
   38   1HB   PRO   5          1HB       PRO   5  17.708   3.414  -0.282
   39   2HB   PRO   5          2HB       PRO   5  18.372   3.602  -1.915
   40   1HG   PRO   5          1HG       PRO   5  19.616   2.398   0.513
   41   2HG   PRO   5          2HG       PRO   5  19.649   1.829  -1.162
   42   1HD   PRO   5          1HD       PRO   5  21.720   3.141  -0.025
   43   2HD   PRO   5          2HD       PRO   5  21.337   3.272  -1.757
   44    H    LYS   6           H        LYS   6  17.067   6.290   0.301
   45    HA   LYS   6           HA       LYS   6  17.170   5.603   3.117
   46   1HB   LYS   6          1HB       LYS   6  18.731   7.818   2.085
   47   2HB   LYS   6          2HB       LYS   6  17.523   8.400   3.231
   48   1HG   LYS   6          1HG       LYS   6  19.310   6.037   3.825
   49   2HG   LYS   6          2HG       LYS   6  19.758   7.691   4.239
   50   1HD   LYS   6          1HD       LYS   6  17.364   7.751   5.339
   51   2HD   LYS   6          2HD       LYS   6  17.540   5.996   5.342
   52   1HE   LYS   6          1HE       LYS   6  19.326   6.040   6.843
   53   2HE   LYS   6          2HE       LYS   6  19.801   7.687   6.383
   54   1HZ   LYS   6          1HZ       LYS   6  17.238   7.006   7.719
   55   2HZ   LYS   6          2HZ       LYS   6  18.612   7.571   8.543
   56   3HZ   LYS   6          3HZ       LYS   6  17.838   8.560   7.397
   57    H    ILE   7           H        ILE   7  15.357   6.540   4.272
   58    HA   ILE   7           HA       ILE   7  13.080   7.183   2.551
   59    HB   ILE   7           HB       ILE   7  13.340   7.008   5.568
   60   1HG1  ILE   7          1HG1      ILE   7  14.134   4.938   4.571
   61   2HG1  ILE   7          2HG1      ILE   7  12.519   4.659   5.221
   62   1HG2  ILE   7          1HG2      ILE   7  10.958   6.702   3.717
   63   2HG2  ILE   7          2HG2      ILE   7  10.929   6.471   5.464
   64   3HG2  ILE   7          3HG2      ILE   7  11.253   8.067   4.793
   65   1HD1  ILE   7          1HD1      ILE   7  11.585   5.090   2.928
   66   2HD1  ILE   7          2HD1      ILE   7  13.238   5.181   2.320
   67   3HD1  ILE   7          3HD1      ILE   7  12.631   3.671   3.000
   68    H    HIS   8           H        HIS   8  15.523   9.103   3.559
   69    HA   HIS   8           HA       HIS   8  13.801  11.391   4.386
   70   1HB   HIS   8          1HB       HIS   8  15.865  12.358   5.189
   71   2HB   HIS   8          2HB       HIS   8  15.847  10.671   5.693
   72    HD1  HIS   8           HD1      HIS   8  18.051   9.589   5.333
   73    HD2  HIS   8           HD2      HIS   8  17.286  12.470   2.421
   74    HE1  HIS   8           HE1      HIS   8  20.068   9.610   3.801
   75    H    LEU   9           H        LEU   9  14.686  13.576   3.396
   76    HA   LEU   9           HA       LEU   9  15.056  13.129   0.458
   77   1HB   LEU   9          1HB       LEU   9  13.950  15.635   0.660
   78   2HB   LEU   9          2HB       LEU   9  13.039  14.163   0.397
   79    HG   LEU   9           HG       LEU   9  12.799  13.939   2.897
   80   1HD1  LEU   9          1HD1      LEU   9  14.801  15.455   3.340
   81   2HD1  LEU   9          2HD1      LEU   9  13.750  16.811   2.938
   82   3HD1  LEU   9          3HD1      LEU   9  13.371  15.779   4.314
   83   1HD2  LEU   9          1HD2      LEU   9  11.667  16.148   1.238
   84   2HD2  LEU   9          2HD2      LEU   9  10.850  14.783   2.000
   85   3HD2  LEU   9          3HD2      LEU   9  11.328  16.177   2.969
   86    H    ASP  10           H        ASP  10  15.217  16.407   1.596
   87    HA   ASP  10           HA       ASP  10  18.127  16.408   0.970
   88   1HB   ASP  10          1HB       ASP  10  15.829  18.312   0.833
   89   2HB   ASP  10          2HB       ASP  10  17.441  18.993   1.045
   90    H    CYS  11           H        CYS  11  15.868  17.006   3.603
   91    HA   CYS  11           HA       CYS  11  18.201  17.442   5.395
   92   1HB   CYS  11          1HB       CYS  11  16.138  19.415   4.602
   93   2HB   CYS  11          2HB       CYS  11  16.523  19.368   6.323
   94    HG   CYS  11           HG       CYS  11  18.193  20.978   4.939
   95    HA   PRO  12           HA       PRO  12  14.605  16.465   8.302
   96   1HB   PRO  12          1HB       PRO  12  12.022  16.479   7.382
   97   2HB   PRO  12          2HB       PRO  12  12.830  17.916   8.037
   98   1HG   PRO  12          1HG       PRO  12  12.365  17.138   5.203
   99   2HG   PRO  12          2HG       PRO  12  12.281  18.733   5.965
  100   1HD   PRO  12          1HD       PRO  12  14.403  17.903   4.476
  101   2HD   PRO  12          2HD       PRO  12  14.534  19.083   5.797
  102    H    GLY  13           H        GLY  13  12.321  15.276   5.908
  103   1HA   GLY  13          2HA       GLY  13  13.615  12.586   6.087
  104   2HA   GLY  13          1HA       GLY  13  12.672  13.122   4.697
  105    H    ARG  14           H        ARG  14  10.420  14.177   5.823
  106    HA   ARG  14           HA       ARG  14   9.340  12.067   7.649
  107   1HB   ARG  14          1HB       ARG  14   8.913  14.964   7.155
  108   2HB   ARG  14          2HB       ARG  14   7.469  14.035   7.560
  109   1HG   ARG  14          1HG       ARG  14   8.422  13.279   9.623
  110   2HG   ARG  14          2HG       ARG  14  10.022  13.874   9.176
  111   1HD   ARG  14          1HD       ARG  14   8.572  16.176   8.969
  112   2HD   ARG  14          2HD       ARG  14   7.713  15.359  10.289
  113    HE   ARG  14           HE       ARG  14  10.671  15.837  10.292
  114   1HH1  ARG  14          1HH1      ARG  14   9.954  17.694  12.088
  115   2HH1  ARG  14          2HH1      ARG  14   9.547  16.899  13.571
  116   1HH2  ARG  14          1HH2      ARG  14   9.141  13.786  12.098
  117   2HH2  ARG  14          2HH2      ARG  14   9.087  14.685  13.578
  118    H    ILE  15           H        ILE  15   8.972  10.509   5.902
  119    HA   ILE  15           HA       ILE  15   7.263  11.220   3.634
  120    HB   ILE  15           HB       ILE  15   8.650   8.801   4.744
  121   1HG1  ILE  15          1HG1      ILE  15   8.537  10.067   1.989
  122   2HG1  ILE  15          2HG1      ILE  15   9.769  10.405   3.205
  123   1HG2  ILE  15          1HG2      ILE  15   6.215   8.773   3.023
  124   2HG2  ILE  15          2HG2      ILE  15   7.538   7.712   2.541
  125   3HG2  ILE  15          3HG2      ILE  15   6.814   7.548   4.140
  126   1HD1  ILE  15          1HD1      ILE  15   9.415   7.537   2.738
  127   2HD1  ILE  15          2HD1      ILE  15   9.902   8.406   1.284
  128   3HD1  ILE  15          3HD1      ILE  15  10.891   8.500   2.738
  129    HA   PRO  16           HA       PRO  16   3.657  10.616   6.279
  130   1HB   PRO  16          1HB       PRO  16   1.825  11.492   4.442
  131   2HB   PRO  16          2HB       PRO  16   2.801  12.595   5.434
  132   1HG   PRO  16          1HG       PRO  16   3.183  11.756   2.602
  133   2HG   PRO  16          2HG       PRO  16   3.413  13.345   3.350
  134   1HD   PRO  16          1HD       PRO  16   5.471  11.666   2.759
  135   2HD   PRO  16          2HD       PRO  16   5.520  12.839   4.093
  136    H    ASP  17           H        ASP  17   4.588   8.268   5.454
  137    HA   ASP  17           HA       ASP  17   3.247   6.901   3.333
  138   1HB   ASP  17          1HB       ASP  17   3.973   4.880   4.730
  139   2HB   ASP  17          2HB       ASP  17   5.251   6.013   4.300
  140    H    THR  18           H        THR  18   0.986   7.720   3.706
  141    HA   THR  18           HA       THR  18  -0.481   5.886   5.551
  142    HB   THR  18           HB       THR  18  -0.194   7.983   6.746
  143    HG1  THR  18           HG1      THR  18  -2.352   8.517   6.991
  144   1HG2  THR  18          1HG2      THR  18  -0.482   9.072   4.073
  145   2HG2  THR  18          2HG2      THR  18  -1.563   9.884   5.206
  146   3HG2  THR  18          3HG2      THR  18   0.171   9.834   5.524
  147    H    ILE  19           H        ILE  19  -1.131   4.756   3.570
  148    HA   ILE  19           HA       ILE  19  -2.537   6.256   1.475
  149    HB   ILE  19           HB       ILE  19  -1.070   4.256   1.101
  150   1HG1  ILE  19          1HG1      ILE  19  -2.677   3.099  -0.446
  151   2HG1  ILE  19          2HG1      ILE  19  -3.977   4.043   0.276
  152   1HG2  ILE  19          1HG2      ILE  19  -2.110   3.109   3.219
  153   2HG2  ILE  19          2HG2      ILE  19  -3.344   2.553   2.089
  154   3HG2  ILE  19          3HG2      ILE  19  -1.656   2.112   1.838
  155   1HD1  ILE  19          1HD1      ILE  19  -2.817   6.132  -0.384
  156   2HD1  ILE  19          2HD1      ILE  19  -1.540   5.175  -1.134
  157   3HD1  ILE  19          3HD1      ILE  19  -3.177   5.125  -1.785
  158    H    VAL  20           H        VAL  20  -4.656   6.835   1.700
  159    HA   VAL  20           HA       VAL  20  -6.434   5.067   3.346
  160    HB   VAL  20           HB       VAL  20  -6.462   8.086   3.021
  161   1HG1  VAL  20          1HG1      VAL  20  -8.615   6.630   3.549
  162   2HG1  VAL  20          2HG1      VAL  20  -7.909   6.577   5.163
  163   3HG1  VAL  20          3HG1      VAL  20  -8.306   8.128   4.426
  164   1HG2  VAL  20          1HG2      VAL  20  -4.517   7.248   4.322
  165   2HG2  VAL  20          2HG2      VAL  20  -5.654   8.126   5.345
  166   3HG2  VAL  20          3HG2      VAL  20  -5.620   6.363   5.376
  167    H    VAL  21           H        VAL  21  -8.333   4.460   2.348
  168    HA   VAL  21           HA       VAL  21  -9.076   5.835  -0.214
  169    HB   VAL  21           HB       VAL  21  -7.971   3.725  -0.691
  170   1HG1  VAL  21          1HG1      VAL  21  -9.850   2.661   1.422
  171   2HG1  VAL  21          2HG1      VAL  21  -9.052   1.598   0.262
  172   3HG1  VAL  21          3HG1      VAL  21  -8.089   2.563   1.383
  173   1HG2  VAL  21          1HG2      VAL  21 -10.279   4.381  -1.770
  174   2HG2  VAL  21          2HG2      VAL  21  -9.598   2.782  -2.071
  175   3HG2  VAL  21          3HG2      VAL  21 -10.875   2.985  -0.871
  176    H    VAL  22           H        VAL  22 -11.353   5.900  -0.624
  177    HA   VAL  22           HA       VAL  22 -13.026   5.675   1.815
  178    HB   VAL  22           HB       VAL  22 -13.551   6.753  -0.975
  179   1HG1  VAL  22          1HG1      VAL  22 -15.204   6.534   1.503
  180   2HG1  VAL  22          2HG1      VAL  22 -15.355   8.005   0.542
  181   3HG1  VAL  22          3HG1      VAL  22 -15.700   6.435  -0.187
  182   1HG2  VAL  22          1HG2      VAL  22 -12.497   7.929   1.574
  183   2HG2  VAL  22          2HG2      VAL  22 -11.992   8.236  -0.089
  184   3HG2  VAL  22          3HG2      VAL  22 -13.491   8.937   0.521
  185    H    ALA  23           H        ALA  23 -12.362   3.177   1.158
  186    HA   ALA  23           HA       ALA  23 -13.144   1.066   0.447
  187   1HB   ALA  23          2HB       ALA  23 -15.717   2.589   0.957
  188   2HB   ALA  23          1HB       ALA  23 -14.740   1.777   2.179
  189   3HB   ALA  23          3HB       ALA  23 -15.558   0.832   0.936
  190    H    GLY  24           H        GLY  24 -12.375   1.467  -1.824
  191   1HA   GLY  24          2HA       GLY  24 -14.583   1.113  -3.709
  192   2HA   GLY  24          1HA       GLY  24 -12.867   1.041  -4.100
  193    H    ASN  25           H        ASN  25 -11.913   3.499  -3.416
  194    HA   ASN  25           HA       ASN  25 -13.459   5.299  -5.238
  195   1HB   ASN  25          1HB       ASN  25 -13.202   5.467  -2.390
  196   2HB   ASN  25          2HB       ASN  25 -12.327   6.823  -3.100
  197   1HD2  ASN  25          2HD2      ASN  25 -13.558   8.489  -4.123
  198   2HD2  ASN  25          1HD2      ASN  25 -15.255   8.488  -4.174
  199    H    LYS  26           H        LYS  26 -12.062   7.256  -5.836
  200    HA   LYS  26           HA       LYS  26  -9.457   6.371  -6.767
  201   1HB   LYS  26          1HB       LYS  26 -11.240   8.739  -6.926
  202   2HB   LYS  26          2HB       LYS  26  -9.522   9.066  -7.156
  203   1HG   LYS  26          1HG       LYS  26  -9.457   7.237  -8.867
  204   2HG   LYS  26          2HG       LYS  26 -11.206   7.078  -8.705
  205   1HD   LYS  26          1HD       LYS  26 -11.626   9.039  -9.811
  206   2HD   LYS  26          2HD       LYS  26 -10.180   9.826  -9.179
  207   1HE   LYS  26          1HE       LYS  26  -9.605   7.560 -10.984
  208   2HE   LYS  26          2HE       LYS  26 -10.423   8.928 -11.764
  209   1HZ   LYS  26          1HZ       LYS  26  -8.125   9.266  -9.919
  210   2HZ   LYS  26          2HZ       LYS  26  -7.932   9.118 -11.600
  211   3HZ   LYS  26          3HZ       LYS  26  -8.805  10.425 -10.960
  212    H    LEU  27           H        LEU  27  -7.583   6.431  -5.567
  213    HA   LEU  27           HA       LEU  27  -7.392   8.469  -3.374
  214   1HB   LEU  27          1HB       LEU  27  -7.734   6.521  -2.171
  215   2HB   LEU  27          2HB       LEU  27  -7.050   5.500  -3.431
  216    HG   LEU  27           HG       LEU  27  -4.788   6.203  -2.826
  217   1HD1  LEU  27          1HD1      LEU  27  -6.154   8.408  -1.661
  218   2HD1  LEU  27          2HD1      LEU  27  -5.316   7.571  -0.354
  219   3HD1  LEU  27          3HD1      LEU  27  -4.413   8.144  -1.757
  220   1HD2  LEU  27          1HD2      LEU  27  -6.650   5.087  -0.793
  221   2HD2  LEU  27          2HD2      LEU  27  -5.208   4.368  -1.509
  222   3HD2  LEU  27          3HD2      LEU  27  -5.054   5.564  -0.221
  223    H    ARG  28           H        ARG  28  -5.389   9.475  -3.181
  224    HA   ARG  28           HA       ARG  28  -3.213   8.605  -5.055
  225   1HB   ARG  28          1HB       ARG  28  -4.492  11.277  -4.509
  226   2HB   ARG  28          2HB       ARG  28  -2.823  11.206  -5.076
  227   1HG   ARG  28          1HG       ARG  28  -3.423  10.518  -7.166
  228   2HG   ARG  28          2HG       ARG  28  -4.727   9.495  -6.562
  229   1HD   ARG  28          1HD       ARG  28  -5.645  11.396  -7.857
  230   2HD   ARG  28          2HD       ARG  28  -6.101  11.544  -6.147
  231    HE   ARG  28           HE       ARG  28  -3.763  12.996  -7.339
  232   1HH1  ARG  28          1HH1      ARG  28  -3.101  13.865  -5.023
  233   2HH1  ARG  28          2HH1      ARG  28  -4.325  14.899  -4.364
  234   1HH2  ARG  28          1HH2      ARG  28  -6.787  13.827  -6.558
  235   2HH2  ARG  28          2HH2      ARG  28  -6.411  14.879  -5.233
  236    H    LEU  29           H        LEU  29  -1.131   8.653  -4.138
  237    HA   LEU  29           HA       LEU  29  -0.869   9.786  -1.373
  238   1HB   LEU  29          1HB       LEU  29  -1.311   7.355  -1.305
  239   2HB   LEU  29          2HB       LEU  29   0.042   7.081  -2.399
  240    HG   LEU  29           HG       LEU  29   1.615   7.916  -0.764
  241   1HD1  LEU  29          1HD1      LEU  29  -0.885   8.597   0.796
  242   2HD1  LEU  29          2HD1      LEU  29   0.697   8.478   1.565
  243   3HD1  LEU  29          3HD1      LEU  29   0.416   9.682   0.307
  244   1HD2  LEU  29          1HD2      LEU  29  -0.388   5.896   0.228
  245   2HD2  LEU  29          2HD2      LEU  29   1.229   5.614  -0.418
  246   3HD2  LEU  29          3HD2      LEU  29   1.029   6.318   1.185
  247    H    ASP  30           H        ASP  30   1.052  10.906  -1.084
  248    HA   ASP  30           HA       ASP  30   3.190  10.570  -3.161
  249   1HB   ASP  30          1HB       ASP  30   2.108  13.135  -1.950
  250   2HB   ASP  30          2HB       ASP  30   3.389  13.027  -3.156
  251    H    VAL  31           H        VAL  31   5.168  10.207  -2.236
  252    HA   VAL  31           HA       VAL  31   5.815  11.409   0.400
  253    HB   VAL  31           HB       VAL  31   6.620   9.083   1.103
  254   1HG1  VAL  31          1HG1      VAL  31   4.524  10.169   1.928
  255   2HG1  VAL  31          2HG1      VAL  31   3.647   9.398   0.607
  256   3HG1  VAL  31          3HG1      VAL  31   4.404   8.411   1.858
  257   1HG2  VAL  31          1HG2      VAL  31   6.247   8.363  -1.449
  258   2HG2  VAL  31          2HG2      VAL  31   6.078   7.209  -0.129
  259   3HG2  VAL  31          3HG2      VAL  31   4.646   7.959  -0.834
  260    HA   PRO  32           HA       PRO  32   9.458  11.786  -2.207
  261   1HB   PRO  32          1HB       PRO  32  10.809  13.521  -0.584
  262   2HB   PRO  32          2HB       PRO  32   9.499  14.029  -1.667
  263   1HG   PRO  32          1HG       PRO  32   9.452  13.552   1.264
  264   2HG   PRO  32          2HG       PRO  32   8.607  14.775   0.303
  265   1HD   PRO  32          1HD       PRO  32   7.432  12.493   1.271
  266   2HD   PRO  32          2HD       PRO  32   6.856  13.388  -0.152
  267    H    ILE  33           H        ILE  33  11.531  10.855  -2.138
  268    HA   ILE  33           HA       ILE  33  12.569   9.835   0.456
  269    HB   ILE  33           HB       ILE  33  12.721   7.830  -1.676
  270   1HG1  ILE  33          1HG1      ILE  33   9.956   8.534  -0.631
  271   2HG1  ILE  33          2HG1      ILE  33  10.512   8.856  -2.271
  272   1HG2  ILE  33          1HG2      ILE  33  12.040   8.035   1.218
  273   2HG2  ILE  33          2HG2      ILE  33  11.448   6.620   0.347
  274   3HG2  ILE  33          3HG2      ILE  33  13.178   6.962   0.405
  275   1HD1  ILE  33          1HD1      ILE  33  11.052   6.105  -1.558
  276   2HD1  ILE  33          2HD1      ILE  33   9.344   6.478  -1.321
  277   3HD1  ILE  33          3HD1      ILE  33  10.093   6.738  -2.896
  278    H    SER  34           H        SER  34  14.732   8.478  -0.273
  279    HA   SER  34           HA       SER  34  16.363  10.456  -1.759
  280   1HB   SER  34          1HB       SER  34  16.764   9.052   0.504
  281   2HB   SER  34          2HB       SER  34  17.449   7.906  -0.644
  282    HG   SER  34           HG       SER  34  19.036   9.254  -1.051
  283    H    GLY  35           H        GLY  35  18.200   8.030  -2.436
  284   1HA   GLY  35          2HA       GLY  35  16.625   6.749  -4.588
  285   2HA   GLY  35          1HA       GLY  35  18.250   6.287  -4.084
  286    H    ASP  36           H        ASP  36  19.299   6.457  -6.052
  287    HA   ASP  36           HA       ASP  36  18.985   8.913  -7.683
  288   1HB   ASP  36          1HB       ASP  36  20.813   8.835  -5.650
  289   2HB   ASP  36          2HB       ASP  36  21.783   8.241  -6.999
  290    HA   PRO  37           HA       PRO  37  18.582   9.248  -9.481
  291   1HB   PRO  37          1HB       PRO  37  16.932   8.322 -11.457
  292   2HB   PRO  37          2HB       PRO  37  18.541   8.998 -11.772
  293   1HG   PRO  37          1HG       PRO  37  17.668   6.161 -11.683
  294   2HG   PRO  37          2HG       PRO  37  18.857   6.947 -12.730
  295   1HD   PRO  37          1HD       PRO  37  19.506   5.413 -10.555
  296   2HD   PRO  37          2HD       PRO  37  20.548   6.686 -11.227
  297    H    ALA  38           H        ALA  38  16.853   6.137  -9.992
  298    HA   ALA  38           HA       ALA  38  14.886   7.013  -7.911
  299   1HB   ALA  38          2HB       ALA  38  13.685   5.011  -9.329
  300   2HB   ALA  38          3HB       ALA  38  13.567   6.719  -9.751
  301   3HB   ALA  38          1HB       ALA  38  14.757   5.691 -10.552
  302    HA   PRO  39           HA       PRO  39  16.403   3.489  -5.673
  303   1HB   PRO  39          1HB       PRO  39  14.764   3.732  -3.506
  304   2HB   PRO  39          2HB       PRO  39  16.165   4.787  -3.774
  305   1HG   PRO  39          1HG       PRO  39  13.290   5.346  -4.127
  306   2HG   PRO  39          2HG       PRO  39  14.614   6.441  -3.712
  307   1HD   PRO  39          1HD       PRO  39  13.413   6.165  -6.229
  308   2HD   PRO  39          2HD       PRO  39  14.938   7.004  -5.879
  309    H    THR  40           H        THR  40  14.847   1.846  -4.097
  310    HA   THR  40           HA       THR  40  12.775   0.813  -6.008
  311    HB   THR  40           HB       THR  40  14.163  -0.968  -4.052
  312    HG1  THR  40           HG1      THR  40  16.006  -1.027  -5.228
  313   1HG2  THR  40          1HG2      THR  40  12.434  -1.762  -5.661
  314   2HG2  THR  40          2HG2      THR  40  13.482  -1.262  -6.989
  315   3HG2  THR  40          3HG2      THR  40  13.994  -2.549  -5.898
  316    H    VAL  41           H        VAL  41  11.151   2.043  -4.826
  317    HA   VAL  41           HA       VAL  41  10.737   1.371  -1.969
  318    HB   VAL  41           HB       VAL  41  10.614   3.696  -2.765
  319   1HG1  VAL  41          1HG1      VAL  41   9.269   2.516  -4.963
  320   2HG1  VAL  41          2HG1      VAL  41   8.092   3.560  -4.168
  321   3HG1  VAL  41          3HG1      VAL  41   9.629   4.224  -4.719
  322   1HG2  VAL  41          1HG2      VAL  41   9.116   2.820  -0.909
  323   2HG2  VAL  41          2HG2      VAL  41   8.558   4.293  -1.699
  324   3HG2  VAL  41          3HG2      VAL  41   7.820   2.743  -2.103
  325    H    ILE  42           H        ILE  42   9.912  -0.733  -1.929
  326    HA   ILE  42           HA       ILE  42   7.705  -1.503  -3.743
  327    HB   ILE  42           HB       ILE  42   9.397  -2.895  -1.649
  328   1HG1  ILE  42          1HG1      ILE  42  10.592  -2.272  -3.702
  329   2HG1  ILE  42          2HG1      ILE  42  10.370  -4.020  -3.637
  330   1HG2  ILE  42          1HG2      ILE  42   7.312  -4.050  -3.517
  331   2HG2  ILE  42          2HG2      ILE  42   8.413  -4.995  -2.514
  332   3HG2  ILE  42          3HG2      ILE  42   7.199  -3.963  -1.758
  333   1HD1  ILE  42          1HD1      ILE  42   8.073  -3.167  -4.920
  334   2HD1  ILE  42          2HD1      ILE  42   9.303  -2.074  -5.556
  335   3HD1  ILE  42          3HD1      ILE  42   9.503  -3.819  -5.720
  336    H    TRP  43           H        TRP  43   5.679  -0.827  -3.042
  337    HA   TRP  43           HA       TRP  43   5.003  -0.376  -0.247
  338   1HB   TRP  43          1HB       TRP  43   3.415  -0.661  -2.821
  339   2HB   TRP  43          2HB       TRP  43   2.675  -0.230  -1.282
  340    HD1  TRP  43           HD1      TRP  43   4.297   1.259  -4.222
  341    HE1  TRP  43           HE1      TRP  43   4.849   3.742  -3.807
  342    HE3  TRP  43           HE3      TRP  43   3.576   1.498   0.835
  343    HZ2  TRP  43           HZ2      TRP  43   4.975   5.584  -1.626
  344    HZ3  TRP  43           HZ3      TRP  43   3.941   3.603   2.055
  345    HH2  TRP  43           HH2      TRP  43   4.631   5.660   0.837
  346    H    GLN  44           H        GLN  44   4.794  -2.122   1.157
  347    HA   GLN  44           HA       GLN  44   3.736  -4.701   0.062
  348   1HB   GLN  44          1HB       GLN  44   5.168  -4.049   2.660
  349   2HB   GLN  44          2HB       GLN  44   4.774  -5.664   2.078
  350   1HG   GLN  44          1HG       GLN  44   6.305  -3.920   0.214
  351   2HG   GLN  44          2HG       GLN  44   7.171  -4.517   1.630
  352   1HE2  GLN  44          2HE2      GLN  44   5.576  -5.501  -1.371
  353   2HE2  GLN  44          1HE2      GLN  44   6.112  -7.110  -1.338
  354    H    LYS  45           H        LYS  45   1.963  -5.725   1.127
  355    HA   LYS  45           HA       LYS  45   0.360  -3.905   2.888
  356   1HB   LYS  45          1HB       LYS  45  -1.565  -5.206   1.967
  357   2HB   LYS  45          2HB       LYS  45  -0.626  -4.415   0.703
  358   1HG   LYS  45          1HG       LYS  45   0.007  -6.386  -0.213
  359   2HG   LYS  45          2HG       LYS  45   0.365  -7.099   1.358
  360   1HD   LYS  45          1HD       LYS  45  -1.665  -8.101   1.494
  361   2HD   LYS  45          2HD       LYS  45  -2.506  -6.671   0.897
  362   1HE   LYS  45          1HE       LYS  45  -2.099  -7.255  -1.384
  363   2HE   LYS  45          2HE       LYS  45  -0.894  -8.477  -0.929
  364   1HZ   LYS  45          1HZ       LYS  45  -2.634  -9.669   0.277
  365   2HZ   LYS  45          2HZ       LYS  45  -3.783  -8.528  -0.227
  366   3HZ   LYS  45          3HZ       LYS  45  -3.021  -9.526  -1.371
  367    H    ALA  46           H        ALA  46  -0.522  -4.769   4.805
  368    HA   ALA  46           HA       ALA  46   0.200  -7.594   5.487
  369   1HB   ALA  46          2HB       ALA  46   0.904  -6.705   7.722
  370   2HB   ALA  46          3HB       ALA  46   1.893  -6.081   6.400
  371   3HB   ALA  46          1HB       ALA  46   0.636  -5.070   7.116
  372    H    ILE  47           H        ILE  47  -1.428  -8.660   6.603
  373    HA   ILE  47           HA       ILE  47  -4.014  -7.303   6.900
  374    HB   ILE  47           HB       ILE  47  -3.786  -9.596   6.030
  375   1HG1  ILE  47          1HG1      ILE  47  -5.078  -9.704   8.767
  376   2HG1  ILE  47          2HG1      ILE  47  -5.807  -8.870   7.395
  377   1HG2  ILE  47          1HG2      ILE  47  -2.191  -9.896   8.498
  378   2HG2  ILE  47          2HG2      ILE  47  -3.290 -11.235   8.170
  379   3HG2  ILE  47          3HG2      ILE  47  -2.080 -10.773   6.973
  380   1HD1  ILE  47          1HD1      ILE  47  -5.393 -11.142   6.146
  381   2HD1  ILE  47          2HD1      ILE  47  -5.319 -11.809   7.777
  382   3HD1  ILE  47          3HD1      ILE  47  -6.778 -10.987   7.225
  383    H    THR  48           H        THR  48  -5.202  -7.338   8.971
  384    HA   THR  48           HA       THR  48  -3.375  -6.891  11.291
  385    HB   THR  48           HB       THR  48  -5.361  -5.667  12.174
  386    HG1  THR  48           HG1      THR  48  -7.053  -6.704  11.277
  387   1HG2  THR  48          1HG2      THR  48  -4.084  -5.067   9.556
  388   2HG2  THR  48          2HG2      THR  48  -5.497  -4.103   9.986
  389   3HG2  THR  48          3HG2      THR  48  -4.089  -4.127  11.049
  390    H    GLN  49           H        GLN  49  -4.033  -9.605  10.473
  391    HA   GLN  49           HA       GLN  49  -5.400 -10.508  12.966
  392   1HB   GLN  49          1HB       GLN  49  -6.295 -10.739  10.153
  393   2HB   GLN  49          2HB       GLN  49  -6.395 -12.234  11.086
  394   1HG   GLN  49          1HG       GLN  49  -7.382  -9.736  12.388
  395   2HG   GLN  49          2HG       GLN  49  -8.374 -10.430  11.105
  396   1HE2  GLN  49          2HE2      GLN  49  -9.937 -10.880  12.971
  397   2HE2  GLN  49          1HE2      GLN  49  -9.703 -12.292  13.883
  398    H    GLY  50           H        GLY  50  -5.235 -13.095  12.918
  399   1HA   GLY  50          2HA       GLY  50  -2.774 -14.042  13.395
  400   2HA   GLY  50          1HA       GLY  50  -2.736 -14.016  11.631
  401    H    ASN  51           H        ASN  51  -2.764 -16.238  11.256
  402    HA   ASN  51           HA       ASN  51  -3.759 -18.362  10.961
  403   1HB   ASN  51          1HB       ASN  51  -4.609 -17.649  13.788
  404   2HB   ASN  51          2HB       ASN  51  -4.648 -19.275  13.108
  405   1HD2  ASN  51          2HD2      ASN  51  -2.941 -18.133  15.361
  406   2HD2  ASN  51          1HD2      ASN  51  -1.342 -18.475  14.903
  407    H    LYS  52           H        LYS  52  -5.272 -16.457   9.695
  408    HA   LYS  52           HA       LYS  52  -8.009 -16.263  10.577
  409   1HB   LYS  52          1HB       LYS  52  -8.344 -15.311   8.382
  410   2HB   LYS  52          2HB       LYS  52  -6.750 -14.800   8.935
  411   1HG   LYS  52          1HG       LYS  52  -6.183 -17.187   7.683
  412   2HG   LYS  52          2HG       LYS  52  -7.484 -16.545   6.680
  413   1HD   LYS  52          1HD       LYS  52  -6.280 -14.487   6.307
  414   2HD   LYS  52          2HD       LYS  52  -5.053 -14.929   7.494
  415   1HE   LYS  52          1HE       LYS  52  -3.898 -16.140   5.960
  416   2HE   LYS  52          2HE       LYS  52  -5.366 -16.988   5.435
  417   1HZ   LYS  52          1HZ       LYS  52  -6.010 -14.850   4.317
  418   2HZ   LYS  52          2HZ       LYS  52  -4.429 -14.298   4.606
  419   3HZ   LYS  52          3HZ       LYS  52  -4.692 -15.656   3.619
  420    H    ALA  53           H        ALA  53  -9.401 -17.044   8.242
  421    HA   ALA  53           HA       ALA  53  -9.687 -19.930   8.748
  422   1HB   ALA  53          2HB       ALA  53 -11.414 -19.239   6.718
  423   2HB   ALA  53          3HB       ALA  53 -11.780 -19.076   8.436
  424   3HB   ALA  53          1HB       ALA  53 -11.173 -17.691   7.529
  425    HA   PRO  54           HA       PRO  54  -7.582 -21.382   5.175
  426   1HB   PRO  54          1HB       PRO  54  -9.282 -23.248   4.119
  427   2HB   PRO  54          2HB       PRO  54  -8.379 -23.507   5.626
  428   1HG   PRO  54          1HG       PRO  54 -11.226 -22.740   5.234
  429   2HG   PRO  54          2HG       PRO  54 -10.501 -23.816   6.438
  430   1HD   PRO  54          1HD       PRO  54 -11.262 -21.244   6.964
  431   2HD   PRO  54          2HD       PRO  54  -9.978 -22.096   7.850
  432    H    ALA  55           H        ALA  55  -7.711 -21.549   2.734
  433    HA   ALA  55           HA       ALA  55  -8.914 -19.225   1.564
  434   1HB   ALA  55          3HB       ALA  55  -8.084 -20.234  -0.521
  435   2HB   ALA  55          2HB       ALA  55  -7.913 -21.792   0.288
  436   3HB   ALA  55          1HB       ALA  55  -6.890 -20.436   0.762
  437    H    ARG  56           H        ARG  56 -10.082 -20.102  -0.797
  438    HA   ARG  56           HA       ARG  56 -12.439 -21.736   0.047
  439   1HB   ARG  56          1HB       ARG  56 -13.887 -20.013  -1.015
  440   2HB   ARG  56          2HB       ARG  56 -12.959 -19.358   0.332
  441   1HG   ARG  56          1HG       ARG  56 -11.210 -18.828  -1.623
  442   2HG   ARG  56          2HG       ARG  56 -12.682 -18.832  -2.592
  443   1HD   ARG  56          1HD       ARG  56 -12.570 -16.589  -1.890
  444   2HD   ARG  56          2HD       ARG  56 -13.611 -17.302  -0.642
  445    HE   ARG  56           HE       ARG  56 -11.565 -17.548   0.773
  446   1HH1  ARG  56          1HH1      ARG  56  -9.143 -17.180   0.171
  447   2HH1  ARG  56          2HH1      ARG  56  -8.809 -15.529  -0.228
  448   1HH2  ARG  56          1HH2      ARG  56 -12.143 -14.688  -0.683
  449   2HH2  ARG  56          2HH2      ARG  56 -10.507 -14.118  -0.712
  450    HA   PRO  57           HA       PRO  57 -10.894 -23.088  -4.045
  451   1HB   PRO  57          1HB       PRO  57 -11.208 -25.762  -3.569
  452   2HB   PRO  57          2HB       PRO  57  -9.762 -24.858  -3.081
  453   1HG   PRO  57          1HG       PRO  57 -12.056 -25.778  -1.447
  454   2HG   PRO  57          2HG       PRO  57 -10.349 -25.626  -1.014
  455   1HD   PRO  57          1HD       PRO  57 -12.332 -23.836  -0.302
  456   2HD   PRO  57          2HD       PRO  57 -10.595 -23.467  -0.342
  457    H    ALA  58           H        ALA  58 -12.096 -24.756  -5.578
  458    HA   ALA  58           HA       ALA  58 -14.852 -23.908  -5.818
  459   1HB   ALA  58          3HB       ALA  58 -14.572 -24.794  -7.902
  460   2HB   ALA  58          2HB       ALA  58 -13.977 -26.327  -7.264
  461   3HB   ALA  58          1HB       ALA  58 -12.880 -24.957  -7.431
  462    HA   PRO  59           HA       PRO  59 -16.989 -27.114  -3.704
  463   1HB   PRO  59          1HB       PRO  59 -18.882 -27.987  -5.477
  464   2HB   PRO  59          2HB       PRO  59 -18.966 -26.405  -4.675
  465   1HG   PRO  59          1HG       PRO  59 -18.092 -27.084  -7.435
  466   2HG   PRO  59          2HG       PRO  59 -19.012 -25.689  -6.852
  467   1HD   PRO  59          1HD       PRO  59 -16.346 -25.608  -7.455
  468   2HD   PRO  59          2HD       PRO  59 -17.131 -24.520  -6.289
  469    H    ASP  60           H        ASP  60 -17.635 -29.524  -3.823
  470    HA   ASP  60           HA       ASP  60 -16.943 -31.759  -4.155
  471   1HB   ASP  60          1HB       ASP  60 -16.457 -30.598  -6.921
  472   2HB   ASP  60          2HB       ASP  60 -16.615 -32.314  -6.548
  473    H    ALA  61           H        ALA  61 -14.995 -30.839  -2.748
  474    HA   ALA  61           HA       ALA  61 -12.470 -30.136  -3.636
  475   1HB   ALA  61          3HB       ALA  61 -12.854 -30.384  -1.317
  476   2HB   ALA  61          1HB       ALA  61 -13.457 -32.031  -1.506
  477   3HB   ALA  61          2HB       ALA  61 -11.735 -31.696  -1.685
  478    HA   PRO  62           HA       PRO  62 -11.810 -33.866  -6.126
  479   1HB   PRO  62          1HB       PRO  62 -10.702 -32.583  -8.267
  480   2HB   PRO  62          2HB       PRO  62 -12.450 -32.692  -8.012
  481   1HG   PRO  62          1HG       PRO  62 -10.689 -30.380  -7.779
  482   2HG   PRO  62          2HG       PRO  62 -12.449 -30.445  -7.920
  483   1HD   PRO  62          1HD       PRO  62 -10.844 -30.066  -5.549
  484   2HD   PRO  62          2HD       PRO  62 -12.610 -29.995  -5.716
  485    H    GLU  63           H        GLU  63 -10.083 -34.902  -5.123
  486    HA   GLU  63           HA       GLU  63  -7.575 -33.701  -4.443
  487   1HB   GLU  63          1HB       GLU  63  -6.907 -36.066  -4.094
  488   2HB   GLU  63          2HB       GLU  63  -8.512 -35.749  -3.434
  489   1HG   GLU  63          1HG       GLU  63  -9.204 -36.482  -5.941
  490   2HG   GLU  63          2HG       GLU  63  -7.718 -37.415  -5.765
  491    H    ASP  64           H        ASP  64  -5.640 -33.566  -5.587
  492    HA   ASP  64           HA       ASP  64  -5.725 -34.414  -8.463
  493   1HB   ASP  64          1HB       ASP  64  -4.612 -32.090  -6.931
  494   2HB   ASP  64          2HB       ASP  64  -3.808 -32.571  -8.426
  495    H    THR  65           H        THR  65  -3.846 -35.452  -9.318
  496    HA   THR  65           HA       THR  65  -1.669 -36.151  -7.400
  497    HB   THR  65           HB       THR  65  -3.238 -38.139  -9.073
  498    HG1  THR  65           HG1      THR  65  -4.604 -37.933  -7.500
  499   1HG2  THR  65          1HG2      THR  65  -0.757 -38.537  -8.400
  500   2HG2  THR  65          2HG2      THR  65  -1.399 -38.748  -6.770
  501   3HG2  THR  65          3HG2      THR  65  -1.930 -39.814  -8.071
  502    H    GLY  66           H        GLY  66  -0.754 -34.473  -9.039
  503   1HA   GLY  66          2HA       GLY  66  -0.123 -34.187 -11.469
  504   2HA   GLY  66          1HA       GLY  66   0.198 -35.922 -11.480
  505    H    ASP  67           H        ASP  67   1.228 -32.876  -9.937
  506    HA   ASP  67           HA       ASP  67   3.696 -34.038  -8.887
  507   1HB   ASP  67          1HB       ASP  67   4.012 -33.981 -11.379
  508   2HB   ASP  67          2HB       ASP  67   3.805 -32.230 -11.323
  509    H    SER  68           H        SER  68   4.466 -32.679  -7.289
  510    HA   SER  68           HA       SER  68   3.037 -30.186  -6.732
  511   1HB   SER  68          1HB       SER  68   4.599 -30.213  -4.759
  512   2HB   SER  68          2HB       SER  68   3.699 -31.714  -4.956
  513    HG   SER  68           HG       SER  68   6.396 -31.187  -5.243
  514    H    ASP  69           H        ASP  69   3.812 -29.202  -8.884
  515    HA   ASP  69           HA       ASP  69   6.603 -28.494  -9.219
  516   1HB   ASP  69          1HB       ASP  69   3.978 -27.516 -10.377
  517   2HB   ASP  69          2HB       ASP  69   5.545 -26.929 -10.935
  518    H    GLU  70           H        GLU  70   7.687 -26.749  -8.367
  519    HA   GLU  70           HA       GLU  70   6.608 -25.179  -6.235
  520   1HB   GLU  70          1HB       GLU  70   8.728 -23.901  -6.550
  521   2HB   GLU  70          2HB       GLU  70   8.996 -25.644  -6.571
  522   1HG   GLU  70          1HG       GLU  70   9.710 -25.614  -8.718
  523   2HG   GLU  70          2HG       GLU  70   8.385 -24.566  -9.227
  524    H    TRP  71           H        TRP  71   7.247 -22.546  -6.740
  525    HA   TRP  71           HA       TRP  71   5.098 -21.750  -8.642
  526   1HB   TRP  71          1HB       TRP  71   5.157 -20.990  -6.255
  527   2HB   TRP  71          2HB       TRP  71   6.669 -20.149  -6.602
  528    HD1  TRP  71           HD1      TRP  71   6.501 -17.817  -7.595
  529    HE1  TRP  71           HE1      TRP  71   4.589 -16.356  -8.525
  530    HE3  TRP  71           HE3      TRP  71   2.725 -21.240  -7.617
  531    HZ2  TRP  71           HZ2      TRP  71   1.824 -16.619  -9.188
  532    HZ3  TRP  71           HZ3      TRP  71   0.464 -20.615  -8.405
  533    HH2  TRP  71           HH2      TRP  71   0.005 -18.307  -9.192
  534    H    VAL  72           H        VAL  72   6.056 -21.711 -10.693
  535    HA   VAL  72           HA       VAL  72   8.725 -20.904 -11.300
  536    HB   VAL  72           HB       VAL  72   7.277 -22.182 -12.802
  537   1HG1  VAL  72          1HG1      VAL  72   5.579 -19.696 -12.646
  538   2HG1  VAL  72          2HG1      VAL  72   5.457 -20.791 -14.024
  539   3HG1  VAL  72          3HG1      VAL  72   5.098 -21.375 -12.399
  540   1HG2  VAL  72          1HG2      VAL  72   9.066 -20.571 -13.699
  541   2HG2  VAL  72          2HG2      VAL  72   7.838 -21.105 -14.847
  542   3HG2  VAL  72          3HG2      VAL  72   7.728 -19.502 -14.121
  543    H    PHE  73           H        PHE  73   9.230 -18.895 -12.632
  544    HA   PHE  73           HA       PHE  73   8.075 -16.510 -11.273
  545   1HB   PHE  73          1HB       PHE  73  10.620 -17.300 -11.706
  546   2HB   PHE  73          2HB       PHE  73  10.365 -16.354 -13.173
  547    HD1  PHE  73           HD1      PHE  73  10.213 -16.227  -9.457
  548    HD2  PHE  73           HD2      PHE  73  10.270 -13.974 -13.113
  549    HE1  PHE  73           HE1      PHE  73  10.518 -14.134  -8.162
  550    HE2  PHE  73           HE2      PHE  73  10.575 -11.881 -11.820
  551    HZ   PHE  73           HZ       PHE  73  10.699 -11.961  -9.344
  552    H    ASP  74           H        ASP  74   9.168 -17.322 -14.594
  553    HA   ASP  74           HA       ASP  74   8.347 -16.598 -16.690
  554   1HB   ASP  74          1HB       ASP  74   6.415 -17.882 -15.308
  555   2HB   ASP  74          2HB       ASP  74   5.630 -16.315 -15.503
  556    H    LYS  75           H        LYS  75   6.441 -14.814 -17.468
  557    HA   LYS  75           HA       LYS  75   7.603 -12.254 -16.925
  558   1HB   LYS  75          1HB       LYS  75   5.520 -13.457 -18.533
  559   2HB   LYS  75          2HB       LYS  75   4.940 -11.939 -17.849
  560   1HG   LYS  75          1HG       LYS  75   7.682 -12.046 -19.066
  561   2HG   LYS  75          2HG       LYS  75   6.273 -11.921 -20.120
  562   1HD   LYS  75          1HD       LYS  75   6.338 -10.091 -17.776
  563   2HD   LYS  75          2HD       LYS  75   7.493  -9.758 -19.067
  564   1HE   LYS  75          1HE       LYS  75   5.859  -9.056 -20.495
  565   2HE   LYS  75          2HE       LYS  75   4.767 -10.376 -20.028
  566   1HZ   LYS  75          1HZ       LYS  75   5.405  -8.111 -18.225
  567   2HZ   LYS  75          2HZ       LYS  75   4.076  -8.085 -19.282
  568   3HZ   LYS  75          3HZ       LYS  75   4.168  -9.258 -18.057
  569    H    LYS  76           H        LYS  76   7.591 -11.946 -14.614
  570    HA   LYS  76           HA       LYS  76   5.280 -12.200 -12.939
  571   1HB   LYS  76          1HB       LYS  76   8.013 -11.455 -12.767
  572   2HB   LYS  76          2HB       LYS  76   7.094 -10.111 -12.091
  573   1HG   LYS  76          1HG       LYS  76   5.771 -12.047 -10.866
  574   2HG   LYS  76          2HG       LYS  76   7.253 -12.955 -11.160
  575   1HD   LYS  76          1HD       LYS  76   8.523 -11.015 -10.130
  576   2HD   LYS  76          2HD       LYS  76   6.964 -10.354  -9.639
  577   1HE   LYS  76          1HE       LYS  76   6.717 -12.927  -8.746
  578   2HE   LYS  76          2HE       LYS  76   8.456 -12.653  -8.525
  579   1HZ   LYS  76          1HZ       LYS  76   6.409 -10.667  -7.717
  580   2HZ   LYS  76          2HZ       LYS  76   6.986 -11.860  -6.655
  581   3HZ   LYS  76          3HZ       LYS  76   8.050 -10.701  -7.293
  582    H    LEU  77           H        LEU  77   3.704 -10.665 -12.355
  583    HA   LEU  77           HA       LEU  77   3.553  -8.242 -14.107
  584   1HB   LEU  77          1HB       LEU  77   1.807 -10.306 -13.707
  585   2HB   LEU  77          2HB       LEU  77   1.216  -9.139 -12.523
  586    HG   LEU  77           HG       LEU  77   1.256  -7.402 -14.372
  587   1HD1  LEU  77          1HD1      LEU  77   1.908  -9.899 -15.933
  588   2HD1  LEU  77          2HD1      LEU  77   1.086  -8.541 -16.699
  589   3HD1  LEU  77          3HD1      LEU  77   2.692  -8.321 -16.004
  590   1HD2  LEU  77          1HD2      LEU  77  -0.770  -8.791 -13.581
  591   2HD2  LEU  77          2HD2      LEU  77  -0.897  -8.023 -15.163
  592   3HD2  LEU  77          3HD2      LEU  77  -0.533  -9.744 -15.045
  593    H    LEU  78           H        LEU  78   2.382  -6.353 -12.986
  594    HA   LEU  78           HA       LEU  78   3.006  -6.207 -10.064
  595   1HB   LEU  78          1HB       LEU  78   4.044  -3.987 -10.501
  596   2HB   LEU  78          2HB       LEU  78   4.892  -5.281 -11.345
  597    HG   LEU  78           HG       LEU  78   2.702  -4.183 -12.942
  598   1HD1  LEU  78          1HD1      LEU  78   4.728  -2.348 -11.721
  599   2HD1  LEU  78          2HD1      LEU  78   4.286  -2.096 -13.409
  600   3HD1  LEU  78          3HD1      LEU  78   3.048  -2.033 -12.156
  601   1HD2  LEU  78          1HD2      LEU  78   5.631  -4.800 -13.225
  602   2HD2  LEU  78          2HD2      LEU  78   4.262  -5.470 -14.113
  603   3HD2  LEU  78          3HD2      LEU  78   4.826  -3.835 -14.462
  604    H    CYS  79           H        CYS  79   0.425  -6.570 -11.136
  605    HA   CYS  79           HA       CYS  79  -0.877  -4.055 -10.271
  606   1HB   CYS  79          1HB       CYS  79  -0.763  -5.143 -13.046
  607   2HB   CYS  79          2HB       CYS  79  -2.305  -4.475 -12.514
  608    HG   CYS  79           HG       CYS  79  -1.089  -2.198 -12.032
  609    H    GLU  80           H        GLU  80  -2.524  -4.676  -8.935
  610    HA   GLU  80           HA       GLU  80  -3.344  -7.384  -8.547
  611   1HB   GLU  80          1HB       GLU  80  -3.520  -5.495  -6.927
  612   2HB   GLU  80          2HB       GLU  80  -4.795  -4.791  -7.921
  613   1HG   GLU  80          1HG       GLU  80  -5.931  -6.012  -6.220
  614   2HG   GLU  80          2HG       GLU  80  -6.023  -7.026  -7.661
  615    H    THR  81           H        THR  81  -5.318  -4.705  -9.907
  616    HA   THR  81           HA       THR  81  -7.145  -6.642 -11.163
  617    HB   THR  81           HB       THR  81  -7.259  -3.706 -11.678
  618    HG1  THR  81           HG1      THR  81  -7.763  -4.862  -9.139
  619   1HG2  THR  81          1HG2      THR  81  -8.988  -5.881 -11.878
  620   2HG2  THR  81          2HG2      THR  81  -9.543  -5.021 -10.442
  621   3HG2  THR  81          3HG2      THR  81  -9.438  -4.179 -11.988
  622    H    GLU  82           H        GLU  82  -7.811  -5.819 -13.551
  623    HA   GLU  82           HA       GLU  82  -5.645  -6.454 -15.305
  624   1HB   GLU  82          1HB       GLU  82  -8.235  -6.541 -15.573
  625   2HB   GLU  82          2HB       GLU  82  -8.088  -4.856 -16.073
  626   1HG   GLU  82          1HG       GLU  82  -6.122  -5.960 -17.578
  627   2HG   GLU  82          2HG       GLU  82  -7.234  -7.326 -17.478
  628    H    GLY  83           H        GLY  83  -6.895  -3.370 -14.113
  629   1HA   GLY  83          2HA       GLY  83  -5.643  -1.615 -15.955
  630   2HA   GLY  83          1HA       GLY  83  -4.478  -1.956 -14.674
  631    H    ARG  84           H        ARG  84  -6.362  -2.204 -12.529
  632    HA   ARG  84           HA       ARG  84  -7.734   0.443 -12.440
  633   1HB   ARG  84          1HB       ARG  84  -8.633  -1.987 -11.815
  634   2HB   ARG  84          2HB       ARG  84  -7.855  -1.624 -10.274
  635   1HG   ARG  84          1HG       ARG  84  -9.322   0.081  -9.774
  636   2HG   ARG  84          2HG       ARG  84  -9.574   0.500 -11.468
  637   1HD   ARG  84          1HD       ARG  84 -11.205  -1.136 -11.773
  638   2HD   ARG  84          2HD       ARG  84 -10.560  -2.161 -10.475
  639    HE   ARG  84           HE       ARG  84 -11.889   0.463  -9.903
  640   1HH1  ARG  84          1HH1      ARG  84 -14.027  -1.173  -9.537
  641   2HH1  ARG  84          2HH1      ARG  84 -13.812  -1.993  -8.027
  642   1HH2  ARG  84          1HH2      ARG  84 -10.413  -1.328  -7.846
  643   2HH2  ARG  84          2HH2      ARG  84 -11.766  -2.080  -7.069
  644    H    VAL  85           H        VAL  85  -5.595  -1.577 -10.393
  645    HA   VAL  85           HA       VAL  85  -4.959   0.490  -8.506
  646    HB   VAL  85           HB       VAL  85  -4.683  -1.926  -8.120
  647   1HG1  VAL  85          1HG1      VAL  85  -3.473  -1.846 -10.676
  648   2HG1  VAL  85          2HG1      VAL  85  -2.206  -2.331  -9.551
  649   3HG1  VAL  85          3HG1      VAL  85  -3.703  -3.258  -9.646
  650   1HG2  VAL  85          1HG2      VAL  85  -3.235  -0.269  -6.904
  651   2HG2  VAL  85          2HG2      VAL  85  -2.494  -1.863  -7.065
  652   3HG2  VAL  85          3HG2      VAL  85  -1.983  -0.542  -8.118
  653    H    ARG  86           H        ARG  86  -3.400   2.100  -8.593
  654    HA   ARG  86           HA       ARG  86  -1.555   2.107 -10.959
  655   1HB   ARG  86          1HB       ARG  86  -3.721   3.836 -10.276
  656   2HB   ARG  86          2HB       ARG  86  -2.230   4.757 -10.074
  657   1HG   ARG  86          1HG       ARG  86  -2.775   5.069 -12.351
  658   2HG   ARG  86          2HG       ARG  86  -1.559   3.792 -12.382
  659   1HD   ARG  86          1HD       ARG  86  -3.540   2.135 -12.286
  660   2HD   ARG  86          2HD       ARG  86  -4.553   3.528 -12.720
  661    HE   ARG  86           HE       ARG  86  -2.249   3.433 -14.437
  662   1HH1  ARG  86          1HH1      ARG  86  -5.365   3.639 -14.923
  663   2HH1  ARG  86          2HH1      ARG  86  -5.556   2.326 -16.037
  664   1HH2  ARG  86          1HH2      ARG  86  -2.434   0.967 -15.384
  665   2HH2  ARG  86          2HH2      ARG  86  -3.898   0.814 -16.297
  666    H    VAL  87           H        VAL  87   0.377   1.607  -9.910
  667    HA   VAL  87           HA       VAL  87   1.205   3.443  -7.686
  668    HB   VAL  87           HB       VAL  87   1.679   0.460  -8.014
  669   1HG1  VAL  87          1HG1      VAL  87   3.597   1.625  -6.969
  670   2HG1  VAL  87          2HG1      VAL  87   2.505   2.353  -5.789
  671   3HG1  VAL  87          3HG1      VAL  87   2.754   0.606  -5.802
  672   1HG2  VAL  87          1HG2      VAL  87  -0.228   2.134  -6.430
  673   2HG2  VAL  87          2HG2      VAL  87  -0.480   0.559  -7.183
  674   3HG2  VAL  87          3HG2      VAL  87   0.417   0.680  -5.669
  675    H    GLU  88           H        GLU  88   2.663   4.740  -8.818
  676    HA   GLU  88           HA       GLU  88   4.947   3.331 -10.149
  677   1HB   GLU  88          1HB       GLU  88   3.324   5.693 -11.150
  678   2HB   GLU  88          2HB       GLU  88   4.797   5.101 -11.919
  679   1HG   GLU  88          1HG       GLU  88   3.769   2.944 -12.351
  680   2HG   GLU  88          2HG       GLU  88   2.328   3.408 -11.446
  681    H    THR  89           H        THR  89   6.812   3.998  -9.169
  682    HA   THR  89           HA       THR  89   6.848   6.502  -7.586
  683    HB   THR  89           HB       THR  89   8.822   4.234  -8.022
  684    HG1  THR  89           HG1      THR  89   7.694   3.319  -6.532
  685   1HG2  THR  89          1HG2      THR  89   9.387   6.800  -7.095
  686   2HG2  THR  89          2HG2      THR  89   9.160   5.861  -5.622
  687   3HG2  THR  89          3HG2      THR  89  10.359   5.357  -6.811
  688    H    THR  90           H        THR  90   7.781   8.367  -8.362
  689    HA   THR  90           HA       THR  90   8.822   8.469 -11.078
  690    HB   THR  90           HB       THR  90   7.486  10.258 -10.024
  691    HG1  THR  90           HG1      THR  90   8.773  11.926 -10.731
  692   1HG2  THR  90          1HG2      THR  90   9.070   9.770  -7.812
  693   2HG2  THR  90          2HG2      THR  90   9.680  11.317  -8.401
  694   3HG2  THR  90          3HG2      THR  90   7.973  11.137  -8.002
  695    H    LYS  91           H        LYS  91  10.944  10.184 -10.988
  696    HA   LYS  91           HA       LYS  91  13.207   8.552 -10.607
  697   1HB   LYS  91          1HB       LYS  91  12.966  10.683 -11.928
  698   2HB   LYS  91          2HB       LYS  91  13.061  11.573 -10.407
  699   1HG   LYS  91          1HG       LYS  91  15.269  10.526  -9.957
  700   2HG   LYS  91          2HG       LYS  91  15.180   9.711 -11.518
  701   1HD   LYS  91          1HD       LYS  91  15.908  11.552 -12.589
  702   2HD   LYS  91          2HD       LYS  91  14.646  12.535 -11.847
  703   1HE   LYS  91          1HE       LYS  91  16.273  12.284  -9.711
  704   2HE   LYS  91          2HE       LYS  91  17.480  12.159 -11.008
  705   1HZ   LYS  91          1HZ       LYS  91  15.384  14.259 -10.827
  706   2HZ   LYS  91          2HZ       LYS  91  17.015  14.481 -10.407
  707   3HZ   LYS  91          3HZ       LYS  91  16.595  14.147 -12.015
  708    H    ASP  92           H        ASP  92  11.565  10.642  -8.250
  709    HA   ASP  92           HA       ASP  92  13.205   9.418  -6.107
  710   1HB   ASP  92          1HB       ASP  92  14.283  11.538  -7.198
  711   2HB   ASP  92          2HB       ASP  92  13.055  12.420  -6.287
  712    H    ARG  93           H        ARG  93  10.455   9.059  -6.499
  713    HA   ARG  93           HA       ARG  93   9.391  10.045  -3.975
  714   1HB   ARG  93          1HB       ARG  93   9.233  11.733  -6.225
  715   2HB   ARG  93          2HB       ARG  93   7.617  11.050  -6.048
  716   1HG   ARG  93          1HG       ARG  93   7.760  11.663  -3.581
  717   2HG   ARG  93          2HG       ARG  93   9.211  12.581  -3.983
  718   1HD   ARG  93          1HD       ARG  93   6.933  13.133  -5.776
  719   2HD   ARG  93          2HD       ARG  93   6.668  13.617  -4.089
  720    HE   ARG  93           HE       ARG  93   9.249  14.352  -5.378
  721   1HH1  ARG  93          1HH1      ARG  93   7.443  15.175  -2.806
  722   2HH1  ARG  93          2HH1      ARG  93   7.258  16.855  -3.183
  723   1HH2  ARG  93          1HH2      ARG  93   8.477  16.535  -6.413
  724   2HH2  ARG  93          2HH2      ARG  93   7.844  17.626  -5.226
  725    H    SER  94           H        SER  94   8.576   8.028  -3.456
  726    HA   SER  94           HA       SER  94   7.298   6.265  -5.385
  727   1HB   SER  94          1HB       SER  94   6.895   4.917  -3.363
  728   2HB   SER  94          2HB       SER  94   8.539   5.549  -3.352
  729    HG   SER  94           HG       SER  94   7.217   5.784  -1.366
  730    H    ILE  95           H        ILE  95   5.265   6.648  -6.170
  731    HA   ILE  95           HA       ILE  95   3.344   8.125  -4.415
  732    HB   ILE  95           HB       ILE  95   4.238   8.405  -7.120
  733   1HG1  ILE  95          1HG1      ILE  95   1.966  10.064  -6.590
  734   2HG1  ILE  95          2HG1      ILE  95   2.875   9.888  -5.090
  735   1HG2  ILE  95          1HG2      ILE  95   1.294   7.708  -6.884
  736   2HG2  ILE  95          2HG2      ILE  95   2.030   8.479  -8.289
  737   3HG2  ILE  95          3HG2      ILE  95   2.506   6.844  -7.831
  738   1HD1  ILE  95          1HD1      ILE  95   4.945  10.301  -6.726
  739   2HD1  ILE  95          2HD1      ILE  95   3.710  11.127  -7.675
  740   3HD1  ILE  95          3HD1      ILE  95   4.046  11.645  -6.023
  741    H    PHE  96           H        PHE  96   1.605   6.998  -3.676
  742    HA   PHE  96           HA       PHE  96   0.926   4.407  -5.028
  743   1HB   PHE  96          1HB       PHE  96   1.829   4.308  -2.692
  744   2HB   PHE  96          2HB       PHE  96   0.486   5.313  -2.161
  745    HD1  PHE  96           HD1      PHE  96   0.329   3.141  -0.625
  746    HD2  PHE  96           HD2      PHE  96  -0.662   3.259  -4.808
  747    HE1  PHE  96           HE1      PHE  96  -1.076   1.114  -0.356
  748    HE2  PHE  96           HE2      PHE  96  -2.064   1.237  -4.532
  749    HZ   PHE  96           HZ       PHE  96  -2.272   0.164  -2.308
  750    H    THR  97           H        THR  97  -0.622   5.280  -6.468
  751    HA   THR  97           HA       THR  97  -3.002   6.563  -5.173
  752    HB   THR  97           HB       THR  97  -1.961   8.205  -6.535
  753    HG1  THR  97           HG1      THR  97  -3.532   8.574  -7.942
  754   1HG2  THR  97          1HG2      THR  97  -1.556   5.992  -8.562
  755   2HG2  THR  97          2HG2      THR  97  -1.236   7.695  -8.889
  756   3HG2  THR  97          3HG2      THR  97  -0.308   6.845  -7.655
  757    H    VAL  98           H        VAL  98  -4.385   4.822  -4.982
  758    HA   VAL  98           HA       VAL  98  -4.883   3.197  -7.459
  759    HB   VAL  98           HB       VAL  98  -3.800   1.993  -5.588
  760   1HG1  VAL  98          1HG1      VAL  98  -5.391   3.605  -3.985
  761   2HG1  VAL  98          2HG1      VAL  98  -6.152   2.024  -3.839
  762   3HG1  VAL  98          3HG1      VAL  98  -4.448   2.222  -3.431
  763   1HG2  VAL  98          1HG2      VAL  98  -6.034   1.201  -7.020
  764   2HG2  VAL  98          2HG2      VAL  98  -5.023   0.139  -6.041
  765   3HG2  VAL  98          3HG2      VAL  98  -6.490   0.838  -5.356
  766    H    GLU  99           H        GLU  99  -7.047   2.881  -8.051
  767    HA   GLU  99           HA       GLU  99  -9.049   4.542  -6.576
  768   1HB   GLU  99          1HB       GLU  99 -10.232   4.499  -8.776
  769   2HB   GLU  99          2HB       GLU  99  -8.599   5.151  -8.911
  770   1HG   GLU  99          1HG       GLU  99  -7.866   3.399 -10.171
  771   2HG   GLU  99          2HG       GLU  99  -8.797   2.219  -9.250
  772    H    GLY 100           H        GLY 100  -8.926   2.417  -5.132
  773   1HA   GLY 100          2HA       GLY 100 -10.872   0.429  -6.228
  774   2HA   GLY 100          1HA       GLY 100 -11.017   1.062  -4.588
  775    H    ALA 101           H        ALA 101  -8.274   1.044  -3.878
  776    HA   ALA 101           HA       ALA 101  -6.850  -1.346  -4.402
  777   1HB   ALA 101          3HB       ALA 101  -5.571   0.123  -3.202
  778   2HB   ALA 101          1HB       ALA 101  -6.963   0.777  -2.341
  779   3HB   ALA 101          2HB       ALA 101  -6.226  -0.734  -1.808
  780    H    GLU 102           H        GLU 102  -8.140  -0.936  -1.134
  781    HA   GLU 102           HA       GLU 102  -9.595  -3.541  -1.389
  782   1HB   GLU 102          1HB       GLU 102  -7.294  -2.723   0.306
  783   2HB   GLU 102          2HB       GLU 102  -8.551  -3.656   1.118
  784   1HG   GLU 102          1HG       GLU 102  -8.125  -5.551  -0.099
  785   2HG   GLU 102          2HG       GLU 102  -7.702  -4.645  -1.553
  786    H    LYS 103           H        LYS 103 -11.415  -3.710   0.072
  787    HA   LYS 103           HA       LYS 103 -12.399  -1.079   1.052
  788   1HB   LYS 103          1HB       LYS 103 -13.598  -3.816   0.553
  789   2HB   LYS 103          2HB       LYS 103 -14.511  -2.522   1.329
  790   1HG   LYS 103          1HG       LYS 103 -13.616  -1.136  -0.772
  791   2HG   LYS 103          2HG       LYS 103 -13.564  -2.744  -1.495
  792   1HD   LYS 103          1HD       LYS 103 -16.034  -2.358  -0.013
  793   2HD   LYS 103          2HD       LYS 103 -15.826  -1.099  -1.230
  794   1HE   LYS 103          1HE       LYS 103 -16.014  -2.577  -2.983
  795   2HE   LYS 103          2HE       LYS 103 -15.211  -3.888  -2.094
  796   1HZ   LYS 103          1HZ       LYS 103 -17.878  -2.831  -1.339
  797   2HZ   LYS 103          2HZ       LYS 103 -17.683  -4.148  -2.395
  798   3HZ   LYS 103          3HZ       LYS 103 -17.129  -4.252  -0.792
  799    H    GLU 104           H        GLU 104 -12.489  -4.437   2.297
  800    HA   GLU 104           HA       GLU 104 -12.368  -3.387   5.079
  801   1HB   GLU 104          1HB       GLU 104 -12.936  -6.115   3.875
  802   2HB   GLU 104          2HB       GLU 104 -13.026  -5.745   5.597
  803   1HG   GLU 104          1HG       GLU 104 -14.582  -3.759   4.655
  804   2HG   GLU 104          2HG       GLU 104 -14.864  -4.959   3.394
  805    H    ASP 105           H        ASP 105 -10.203  -4.446   2.736
  806    HA   ASP 105           HA       ASP 105  -8.484  -6.073   4.466
  807   1HB   ASP 105          1HB       ASP 105  -8.956  -5.719   1.739
  808   2HB   ASP 105          2HB       ASP 105  -7.333  -5.072   1.982
  809    H    GLU 106           H        GLU 106  -8.973  -3.005   5.015
  810    HA   GLU 106           HA       GLU 106  -6.549  -1.583   4.540
  811   1HB   GLU 106          1HB       GLU 106  -7.346  -0.200   6.447
  812   2HB   GLU 106          2HB       GLU 106  -8.652  -0.592   5.347
  813   1HG   GLU 106          1HG       GLU 106  -9.757  -1.310   7.185
  814   2HG   GLU 106          2HG       GLU 106  -8.713  -2.727   7.089
  815    H    GLY 107           H        GLY 107  -5.954  -0.921   7.369
  816   1HA   GLY 107          2HA       GLY 107  -4.463  -3.408   8.128
  817   2HA   GLY 107          1HA       GLY 107  -5.110  -2.281   9.319
  818    H    VAL 108           H        VAL 108  -2.343  -3.136   7.617
  819    HA   VAL 108           HA       VAL 108  -1.164  -0.397   7.772
  820    HB   VAL 108           HB       VAL 108  -0.142  -2.906   9.143
  821   1HG1  VAL 108          1HG1      VAL 108   1.012  -0.122   8.840
  822   2HG1  VAL 108          2HG1      VAL 108   1.532  -1.232  10.107
  823   3HG1  VAL 108          3HG1      VAL 108   1.768  -1.658   8.413
  824   1HG2  VAL 108          1HG2      VAL 108  -1.385  -0.329  10.129
  825   2HG2  VAL 108          2HG2      VAL 108  -1.951  -1.976  10.406
  826   3HG2  VAL 108          3HG2      VAL 108  -0.473  -1.409  11.183
  827    H    TYR 109           H        TYR 109   0.898  -0.247   6.639
  828    HA   TYR 109           HA       TYR 109   1.425  -2.464   4.684
  829   1HB   TYR 109          1HB       TYR 109   0.964   0.492   4.284
  830   2HB   TYR 109          2HB       TYR 109   1.961  -0.406   3.144
  831    HD1  TYR 109           HD1      TYR 109  -1.383  -0.538   4.830
  832    HD2  TYR 109           HD2      TYR 109   0.970  -1.596   1.397
  833    HE1  TYR 109           HE1      TYR 109  -3.417  -1.396   3.698
  834    HE2  TYR 109           HE2      TYR 109  -1.063  -2.454   0.266
  835    HH   TYR 109           HH       TYR 109  -4.093  -1.717   1.130
  836    H    THR 110           H        THR 110   3.660  -2.408   3.845
  837    HA   THR 110           HA       THR 110   5.559  -0.772   5.480
  838    HB   THR 110           HB       THR 110   5.939  -3.695   4.771
  839    HG1  THR 110           HG1      THR 110   5.056  -4.205   6.665
  840   1HG2  THR 110          1HG2      THR 110   7.382  -1.650   6.427
  841   2HG2  THR 110          2HG2      THR 110   7.487  -3.353   6.875
  842   3HG2  THR 110          3HG2      THR 110   8.038  -2.824   5.285
  843    H    VAL 111           H        VAL 111   6.207   0.567   3.792
  844    HA   VAL 111           HA       VAL 111   6.745  -0.559   1.131
  845    HB   VAL 111           HB       VAL 111   5.606   1.632   1.657
  846   1HG1  VAL 111          1HG1      VAL 111   7.338   2.165   3.484
  847   2HG1  VAL 111          2HG1      VAL 111   8.374   2.696   2.158
  848   3HG1  VAL 111          3HG1      VAL 111   6.823   3.488   2.437
  849   1HG2  VAL 111          1HG2      VAL 111   8.034   1.452  -0.105
  850   2HG2  VAL 111          2HG2      VAL 111   6.332   1.432  -0.566
  851   3HG2  VAL 111          3HG2      VAL 111   7.082   2.937  -0.032
  852    H    THR 112           H        THR 112   8.726  -1.342   0.567
  853    HA   THR 112           HA       THR 112  11.045  -0.762   2.347
  854    HB   THR 112           HB       THR 112  10.514  -2.840   0.198
  855    HG1  THR 112           HG1      THR 112  10.376  -4.193   2.055
  856   1HG2  THR 112          1HG2      THR 112  12.924  -2.111   1.756
  857   2HG2  THR 112          2HG2      THR 112  12.534  -3.831   1.731
  858   3HG2  THR 112          3HG2      THR 112  12.791  -2.964   0.217
  859    H    VAL 113           H        VAL 113  12.479   0.753   1.671
  860    HA   VAL 113           HA       VAL 113  12.653   1.466  -1.223
  861    HB   VAL 113           HB       VAL 113  13.735   2.745   1.314
  862   1HG1  VAL 113          1HG1      VAL 113  14.917   3.189  -0.944
  863   2HG1  VAL 113          2HG1      VAL 113  13.450   4.064  -1.379
  864   3HG1  VAL 113          3HG1      VAL 113  14.410   4.585   0.006
  865   1HG2  VAL 113          1HG2      VAL 113  11.227   3.111  -0.303
  866   2HG2  VAL 113          2HG2      VAL 113  11.413   3.019   1.447
  867   3HG2  VAL 113          3HG2      VAL 113  11.906   4.474   0.584
  868    H    LYS 114           H        LYS 114  14.400   0.629  -2.381
  869    HA   LYS 114           HA       LYS 114  16.867  -0.109  -0.842
  870   1HB   LYS 114          1HB       LYS 114  14.937  -1.772  -2.309
  871   2HB   LYS 114          2HB       LYS 114  16.614  -2.068  -2.767
  872   1HG   LYS 114          1HG       LYS 114  16.771  -1.898  -0.013
  873   2HG   LYS 114          2HG       LYS 114  15.221  -2.704  -0.260
  874   1HD   LYS 114          1HD       LYS 114  17.098  -3.850  -2.086
  875   2HD   LYS 114          2HD       LYS 114  17.850  -3.815  -0.492
  876   1HE   LYS 114          1HE       LYS 114  15.470  -4.723   0.285
  877   2HE   LYS 114          2HE       LYS 114  15.403  -5.291  -1.396
  878   1HZ   LYS 114          1HZ       LYS 114  17.693  -5.722   0.451
  879   2HZ   LYS 114          2HZ       LYS 114  16.515  -6.892   0.087
  880   3HZ   LYS 114          3HZ       LYS 114  17.546  -6.322  -1.133
  881    H    ASN 115           H        ASN 115  18.728  -0.560  -2.331
  882    HA   ASN 115           HA       ASN 115  18.707   0.373  -5.081
  883   1HB   ASN 115          1HB       ASN 115  19.139   2.221  -2.855
  884   2HB   ASN 115          2HB       ASN 115  20.485   2.225  -3.987
  885   1HD2  ASN 115          2HD2      ASN 115  18.863   1.635  -6.382
  886   2HD2  ASN 115          1HD2      ASN 115  17.940   3.020  -6.692
  887    HA   PRO 116           HA       PRO 116  22.538  -1.786  -5.087
  888   1HB   PRO 116          1HB       PRO 116  24.212  -0.261  -6.626
  889   2HB   PRO 116          2HB       PRO 116  22.862  -1.199  -7.297
  890   1HG   PRO 116          1HG       PRO 116  23.026   1.711  -6.685
  891   2HG   PRO 116          2HG       PRO 116  22.270   0.886  -8.058
  892   1HD   PRO 116          1HD       PRO 116  20.861   1.849  -5.941
  893   2HD   PRO 116          2HD       PRO 116  20.340   0.449  -6.904
  894    H    VAL 117           H        VAL 117  22.389   1.259  -3.569
  895    HA   VAL 117           HA       VAL 117  25.206   1.046  -2.592
  896    HB   VAL 117           HB       VAL 117  23.192   3.312  -2.435
  897   1HG1  VAL 117          1HG1      VAL 117  26.156   3.150  -1.811
  898   2HG1  VAL 117          2HG1      VAL 117  25.234   4.651  -1.890
  899   3HG1  VAL 117          3HG1      VAL 117  24.855   3.447  -0.658
  900   1HG2  VAL 117          1HG2      VAL 117  25.512   2.760  -4.308
  901   2HG2  VAL 117          2HG2      VAL 117  23.809   2.899  -4.744
  902   3HG2  VAL 117          3HG2      VAL 117  24.696   4.318  -4.187
  903    H    GLY 118           H        GLY 118  21.812   1.129  -1.487
  904   1HA   GLY 118          2HA       GLY 118  22.029   1.496   1.229
  905   2HA   GLY 118          1HA       GLY 118  22.635  -0.146   1.017
  906    H    GLU 119           H        GLU 119  20.243   0.584   2.444
  907    HA   GLU 119           HA       GLU 119  17.923   0.012   0.770
  908   1HB   GLU 119          1HB       GLU 119  18.620  -2.205   0.714
  909   2HB   GLU 119          2HB       GLU 119  19.442  -2.090   2.269
  910   1HG   GLU 119          1HG       GLU 119  17.340  -2.146   3.460
  911   2HG   GLU 119          2HG       GLU 119  16.430  -2.025   1.955
  912    H    ASP 120           H        ASP 120  16.212   0.944   1.815
  913    HA   ASP 120           HA       ASP 120  16.338   1.206   4.804
  914   1HB   ASP 120          1HB       ASP 120  16.116   3.146   2.623
  915   2HB   ASP 120          2HB       ASP 120  14.810   3.314   3.795
  916    H    GLN 121           H        GLN 121  14.137   1.412   5.796
  917    HA   GLN 121           HA       GLN 121  11.912   0.358   4.110
  918   1HB   GLN 121          1HB       GLN 121  13.486  -1.110   6.003
  919   2HB   GLN 121          2HB       GLN 121  11.862  -0.930   6.668
  920   1HG   GLN 121          1HG       GLN 121  11.093  -1.608   4.250
  921   2HG   GLN 121          2HG       GLN 121  12.723  -2.274   4.122
  922   1HE2  GLN 121          2HE2      GLN 121  13.119  -4.275   5.148
  923   2HE2  GLN 121          1HE2      GLN 121  11.998  -5.066   6.148
  924    H    VAL 122           H        VAL 122   9.842   0.936   4.904
  925    HA   VAL 122           HA       VAL 122   9.651   2.452   7.444
  926    HB   VAL 122           HB       VAL 122  10.128   4.298   6.089
  927   1HG1  VAL 122          1HG1      VAL 122   9.217   2.515   3.951
  928   2HG1  VAL 122          2HG1      VAL 122   8.762   4.198   3.702
  929   3HG1  VAL 122          3HG1      VAL 122  10.457   3.766   3.923
  930   1HG2  VAL 122          1HG2      VAL 122   7.694   4.311   7.036
  931   2HG2  VAL 122          2HG2      VAL 122   8.136   5.527   5.837
  932   3HG2  VAL 122          3HG2      VAL 122   7.211   4.106   5.351
  933    H    ASN 123           H        ASN 123   7.401   2.656   8.126
  934    HA   ASN 123           HA       ASN 123   5.669   0.552   6.903
  935   1HB   ASN 123          1HB       ASN 123   5.433   1.991   9.560
  936   2HB   ASN 123          2HB       ASN 123   4.607   0.510   9.084
  937   1HD2  ASN 123          2HD2      ASN 123   6.833   1.243  11.208
  938   2HD2  ASN 123          1HD2      ASN 123   7.966  -0.004  10.996
  939    H    LEU 124           H        LEU 124   3.648   1.067   6.101
  940    HA   LEU 124           HA       LEU 124   2.864   3.960   6.106
  941   1HB   LEU 124          1HB       LEU 124   3.522   3.156   3.919
  942   2HB   LEU 124          2HB       LEU 124   2.536   1.709   4.100
  943    HG   LEU 124           HG       LEU 124   0.810   3.952   4.495
  944   1HD1  LEU 124          1HD1      LEU 124   2.920   4.847   3.014
  945   2HD1  LEU 124          2HD1      LEU 124   1.865   4.220   1.746
  946   3HD1  LEU 124          3HD1      LEU 124   1.274   5.455   2.855
  947   1HD2  LEU 124          1HD2      LEU 124   1.168   1.662   2.624
  948   2HD2  LEU 124          2HD2      LEU 124  -0.254   2.145   3.548
  949   3HD2  LEU 124          3HD2      LEU 124   0.151   2.982   2.049
  950    H    THR 125           H        THR 125   0.989   4.352   7.237
  951    HA   THR 125           HA       THR 125  -0.674   2.118   8.178
  952    HB   THR 125           HB       THR 125  -0.997   5.122   8.464
  953    HG1  THR 125           HG1      THR 125   0.262   4.920  10.261
  954   1HG2  THR 125          1HG2      THR 125  -2.177   2.715   9.829
  955   2HG2  THR 125          2HG2      THR 125  -2.044   4.250  10.686
  956   3HG2  THR 125          3HG2      THR 125  -2.998   4.146   9.205
  957    H    VAL 126           H        VAL 126  -2.770   1.652   7.466
  958    HA   VAL 126           HA       VAL 126  -3.828   3.316   5.208
  959    HB   VAL 126           HB       VAL 126  -2.819   1.187   4.460
  960   1HG1  VAL 126          1HG1      VAL 126  -4.418   0.167   6.729
  961   2HG1  VAL 126          2HG1      VAL 126  -4.471  -0.826   5.274
  962   3HG1  VAL 126          3HG1      VAL 126  -2.924  -0.457   6.034
  963   1HG2  VAL 126          1HG2      VAL 126  -4.847   2.101   3.320
  964   2HG2  VAL 126          2HG2      VAL 126  -4.743   0.343   3.215
  965   3HG2  VAL 126          3HG2      VAL 126  -5.850   1.094   4.365
  966    H    LYS 127           H        LYS 127  -6.203   3.225   4.998
  967    HA   LYS 127           HA       LYS 127  -7.817   2.006   7.108
  968   1HB   LYS 127          1HB       LYS 127  -6.637   4.046   8.115
  969   2HB   LYS 127          2HB       LYS 127  -7.618   5.027   7.026
  970   1HG   LYS 127          1HG       LYS 127  -9.638   4.365   8.059
  971   2HG   LYS 127          2HG       LYS 127  -8.881   2.982   8.848
  972   1HD   LYS 127          1HD       LYS 127  -8.851   4.386  10.654
  973   2HD   LYS 127          2HD       LYS 127  -7.380   4.984   9.887
  974   1HE   LYS 127          1HE       LYS 127  -8.484   7.004  10.076
  975   2HE   LYS 127          2HE       LYS 127  -9.231   6.468   8.558
  976   1HZ   LYS 127          1HZ       LYS 127 -10.273   5.862  11.275
  977   2HZ   LYS 127          2HZ       LYS 127 -10.899   7.055  10.245
  978   3HZ   LYS 127          3HZ       LYS 127 -10.992   5.418   9.801
  979    H    VAL 128           H        VAL 128  -9.482   1.351   5.782
  980    HA   VAL 128           HA       VAL 128 -10.247   2.877   3.407
  981    HB   VAL 128           HB       VAL 128 -11.554   0.503   4.778
  982   1HG1  VAL 128          1HG1      VAL 128 -12.576   2.049   2.784
  983   2HG1  VAL 128          2HG1      VAL 128 -11.657   0.876   1.840
  984   3HG1  VAL 128          3HG1      VAL 128 -12.912   0.325   2.951
  985   1HG2  VAL 128          1HG2      VAL 128  -8.990   0.599   3.745
  986   2HG2  VAL 128          2HG2      VAL 128  -9.972  -0.860   3.872
  987   3HG2  VAL 128          3HG2      VAL 128  -9.933   0.048   2.362
  988    H    ILE 129           H        ILE 129 -11.560   4.627   3.538
  989    HA   ILE 129           HA       ILE 129 -13.388   4.958   5.853
  990    HB   ILE 129           HB       ILE 129 -12.438   6.743   3.587
  991   1HG1  ILE 129          1HG1      ILE 129 -10.716   6.177   5.262
  992   2HG1  ILE 129          2HG1      ILE 129 -11.176   7.875   5.385
  993   1HG2  ILE 129          1HG2      ILE 129 -14.263   7.297   5.933
  994   2HG2  ILE 129          2HG2      ILE 129 -13.456   8.570   5.017
  995   3HG2  ILE 129          3HG2      ILE 129 -14.619   7.512   4.220
  996   1HD1  ILE 129          1HD1      ILE 129 -12.974   6.573   7.075
  997   2HD1  ILE 129          2HD1      ILE 129 -11.448   5.739   7.357
  998   3HD1  ILE 129          3HD1      ILE 129 -11.552   7.485   7.579
  999    H    ASP 130           H        ASP 130 -15.632   5.795   5.289
 1000    HA   ASP 130           HA       ASP 130 -16.650   4.480   2.789
 1001   1HB   ASP 130          1HB       ASP 130 -17.169   3.760   5.327
 1002   2HB   ASP 130          2HB       ASP 130 -18.401   5.010   5.149

  No H/Q in entry =        1002
  Start of MODEL    6
    1    H1   ARG   1          1H        ARG   1  27.539   4.878  -8.000
    2    H2   ARG   1          2H        ARG   1  28.303   5.903  -9.120
    3    H3   ARG   1          3H        ARG   1  29.216   4.766  -8.253
    4    HA   ARG   1           HA       ARG   1  28.862   5.931  -6.197
    5   1HB   ARG   1          1HB       ARG   1  29.686   7.552  -8.622
    6   2HB   ARG   1          2HB       ARG   1  29.952   8.107  -6.969
    7   1HG   ARG   1          1HG       ARG   1  30.948   5.577  -6.806
    8   2HG   ARG   1          2HG       ARG   1  31.326   5.966  -8.485
    9   1HD   ARG   1          1HD       ARG   1  32.817   7.634  -7.905
   10   2HD   ARG   1          2HD       ARG   1  31.928   8.055  -6.428
   11    HE   ARG   1           HE       ARG   1  32.868   5.405  -6.099
   12   1HH1  ARG   1          1HH1      ARG   1  33.709   6.582  -3.865
   13   2HH1  ARG   1          2HH1      ARG   1  35.315   7.181  -4.114
   14   1HH2  ARG   1          1HH2      ARG   1  35.112   7.048  -7.573
   15   2HH2  ARG   1          2HH2      ARG   1  36.109   7.444  -6.214
   16    H    GLN   2           H        GLN   2  26.282   5.804  -6.357
   17    HA   GLN   2           HA       GLN   2  25.147   8.493  -6.952
   18   1HB   GLN   2          1HB       GLN   2  23.003   7.257  -6.889
   19   2HB   GLN   2          2HB       GLN   2  24.147   6.495  -7.991
   20   1HG   GLN   2          1HG       GLN   2  24.517   4.699  -6.597
   21   2HG   GLN   2          2HG       GLN   2  24.115   5.604  -5.144
   22   1HE2  GLN   2          2HE2      GLN   2  21.899   5.682  -4.480
   23   2HE2  GLN   2          1HE2      GLN   2  20.670   4.817  -5.268
   24    H    GLU   3           H        GLU   3  22.902   7.444  -4.979
   25    HA   GLU   3           HA       GLU   3  24.295   8.297  -2.465
   26   1HB   GLU   3          1HB       GLU   3  21.637   9.080  -3.679
   27   2HB   GLU   3          2HB       GLU   3  22.027   9.399  -1.990
   28   1HG   GLU   3          1HG       GLU   3  24.100  10.210  -3.947
   29   2HG   GLU   3          2HG       GLU   3  22.595  11.129  -4.010
   30    HA   PRO   4           HA       PRO   4  22.623   4.639  -0.655
   31   1HB   PRO   4          1HB       PRO   4  22.286   5.499   1.930
   32   2HB   PRO   4          2HB       PRO   4  23.870   5.093   1.235
   33   1HG   PRO   4          1HG       PRO   4  22.578   7.771   1.550
   34   2HG   PRO   4          2HG       PRO   4  24.248   7.282   1.896
   35   1HD   PRO   4          1HD       PRO   4  23.636   8.585  -0.357
   36   2HD   PRO   4          2HD       PRO   4  24.857   7.292  -0.346
   37    HA   PRO   5           HA       PRO   5  18.272   5.520  -1.044
   38   1HB   PRO   5          1HB       PRO   5  17.405   2.955  -0.637
   39   2HB   PRO   5          2HB       PRO   5  18.109   3.504  -2.169
   40   1HG   PRO   5          1HG       PRO   5  19.381   2.021   0.081
   41   2HG   PRO   5          2HG       PRO   5  19.527   1.745  -1.663
   42   1HD   PRO   5          1HD       PRO   5  21.429   3.024  -0.256
   43   2HD   PRO   5          2HD       PRO   5  21.047   3.458  -1.938
   44    H    LYS   6           H        LYS   6  17.090   6.392   0.599
   45    HA   LYS   6           HA       LYS   6  16.717   4.877   3.118
   46   1HB   LYS   6          1HB       LYS   6  18.224   7.446   2.756
   47   2HB   LYS   6          2HB       LYS   6  17.292   7.214   4.235
   48   1HG   LYS   6          1HG       LYS   6  18.653   4.786   3.849
   49   2HG   LYS   6          2HG       LYS   6  19.837   6.040   3.480
   50   1HD   LYS   6          1HD       LYS   6  18.159   6.507   5.885
   51   2HD   LYS   6          2HD       LYS   6  19.328   5.190   6.001
   52   1HE   LYS   6          1HE       LYS   6  20.348   7.715   4.800
   53   2HE   LYS   6          2HE       LYS   6  19.995   7.758   6.538
   54   1HZ   LYS   6          1HZ       LYS   6  21.198   5.580   6.684
   55   2HZ   LYS   6          2HZ       LYS   6  21.729   5.834   5.090
   56   3HZ   LYS   6          3HZ       LYS   6  22.183   6.912   6.321
   57    H    ILE   7           H        ILE   7  14.942   5.839   4.407
   58    HA   ILE   7           HA       ILE   7  12.826   6.926   2.697
   59    HB   ILE   7           HB       ILE   7  12.841   6.408   5.685
   60   1HG1  ILE   7          1HG1      ILE   7  13.674   4.384   4.656
   61   2HG1  ILE   7          2HG1      ILE   7  11.974   4.120   5.035
   62   1HG2  ILE   7          1HG2      ILE   7  10.898   7.534   4.190
   63   2HG2  ILE   7          2HG2      ILE   7  10.507   5.834   3.938
   64   3HG2  ILE   7          3HG2      ILE   7  10.557   6.496   5.572
   65   1HD1  ILE   7          1HD1      ILE   7  13.065   4.924   2.318
   66   2HD1  ILE   7          2HD1      ILE   7  12.512   3.309   2.762
   67   3HD1  ILE   7          3HD1      ILE   7  11.366   4.648   2.701
   68    H    HIS   8           H        HIS   8  15.327   8.580   3.727
   69    HA   HIS   8           HA       HIS   8  13.698  10.900   4.695
   70   1HB   HIS   8          1HB       HIS   8  15.481  11.447   6.200
   71   2HB   HIS   8          2HB       HIS   8  15.205   9.717   6.377
   72    HD1  HIS   8           HD1      HIS   8  17.953  11.035   7.053
   73    HD2  HIS   8           HD2      HIS   8  17.051   9.236   3.404
   74    HE1  HIS   8           HE1      HIS   8  20.166  10.370   6.015
   75    H    LEU   9           H        LEU   9  14.511  13.013   4.026
   76    HA   LEU   9           HA       LEU   9  16.587  13.074   1.920
   77   1HB   LEU   9          1HB       LEU   9  14.723  14.482   0.585
   78   2HB   LEU   9          2HB       LEU   9  14.902  12.751   0.385
   79    HG   LEU   9           HG       LEU   9  12.531  13.603   0.699
   80   1HD1  LEU   9          1HD1      LEU   9  13.698  11.253   1.455
   81   2HD1  LEU   9          2HD1      LEU   9  12.907  11.748   2.951
   82   3HD1  LEU   9          3HD1      LEU   9  11.963  11.562   1.474
   83   1HD2  LEU   9          1HD2      LEU   9  13.724  14.528   3.234
   84   2HD2  LEU   9          2HD2      LEU   9  12.294  15.097   2.387
   85   3HD2  LEU   9          3HD2      LEU   9  12.201  13.670   3.416
   86    H    ASP  10           H        ASP  10  15.871  15.736   1.018
   87    HA   ASP  10           HA       ASP  10  17.184  17.374   2.919
   88   1HB   ASP  10          1HB       ASP  10  15.572  17.662   0.451
   89   2HB   ASP  10          2HB       ASP  10  15.608  19.096   1.477
   90    H    CYS  11           H        CYS  11  13.818  16.466   2.564
   91    HA   CYS  11           HA       CYS  11  13.099  18.191   4.892
   92   1HB   CYS  11          1HB       CYS  11  11.661  17.145   2.464
   93   2HB   CYS  11          2HB       CYS  11  10.731  17.585   3.897
   94    HG   CYS  11           HG       CYS  11  11.095  19.980   3.377
   95    HA   PRO  12           HA       PRO  12  13.192  13.740   6.241
   96   1HB   PRO  12          1HB       PRO  12  14.270  14.276   8.708
   97   2HB   PRO  12          2HB       PRO  12  15.248  13.988   7.254
   98   1HG   PRO  12          1HG       PRO  12  14.456  16.576   8.514
   99   2HG   PRO  12          2HG       PRO  12  16.023  16.081   7.849
  100   1HD   PRO  12          1HD       PRO  12  14.335  17.663   6.479
  101   2HD   PRO  12          2HD       PRO  12  15.368  16.462   5.667
  102    H    GLY  13           H        GLY  13  12.375  13.003   8.604
  103   1HA   GLY  13          2HA       GLY  13   9.994  14.689   9.270
  104   2HA   GLY  13          1HA       GLY  13  10.835  13.687  10.457
  105    H    ARG  14           H        ARG  14  11.225  11.425   8.709
  106    HA   ARG  14           HA       ARG  14  10.111   9.418   8.179
  107   1HB   ARG  14          1HB       ARG  14   8.840  10.554  10.359
  108   2HB   ARG  14          2HB       ARG  14   7.508  10.308   9.229
  109   1HG   ARG  14          1HG       ARG  14   7.480   8.151   9.895
  110   2HG   ARG  14          2HG       ARG  14   9.012   7.956   9.042
  111   1HD   ARG  14          1HD       ARG  14   9.777   7.338  11.121
  112   2HD   ARG  14          2HD       ARG  14   9.864   9.091  11.389
  113    HE   ARG  14           HE       ARG  14   7.257   8.593  11.989
  114   1HH1  ARG  14          1HH1      ARG  14   8.057   9.143  14.437
  115   2HH1  ARG  14          2HH1      ARG  14   8.408   7.670  15.279
  116   1HH2  ARG  14          1HH2      ARG  14   8.629   5.761  12.393
  117   2HH2  ARG  14          2HH2      ARG  14   8.732   5.757  14.122
  118    H    ILE  15           H        ILE  15   8.899   8.667   6.419
  119    HA   ILE  15           HA       ILE  15   8.003  10.667   4.475
  120    HB   ILE  15           HB       ILE  15   8.666   7.803   4.650
  121   1HG1  ILE  15          1HG1      ILE  15   8.649   9.781   2.347
  122   2HG1  ILE  15          2HG1      ILE  15   9.996   9.524   3.455
  123   1HG2  ILE  15          1HG2      ILE  15   6.342   8.692   2.925
  124   2HG2  ILE  15          2HG2      ILE  15   7.290   7.248   2.574
  125   3HG2  ILE  15          3HG2      ILE  15   6.380   7.362   4.080
  126   1HD1  ILE  15          1HD1      ILE  15   9.500   6.961   2.659
  127   2HD1  ILE  15          2HD1      ILE  15   9.067   7.849   1.199
  128   3HD1  ILE  15          3HD1      ILE  15  10.683   8.015   1.886
  129    HA   PRO  16           HA       PRO  16   3.772  10.581   5.742
  130   1HB   PRO  16          1HB       PRO  16   2.570  11.405   3.426
  131   2HB   PRO  16          2HB       PRO  16   3.474  12.502   4.488
  132   1HG   PRO  16          1HG       PRO  16   4.289  11.255   1.923
  133   2HG   PRO  16          2HG       PRO  16   4.687  12.846   2.584
  134   1HD   PRO  16          1HD       PRO  16   6.383  10.672   2.604
  135   2HD   PRO  16          2HD       PRO  16   6.502  12.059   3.708
  136    H    ASP  17           H        ASP  17   4.598   8.026   5.314
  137    HA   ASP  17           HA       ASP  17   3.224   6.682   3.139
  138   1HB   ASP  17          1HB       ASP  17   3.902   4.659   4.572
  139   2HB   ASP  17          2HB       ASP  17   5.209   5.701   4.024
  140    H    THR  18           H        THR  18   1.038   7.616   3.553
  141    HA   THR  18           HA       THR  18  -0.480   5.920   5.489
  142    HB   THR  18           HB       THR  18  -0.117   7.996   6.652
  143    HG1  THR  18           HG1      THR  18  -2.307   7.223   6.547
  144   1HG2  THR  18          1HG2      THR  18  -0.355   9.087   3.928
  145   2HG2  THR  18          2HG2      THR  18  -1.139  10.060   5.171
  146   3HG2  THR  18          3HG2      THR  18   0.579   9.679   5.302
  147    H    ILE  19           H        ILE  19  -1.217   4.771   3.565
  148    HA   ILE  19           HA       ILE  19  -2.567   6.268   1.431
  149    HB   ILE  19           HB       ILE  19  -1.207   4.193   1.113
  150   1HG1  ILE  19          1HG1      ILE  19  -2.922   3.047  -0.349
  151   2HG1  ILE  19          2HG1      ILE  19  -4.131   4.132   0.335
  152   1HG2  ILE  19          1HG2      ILE  19  -2.301   3.184   3.292
  153   2HG2  ILE  19          2HG2      ILE  19  -3.530   2.609   2.167
  154   3HG2  ILE  19          3HG2      ILE  19  -1.850   2.118   1.961
  155   1HD1  ILE  19          1HD1      ILE  19  -1.589   5.178  -0.917
  156   2HD1  ILE  19          2HD1      ILE  19  -3.038   4.872  -1.875
  157   3HD1  ILE  19          3HD1      ILE  19  -3.076   6.059  -0.570
  158    H    VAL  20           H        VAL  20  -4.662   6.933   1.599
  159    HA   VAL  20           HA       VAL  20  -6.523   5.330   3.322
  160    HB   VAL  20           HB       VAL  20  -6.338   8.328   2.872
  161   1HG1  VAL  20          1HG1      VAL  20  -8.666   7.447   3.175
  162   2HG1  VAL  20          2HG1      VAL  20  -8.161   6.757   4.717
  163   3HG1  VAL  20          3HG1      VAL  20  -8.147   8.505   4.486
  164   1HG2  VAL  20          1HG2      VAL  20  -4.591   7.221   4.352
  165   2HG2  VAL  20          2HG2      VAL  20  -5.577   8.444   5.152
  166   3HG2  VAL  20          3HG2      VAL  20  -5.913   6.732   5.414
  167    H    VAL  21           H        VAL  21  -8.609   5.012   2.463
  168    HA   VAL  21           HA       VAL  21  -9.203   6.204  -0.214
  169    HB   VAL  21           HB       VAL  21  -8.141   4.027  -0.555
  170   1HG1  VAL  21          1HG1      VAL  21 -10.191   3.130   1.476
  171   2HG1  VAL  21          2HG1      VAL  21  -9.401   1.990   0.385
  172   3HG1  VAL  21          3HG1      VAL  21  -8.440   2.926   1.531
  173   1HG2  VAL  21          1HG2      VAL  21 -10.343   4.776  -1.785
  174   2HG2  VAL  21          2HG2      VAL  21  -9.741   3.132  -2.002
  175   3HG2  VAL  21          3HG2      VAL  21 -11.070   3.444  -0.885
  176    H    VAL  22           H        VAL  22 -11.508   6.153  -0.721
  177    HA   VAL  22           HA       VAL  22 -13.203   6.164   1.722
  178    HB   VAL  22           HB       VAL  22 -13.676   7.105  -1.124
  179   1HG1  VAL  22          1HG1      VAL  22 -15.334   7.099   1.363
  180   2HG1  VAL  22          2HG1      VAL  22 -15.437   8.504   0.301
  181   3HG1  VAL  22          3HG1      VAL  22 -15.833   6.900  -0.317
  182   1HG2  VAL  22          1HG2      VAL  22 -12.480   8.337   1.310
  183   2HG2  VAL  22          2HG2      VAL  22 -12.135   8.648  -0.391
  184   3HG2  VAL  22          3HG2      VAL  22 -13.567   9.351   0.361
  185    H    ALA  23           H        ALA  23 -12.622   3.625   1.220
  186    HA   ALA  23           HA       ALA  23 -13.426   1.503   0.552
  187   1HB   ALA  23          1HB       ALA  23 -15.604   3.239   1.581
  188   2HB   ALA  23          3HB       ALA  23 -14.990   1.710   2.210
  189   3HB   ALA  23          2HB       ALA  23 -16.103   1.719   0.840
  190    H    GLY  24           H        GLY  24 -12.719   2.182  -1.797
  191   1HA   GLY  24          2HA       GLY  24 -15.079   1.737  -3.542
  192   2HA   GLY  24          1HA       GLY  24 -13.401   1.459  -4.000
  193    H    ASN  25           H        ASN  25 -12.233   3.902  -3.356
  194    HA   ASN  25           HA       ASN  25 -13.572   5.698  -5.337
  195   1HB   ASN  25          1HB       ASN  25 -14.175   6.307  -2.988
  196   2HB   ASN  25          2HB       ASN  25 -12.460   6.527  -2.639
  197   1HD2  ASN  25          2HD2      ASN  25 -14.652   7.548  -5.332
  198   2HD2  ASN  25          1HD2      ASN  25 -14.143   9.167  -5.320
  199    H    LYS  26           H        LYS  26 -12.048   7.312  -6.242
  200    HA   LYS  26           HA       LYS  26  -9.485   6.231  -6.921
  201   1HB   LYS  26          1HB       LYS  26 -10.591   9.058  -7.014
  202   2HB   LYS  26          2HB       LYS  26  -9.161   8.510  -7.887
  203   1HG   LYS  26          1HG       LYS  26 -10.556   7.948  -9.571
  204   2HG   LYS  26          2HG       LYS  26 -11.095   6.617  -8.548
  205   1HD   LYS  26          1HD       LYS  26 -12.434   8.993  -7.678
  206   2HD   LYS  26          2HD       LYS  26 -12.599   8.884  -9.431
  207   1HE   LYS  26          1HE       LYS  26 -12.993   6.311  -8.032
  208   2HE   LYS  26          2HE       LYS  26 -14.216   7.544  -7.666
  209   1HZ   LYS  26          1HZ       LYS  26 -13.290   6.856 -10.404
  210   2HZ   LYS  26          2HZ       LYS  26 -14.721   6.270  -9.707
  211   3HZ   LYS  26          3HZ       LYS  26 -14.537   7.935  -9.996
  212    H    LEU  27           H        LEU  27  -7.758   6.063  -5.538
  213    HA   LEU  27           HA       LEU  27  -7.443   8.168  -3.424
  214   1HB   LEU  27          1HB       LEU  27  -7.739   6.304  -2.143
  215   2HB   LEU  27          2HB       LEU  27  -7.390   5.219  -3.483
  216    HG   LEU  27           HG       LEU  27  -4.958   5.687  -3.185
  217   1HD1  LEU  27          1HD1      LEU  27  -5.986   7.793  -1.542
  218   2HD1  LEU  27          2HD1      LEU  27  -5.033   6.719  -0.518
  219   3HD1  LEU  27          3HD1      LEU  27  -4.304   7.449  -1.947
  220   1HD2  LEU  27          1HD2      LEU  27  -6.570   3.992  -1.765
  221   2HD2  LEU  27          2HD2      LEU  27  -4.810   4.001  -1.662
  222   3HD2  LEU  27          3HD2      LEU  27  -5.768   4.870  -0.463
  223    H    ARG  28           H        ARG  28  -5.383   9.069  -3.161
  224    HA   ARG  28           HA       ARG  28  -3.229   8.160  -5.039
  225   1HB   ARG  28          1HB       ARG  28  -4.211  10.964  -4.414
  226   2HB   ARG  28          2HB       ARG  28  -2.769  10.610  -5.365
  227   1HG   ARG  28          1HG       ARG  28  -4.078   9.468  -7.047
  228   2HG   ARG  28          2HG       ARG  28  -5.534   9.581  -6.056
  229   1HD   ARG  28          1HD       ARG  28  -4.104  12.126  -6.744
  230   2HD   ARG  28          2HD       ARG  28  -5.104  11.352  -7.989
  231    HE   ARG  28           HE       ARG  28  -6.183  11.925  -5.255
  232   1HH1  ARG  28          1HH1      ARG  28  -7.106  10.702  -8.176
  233   2HH1  ARG  28          2HH1      ARG  28  -8.397  11.819  -8.466
  234   1HH2  ARG  28          1HH2      ARG  28  -7.533  13.912  -5.839
  235   2HH2  ARG  28          2HH2      ARG  28  -8.639  13.636  -7.143
  236    H    LEU  29           H        LEU  29  -1.082   8.446  -4.197
  237    HA   LEU  29           HA       LEU  29  -0.843   9.528  -1.423
  238   1HB   LEU  29          1HB       LEU  29  -1.301   7.124  -1.257
  239   2HB   LEU  29          2HB       LEU  29   0.002   6.778  -2.389
  240    HG   LEU  29           HG       LEU  29   1.644   7.677  -0.827
  241   1HD1  LEU  29          1HD1      LEU  29  -0.833   8.434   0.692
  242   2HD1  LEU  29          2HD1      LEU  29   0.662   8.116   1.572
  243   3HD1  LEU  29          3HD1      LEU  29   0.606   9.398   0.361
  244   1HD2  LEU  29          1HD2      LEU  29   0.327   5.296  -0.565
  245   2HD2  LEU  29          2HD2      LEU  29   1.733   5.758   0.393
  246   3HD2  LEU  29          3HD2      LEU  29   0.110   5.981   1.045
  247    H    ASP  30           H        ASP  30   1.019  10.723  -1.228
  248    HA   ASP  30           HA       ASP  30   3.185  10.300  -3.266
  249   1HB   ASP  30          1HB       ASP  30   2.157  12.904  -2.088
  250   2HB   ASP  30          2HB       ASP  30   3.394  12.744  -3.334
  251    H    VAL  31           H        VAL  31   5.108   9.829  -2.287
  252    HA   VAL  31           HA       VAL  31   5.734  11.070   0.355
  253    HB   VAL  31           HB       VAL  31   6.663   8.753   0.971
  254   1HG1  VAL  31          1HG1      VAL  31   3.738   9.391   0.648
  255   2HG1  VAL  31          2HG1      VAL  31   4.246   7.858   1.356
  256   3HG1  VAL  31          3HG1      VAL  31   4.712   9.378   2.117
  257   1HG2  VAL  31          1HG2      VAL  31   6.309   8.105  -1.593
  258   2HG2  VAL  31          2HG2      VAL  31   6.157   6.899  -0.316
  259   3HG2  VAL  31          3HG2      VAL  31   4.713   7.640  -1.006
  260    HA   PRO  32           HA       PRO  32   9.488  11.588  -1.995
  261   1HB   PRO  32          1HB       PRO  32  10.797  13.160  -0.186
  262   2HB   PRO  32          2HB       PRO  32   9.493  13.764  -1.224
  263   1HG   PRO  32          1HG       PRO  32   9.471  13.149   1.652
  264   2HG   PRO  32          2HG       PRO  32   8.463  14.267   0.727
  265   1HD   PRO  32          1HD       PRO  32   7.752  11.689   1.647
  266   2HD   PRO  32          2HD       PRO  32   6.820  12.733   0.552
  267    H    ILE  33           H        ILE  33  11.619  10.701  -1.936
  268    HA   ILE  33           HA       ILE  33  12.527   9.389   0.579
  269    HB   ILE  33           HB       ILE  33  12.742   7.752  -1.895
  270   1HG1  ILE  33          1HG1      ILE  33  10.085   8.044  -0.449
  271   2HG1  ILE  33          2HG1      ILE  33  10.416   8.663  -2.066
  272   1HG2  ILE  33          1HG2      ILE  33  13.088   7.407   0.844
  273   2HG2  ILE  33          2HG2      ILE  33  11.571   6.573   0.513
  274   3HG2  ILE  33          3HG2      ILE  33  13.035   6.121  -0.360
  275   1HD1  ILE  33          1HD1      ILE  33  11.192   5.868  -1.821
  276   2HD1  ILE  33          2HD1      ILE  33   9.487   6.103  -1.438
  277   3HD1  ILE  33          3HD1      ILE  33  10.121   6.633  -2.996
  278    H    SER  34           H        SER  34  14.760   8.164  -0.181
  279    HA   SER  34           HA       SER  34  16.379  10.314  -1.483
  280   1HB   SER  34          1HB       SER  34  16.613   8.894   0.891
  281   2HB   SER  34          2HB       SER  34  17.751   8.071  -0.170
  282    HG   SER  34           HG       SER  34  17.935  10.491   1.006
  283    H    GLY  35           H        GLY  35  18.585   8.319  -1.904
  284   1HA   GLY  35          2HA       GLY  35  17.499   6.416  -3.862
  285   2HA   GLY  35          1HA       GLY  35  19.197   6.590  -3.415
  286    H    ASP  36           H        ASP  36  19.936   6.725  -5.577
  287    HA   ASP  36           HA       ASP  36  18.839   8.846  -7.330
  288   1HB   ASP  36          1HB       ASP  36  20.656   9.621  -5.571
  289   2HB   ASP  36          2HB       ASP  36  21.778   8.875  -6.709
  290    HA   PRO  37           HA       PRO  37  18.825   9.424  -9.163
  291   1HB   PRO  37          1HB       PRO  37  17.539   8.636 -11.444
  292   2HB   PRO  37          2HB       PRO  37  19.160   9.357 -11.447
  293   1HG   PRO  37          1HG       PRO  37  18.349   6.533 -11.783
  294   2HG   PRO  37          2HG       PRO  37  19.722   7.408 -12.472
  295   1HD   PRO  37          1HD       PRO  37  19.843   5.656 -10.320
  296   2HD   PRO  37          2HD       PRO  37  21.076   6.862 -10.742
  297    H    ALA  38           H        ALA  38  17.333   6.316 -10.176
  298    HA   ALA  38           HA       ALA  38  15.005   6.962  -8.410
  299   1HB   ALA  38          2HB       ALA  38  14.207   4.949 -10.083
  300   2HB   ALA  38          3HB       ALA  38  14.036   6.664 -10.456
  301   3HB   ALA  38          1HB       ALA  38  15.416   5.760 -11.079
  302    HA   PRO  39           HA       PRO  39  16.497   3.404  -6.150
  303   1HB   PRO  39          1HB       PRO  39  14.833   3.697  -4.007
  304   2HB   PRO  39          2HB       PRO  39  16.268   4.707  -4.252
  305   1HG   PRO  39          1HG       PRO  39  13.426   5.374  -4.583
  306   2HG   PRO  39          2HG       PRO  39  14.802   6.428  -4.249
  307   1HD   PRO  39          1HD       PRO  39  13.506   6.035  -6.736
  308   2HD   PRO  39          2HD       PRO  39  14.987   6.966  -6.431
  309    H    THR  40           H        THR  40  14.906   1.778  -4.627
  310    HA   THR  40           HA       THR  40  12.750   0.868  -6.509
  311    HB   THR  40           HB       THR  40  14.218  -1.011  -4.697
  312    HG1  THR  40           HG1      THR  40  15.252   0.160  -7.059
  313   1HG2  THR  40          1HG2      THR  40  12.786  -1.064  -7.317
  314   2HG2  THR  40          2HG2      THR  40  14.045  -2.266  -7.035
  315   3HG2  THR  40          3HG2      THR  40  12.660  -2.168  -5.948
  316    H    VAL  41           H        VAL  41  11.199   2.066  -5.198
  317    HA   VAL  41           HA       VAL  41  10.898   1.302  -2.355
  318    HB   VAL  41           HB       VAL  41  10.681   3.641  -3.069
  319   1HG1  VAL  41          1HG1      VAL  41   9.405   2.536  -5.303
  320   2HG1  VAL  41          2HG1      VAL  41   8.114   3.364  -4.440
  321   3HG1  VAL  41          3HG1      VAL  41   9.553   4.253  -4.935
  322   1HG2  VAL  41          1HG2      VAL  41   9.261   2.712  -1.195
  323   2HG2  VAL  41          2HG2      VAL  41   8.593   4.147  -1.972
  324   3HG2  VAL  41          3HG2      VAL  41   7.942   2.554  -2.357
  325    H    ILE  42           H        ILE  42  10.101  -0.809  -2.306
  326    HA   ILE  42           HA       ILE  42   7.851  -1.602  -4.053
  327    HB   ILE  42           HB       ILE  42   9.621  -2.962  -2.003
  328   1HG1  ILE  42          1HG1      ILE  42  10.726  -2.366  -4.111
  329   2HG1  ILE  42          2HG1      ILE  42  10.515  -4.113  -4.014
  330   1HG2  ILE  42          1HG2      ILE  42   7.251  -3.969  -3.547
  331   2HG2  ILE  42          2HG2      ILE  42   8.574  -5.063  -3.144
  332   3HG2  ILE  42          3HG2      ILE  42   7.681  -4.249  -1.859
  333   1HD1  ILE  42          1HD1      ILE  42   8.174  -3.363  -5.219
  334   2HD1  ILE  42          2HD1      ILE  42   9.296  -2.170  -5.873
  335   3HD1  ILE  42          3HD1      ILE  42   9.613  -3.891  -6.092
  336    H    TRP  43           H        TRP  43   5.819  -1.000  -3.316
  337    HA   TRP  43           HA       TRP  43   5.221  -0.515  -0.503
  338   1HB   TRP  43          1HB       TRP  43   3.567  -0.810  -3.032
  339   2HB   TRP  43          2HB       TRP  43   2.866  -0.382  -1.473
  340    HD1  TRP  43           HD1      TRP  43   4.519   1.086  -4.434
  341    HE1  TRP  43           HE1      TRP  43   5.043   3.578  -4.040
  342    HE3  TRP  43           HE3      TRP  43   3.663   1.392   0.602
  343    HZ2  TRP  43           HZ2      TRP  43   5.099   5.447  -1.885
  344    HZ3  TRP  43           HZ3      TRP  43   3.988   3.518   1.798
  345    HH2  TRP  43           HH2      TRP  43   4.693   5.559   0.566
  346    H    GLN  44           H        GLN  44   4.507  -2.035   0.979
  347    HA   GLN  44           HA       GLN  44   3.603  -4.694  -0.083
  348   1HB   GLN  44          1HB       GLN  44   5.974  -4.307   1.055
  349   2HB   GLN  44          2HB       GLN  44   5.026  -4.405   2.540
  350   1HG   GLN  44          1HG       GLN  44   4.120  -6.581   1.830
  351   2HG   GLN  44          2HG       GLN  44   5.047  -6.485   0.332
  352   1HE2  GLN  44          2HE2      GLN  44   7.484  -6.420   0.586
  353   2HE2  GLN  44          1HE2      GLN  44   8.183  -7.185   1.929
  354    H    LYS  45           H        LYS  45   2.117  -5.839   1.383
  355    HA   LYS  45           HA       LYS  45   0.509  -3.946   3.061
  356   1HB   LYS  45          1HB       LYS  45  -0.558  -4.931   1.052
  357   2HB   LYS  45          2HB       LYS  45  -0.209  -6.548   1.666
  358   1HG   LYS  45          1HG       LYS  45  -1.495  -5.700   3.801
  359   2HG   LYS  45          2HG       LYS  45  -2.179  -4.521   2.681
  360   1HD   LYS  45          1HD       LYS  45  -2.990  -6.298   1.230
  361   2HD   LYS  45          2HD       LYS  45  -2.200  -7.518   2.228
  362   1HE   LYS  45          1HE       LYS  45  -4.358  -7.610   3.107
  363   2HE   LYS  45          2HE       LYS  45  -3.665  -6.352   4.148
  364   1HZ   LYS  45          1HZ       LYS  45  -5.020  -5.820   1.558
  365   2HZ   LYS  45          2HZ       LYS  45  -5.774  -5.672   3.073
  366   3HZ   LYS  45          3HZ       LYS  45  -4.465  -4.666   2.670
  367    H    ALA  46           H        ALA  46   0.786  -4.271   5.232
  368    HA   ALA  46           HA       ALA  46   1.695  -6.949   6.191
  369   1HB   ALA  46          1HB       ALA  46   2.590  -4.411   6.657
  370   2HB   ALA  46          3HB       ALA  46   2.835  -5.753   7.775
  371   3HB   ALA  46          2HB       ALA  46   1.498  -4.631   8.026
  372    H    ILE  47           H        ILE  47  -0.001  -8.247   6.794
  373    HA   ILE  47           HA       ILE  47  -2.488  -7.024   7.867
  374    HB   ILE  47           HB       ILE  47  -1.727  -9.850   7.053
  375   1HG1  ILE  47          1HG1      ILE  47  -3.636  -8.908   5.293
  376   2HG1  ILE  47          2HG1      ILE  47  -2.666  -7.467   5.596
  377   1HG2  ILE  47          1HG2      ILE  47  -3.641  -9.495   8.766
  378   2HG2  ILE  47          2HG2      ILE  47  -4.523  -8.775   7.418
  379   3HG2  ILE  47          3HG2      ILE  47  -3.994 -10.456   7.329
  380   1HD1  ILE  47          1HD1      ILE  47  -0.715  -9.362   5.292
  381   2HD1  ILE  47          2HD1      ILE  47  -1.948  -9.953   4.177
  382   3HD1  ILE  47          3HD1      ILE  47  -1.300  -8.324   3.992
  383    H    THR  48           H        THR  48   0.309  -8.837   8.884
  384    HA   THR  48           HA       THR  48   0.905  -9.810  10.959
  385    HB   THR  48           HB       THR  48   0.517  -8.211  12.788
  386    HG1  THR  48           HG1      THR  48  -1.398  -7.360  12.719
  387   1HG2  THR  48          1HG2      THR  48   2.107  -7.729  10.823
  388   2HG2  THR  48          2HG2      THR  48   0.869  -6.607  10.257
  389   3HG2  THR  48          3HG2      THR  48   1.635  -6.357  11.825
  390    H    GLN  49           H        GLN  49  -1.140 -11.330  10.041
  391    HA   GLN  49           HA       GLN  49  -3.172 -11.467  12.234
  392   1HB   GLN  49          1HB       GLN  49  -3.440 -11.421   9.522
  393   2HB   GLN  49          2HB       GLN  49  -3.382 -13.161   9.807
  394   1HG   GLN  49          1HG       GLN  49  -5.070 -11.927  11.793
  395   2HG   GLN  49          2HG       GLN  49  -5.593 -11.423  10.184
  396   1HE2  GLN  49          2HE2      GLN  49  -5.811 -13.323   8.548
  397   2HE2  GLN  49          1HE2      GLN  49  -6.410 -14.792   9.153
  398    H    GLY  50           H        GLY  50  -1.256 -13.697  10.173
  399   1HA   GLY  50          2HA       GLY  50  -0.610 -15.932  10.637
  400   2HA   GLY  50          1HA       GLY  50  -1.514 -15.844  12.150
  401    H    ASN  51           H        ASN  51  -0.437 -15.101  14.022
  402    HA   ASN  51           HA       ASN  51   2.159 -13.869  14.041
  403   1HB   ASN  51          1HB       ASN  51   2.042 -14.458  16.460
  404   2HB   ASN  51          2HB       ASN  51   0.535 -13.747  15.881
  405   1HD2  ASN  51          2HD2      ASN  51   1.666 -16.261  17.750
  406   2HD2  ASN  51          1HD2      ASN  51   0.378 -17.350  17.562
  407    H    LYS  52           H        LYS  52   1.099 -17.236  14.026
  408    HA   LYS  52           HA       LYS  52   2.333 -19.253  13.904
  409   1HB   LYS  52          1HB       LYS  52   3.363 -17.285  12.141
  410   2HB   LYS  52          2HB       LYS  52   4.760 -18.100  12.841
  411   1HG   LYS  52          1HG       LYS  52   4.355 -19.995  11.681
  412   2HG   LYS  52          2HG       LYS  52   2.646 -19.982  12.114
  413   1HD   LYS  52          1HD       LYS  52   2.032 -18.807  10.230
  414   2HD   LYS  52          2HD       LYS  52   3.572 -17.953  10.133
  415   1HE   LYS  52          1HE       LYS  52   3.776 -20.883   9.754
  416   2HE   LYS  52          2HE       LYS  52   2.896 -20.021   8.476
  417   1HZ   LYS  52          1HZ       LYS  52   4.728 -18.374   8.466
  418   2HZ   LYS  52          2HZ       LYS  52   5.596 -19.372   9.532
  419   3HZ   LYS  52          3HZ       LYS  52   5.221 -19.923   7.972
  420    H    ALA  53           H        ALA  53   5.088 -19.694  14.133
  421    HA   ALA  53           HA       ALA  53   5.714 -18.677  16.888
  422   1HB   ALA  53          1HB       ALA  53   4.904 -21.210  16.202
  423   2HB   ALA  53          3HB       ALA  53   5.885 -20.833  17.618
  424   3HB   ALA  53          2HB       ALA  53   6.659 -21.371  16.128
  425    HA   PRO  54           HA       PRO  54   9.784 -17.866  15.448
  426   1HB   PRO  54          1HB       PRO  54  11.423 -18.907  17.377
  427   2HB   PRO  54          2HB       PRO  54  10.444 -17.447  17.626
  428   1HG   PRO  54          1HG       PRO  54   9.939 -20.238  18.522
  429   2HG   PRO  54          2HG       PRO  54   9.634 -18.710  19.362
  430   1HD   PRO  54          1HD       PRO  54   7.688 -20.161  18.113
  431   2HD   PRO  54          2HD       PRO  54   7.613 -18.400  18.336
  432    H    ALA  55           H        ALA  55  11.875 -18.906  14.710
  433    HA   ALA  55           HA       ALA  55  11.480 -21.818  14.090
  434   1HB   ALA  55          1HB       ALA  55  11.154 -20.228  12.194
  435   2HB   ALA  55          2HB       ALA  55  12.797 -19.634  12.441
  436   3HB   ALA  55          3HB       ALA  55  12.529 -21.301  11.930
  437    H    ARG  56           H        ARG  56  13.841 -22.602  13.204
  438    HA   ARG  56           HA       ARG  56  15.950 -21.587  15.066
  439   1HB   ARG  56          1HB       ARG  56  16.443 -23.994  15.593
  440   2HB   ARG  56          2HB       ARG  56  14.851 -23.474  16.142
  441   1HG   ARG  56          1HG       ARG  56  14.647 -24.418  13.429
  442   2HG   ARG  56          2HG       ARG  56  15.459 -25.639  14.408
  443   1HD   ARG  56          1HD       ARG  56  13.066 -24.350  15.633
  444   2HD   ARG  56          2HD       ARG  56  12.771 -25.475  14.292
  445    HE   ARG  56           HE       ARG  56  14.708 -26.616  16.070
  446   1HH1  ARG  56          1HH1      ARG  56  13.454 -28.775  16.037
  447   2HH1  ARG  56          2HH1      ARG  56  12.021 -28.736  17.008
  448   1HH2  ARG  56          1HH2      ARG  56  11.953 -25.277  17.241
  449   2HH2  ARG  56          2HH2      ARG  56  11.170 -26.756  17.690
  450    HA   PRO  57           HA       PRO  57  17.560 -22.314  10.812
  451   1HB   PRO  57          1HB       PRO  57  18.828 -19.907  10.568
  452   2HB   PRO  57          2HB       PRO  57  17.118 -20.141  10.161
  453   1HG   PRO  57          1HG       PRO  57  18.339 -18.881  12.546
  454   2HG   PRO  57          2HG       PRO  57  16.822 -18.506  11.719
  455   1HD   PRO  57          1HD       PRO  57  17.052 -19.940  14.083
  456   2HD   PRO  57          2HD       PRO  57  15.638 -19.951  13.009
  457    H    ALA  58           H        ALA  58  19.853 -22.548  10.181
  458    HA   ALA  58           HA       ALA  58  21.762 -22.447  12.494
  459   1HB   ALA  58          3HB       ALA  58  21.074 -24.723  12.243
  460   2HB   ALA  58          1HB       ALA  58  21.164 -24.628  10.484
  461   3HB   ALA  58          2HB       ALA  58  22.643 -24.620  11.444
  462    HA   PRO  59           HA       PRO  59  24.532 -20.522   9.676
  463   1HB   PRO  59          1HB       PRO  59  26.953 -21.527  10.463
  464   2HB   PRO  59          2HB       PRO  59  26.044 -20.339  11.418
  465   1HG   PRO  59          1HG       PRO  59  26.278 -23.281  11.786
  466   2HG   PRO  59          2HG       PRO  59  26.220 -21.992  12.998
  467   1HD   PRO  59          1HD       PRO  59  24.086 -23.574  12.368
  468   2HD   PRO  59          2HD       PRO  59  23.936 -21.922  13.004
  469    H    ASP  60           H        ASP  60  26.020 -20.976   7.845
  470    HA   ASP  60           HA       ASP  60  26.588 -22.201   5.904
  471   1HB   ASP  60          1HB       ASP  60  26.744 -24.380   8.017
  472   2HB   ASP  60          2HB       ASP  60  27.498 -24.446   6.424
  473    H    ALA  61           H        ALA  61  24.052 -21.857   5.577
  474    HA   ALA  61           HA       ALA  61  22.044 -23.719   5.927
  475   1HB   ALA  61          3HB       ALA  61  21.371 -21.873   4.731
  476   2HB   ALA  61          1HB       ALA  61  22.859 -21.818   3.786
  477   3HB   ALA  61          2HB       ALA  61  21.593 -22.973   3.370
  478    HA   PRO  62           HA       PRO  62  24.105 -27.076   3.688
  479   1HB   PRO  62          1HB       PRO  62  23.485 -29.036   5.485
  480   2HB   PRO  62          2HB       PRO  62  24.853 -27.935   5.700
  481   1HG   PRO  62          1HG       PRO  62  22.332 -28.056   7.158
  482   2HG   PRO  62          2HG       PRO  62  23.843 -27.247   7.587
  483   1HD   PRO  62          1HD       PRO  62  21.443 -26.105   6.452
  484   2HD   PRO  62          2HD       PRO  62  22.905 -25.274   7.023
  485    H    GLU  63           H        GLU  63  23.116 -28.400   2.177
  486    HA   GLU  63           HA       GLU  63  21.286 -29.082   0.817
  487   1HB   GLU  63          1HB       GLU  63  20.209 -31.001   1.925
  488   2HB   GLU  63          2HB       GLU  63  21.934 -30.964   2.286
  489   1HG   GLU  63          1HG       GLU  63  21.566 -30.139   4.483
  490   2HG   GLU  63          2HG       GLU  63  19.897 -29.700   4.125
  491    H    ASP  64           H        ASP  64  20.624 -26.534   1.673
  492    HA   ASP  64           HA       ASP  64  18.141 -26.361   3.130
  493   1HB   ASP  64          1HB       ASP  64  19.859 -24.554   2.675
  494   2HB   ASP  64          2HB       ASP  64  19.256 -24.491   1.018
  495    H    THR  65           H        THR  65  16.374 -27.489   2.351
  496    HA   THR  65           HA       THR  65  15.868 -28.124  -0.393
  497    HB   THR  65           HB       THR  65  13.523 -28.518   0.574
  498    HG1  THR  65           HG1      THR  65  13.209 -27.402   2.316
  499   1HG2  THR  65          1HG2      THR  65  16.035 -29.677   1.777
  500   2HG2  THR  65          2HG2      THR  65  14.437 -30.281   2.214
  501   3HG2  THR  65          3HG2      THR  65  14.989 -30.378   0.542
  502    H    GLY  66           H        GLY  66  14.982 -25.338   1.601
  503   1HA   GLY  66          2HA       GLY  66  14.544 -23.629  -0.649
  504   2HA   GLY  66          1HA       GLY  66  14.046 -23.270   1.004
  505    H    ASP  67           H        ASP  67  12.589 -22.887  -1.590
  506    HA   ASP  67           HA       ASP  67  10.430 -24.840  -1.675
  507   1HB   ASP  67          1HB       ASP  67  10.083 -23.657   0.508
  508   2HB   ASP  67          2HB       ASP  67   9.923 -22.141  -0.381
  509    H    SER  68           H        SER  68   8.751 -24.161  -3.245
  510    HA   SER  68           HA       SER  68   9.802 -22.838  -5.551
  511   1HB   SER  68          1HB       SER  68   7.815 -24.520  -5.137
  512   2HB   SER  68          2HB       SER  68   6.863 -23.050  -4.944
  513    HG   SER  68           HG       SER  68   8.549 -23.621  -7.159
  514    H    ASP  69           H        ASP  69  10.453 -20.693  -5.241
  515    HA   ASP  69           HA       ASP  69   9.266 -18.726  -3.603
  516   1HB   ASP  69          1HB       ASP  69  11.410 -18.907  -5.238
  517   2HB   ASP  69          2HB       ASP  69  10.359 -17.917  -6.252
  518    H    GLU  70           H        GLU  70   8.752 -19.150  -7.133
  519    HA   GLU  70           HA       GLU  70   5.912 -18.382  -6.821
  520   1HB   GLU  70          1HB       GLU  70   8.095 -16.638  -7.787
  521   2HB   GLU  70          2HB       GLU  70   6.678 -16.681  -8.836
  522   1HG   GLU  70          1HG       GLU  70   5.450 -15.474  -7.376
  523   2HG   GLU  70          2HG       GLU  70   5.931 -16.496  -6.022
  524    H    TRP  71           H        TRP  71   5.237 -17.990  -9.437
  525    HA   TRP  71           HA       TRP  71   6.410 -20.253 -10.997
  526   1HB   TRP  71          1HB       TRP  71   4.455 -21.006  -9.643
  527   2HB   TRP  71          2HB       TRP  71   3.465 -19.783 -10.441
  528    HD1  TRP  71           HD1      TRP  71   2.445 -20.384 -12.681
  529    HE1  TRP  71           HE1      TRP  71   2.658 -22.370 -14.317
  530    HE3  TRP  71           HE3      TRP  71   6.340 -22.857 -10.528
  531    HZ2  TRP  71           HZ2      TRP  71   4.284 -24.699 -14.655
  532    HZ3  TRP  71           HZ3      TRP  71   7.210 -24.949 -11.521
  533    HH2  TRP  71           HH2      TRP  71   6.189 -25.878 -13.583
  534    H    VAL  72           H        VAL  72   5.638 -20.152 -13.317
  535    HA   VAL  72           HA       VAL  72   5.615 -17.355 -14.246
  536    HB   VAL  72           HB       VAL  72   5.701 -20.040 -15.659
  537   1HG1  VAL  72          1HG1      VAL  72   4.951 -17.695 -16.818
  538   2HG1  VAL  72          2HG1      VAL  72   6.704 -17.577 -16.977
  539   3HG1  VAL  72          3HG1      VAL  72   5.845 -18.954 -17.668
  540   1HG2  VAL  72          1HG2      VAL  72   7.780 -18.093 -14.673
  541   2HG2  VAL  72          2HG2      VAL  72   7.710 -19.841 -14.447
  542   3HG2  VAL  72          3HG2      VAL  72   8.130 -19.172 -16.024
  543    H    PHE  73           H        PHE  73   3.826 -19.985 -15.780
  544    HA   PHE  73           HA       PHE  73   1.608 -20.072 -16.569
  545   1HB   PHE  73          1HB       PHE  73   1.216 -20.509 -14.242
  546   2HB   PHE  73          2HB       PHE  73   1.414 -18.809 -13.826
  547    HD1  PHE  73           HD1      PHE  73  -0.592 -20.743 -16.350
  548    HD2  PHE  73           HD2      PHE  73  -0.585 -17.759 -13.262
  549    HE1  PHE  73           HE1      PHE  73  -3.021 -20.379 -16.696
  550    HE2  PHE  73           HE2      PHE  73  -3.014 -17.396 -13.606
  551    HZ   PHE  73           HZ       PHE  73  -4.232 -18.706 -15.324
  552    H    ASP  74           H        ASP  74   0.934 -17.104 -14.783
  553    HA   ASP  74           HA       ASP  74  -0.308 -15.731 -16.901
  554   1HB   ASP  74          1HB       ASP  74   1.223 -14.753 -14.472
  555   2HB   ASP  74          2HB       ASP  74   0.177 -13.722 -15.450
  556    H    LYS  75           H        LYS  75   0.452 -14.480 -18.595
  557    HA   LYS  75           HA       LYS  75   3.391 -14.442 -19.051
  558   1HB   LYS  75          1HB       LYS  75   0.910 -14.517 -20.616
  559   2HB   LYS  75          2HB       LYS  75   2.088 -13.374 -21.261
  560   1HG   LYS  75          1HG       LYS  75   3.108 -16.051 -20.435
  561   2HG   LYS  75          2HG       LYS  75   2.140 -15.976 -21.908
  562   1HD   LYS  75          1HD       LYS  75   3.688 -14.681 -23.028
  563   2HD   LYS  75          2HD       LYS  75   4.284 -13.927 -21.550
  564   1HE   LYS  75          1HE       LYS  75   6.062 -15.349 -21.847
  565   2HE   LYS  75          2HE       LYS  75   4.975 -16.554 -21.128
  566   1HZ   LYS  75          1HZ       LYS  75   5.077 -15.906 -24.026
  567   2HZ   LYS  75          2HZ       LYS  75   5.860 -17.239 -23.321
  568   3HZ   LYS  75          3HZ       LYS  75   4.167 -17.138 -23.291
  569    H    LYS  76           H        LYS  76   0.807 -12.097 -19.847
  570    HA   LYS  76           HA       LYS  76   2.577  -9.930 -18.757
  571   1HB   LYS  76          1HB       LYS  76   0.661  -9.927 -21.115
  572   2HB   LYS  76          2HB       LYS  76   1.639  -8.555 -20.595
  573   1HG   LYS  76          1HG       LYS  76   3.511  -9.378 -21.572
  574   2HG   LYS  76          2HG       LYS  76   3.207 -11.009 -20.971
  575   1HD   LYS  76          1HD       LYS  76   1.699 -11.488 -22.771
  576   2HD   LYS  76          2HD       LYS  76   1.661  -9.797 -23.274
  577   1HE   LYS  76          1HE       LYS  76   4.275 -10.127 -23.538
  578   2HE   LYS  76          2HE       LYS  76   3.825 -11.839 -23.678
  579   1HZ   LYS  76          1HZ       LYS  76   2.594  -9.614 -25.218
  580   2HZ   LYS  76          2HZ       LYS  76   3.739 -10.703 -25.834
  581   3HZ   LYS  76          3HZ       LYS  76   2.206 -11.262 -25.359
  582    H    LEU  77           H        LEU  77   0.917 -10.939 -16.894
  583    HA   LEU  77           HA       LEU  77  -1.230  -8.875 -16.689
  584   1HB   LEU  77          1HB       LEU  77  -1.990 -11.152 -17.621
  585   2HB   LEU  77          2HB       LEU  77  -1.661 -11.790 -16.009
  586    HG   LEU  77           HG       LEU  77  -3.286  -9.302 -16.148
  587   1HD1  LEU  77          1HD1      LEU  77  -4.130 -11.952 -17.272
  588   2HD1  LEU  77          2HD1      LEU  77  -5.313 -10.980 -16.398
  589   3HD1  LEU  77          3HD1      LEU  77  -4.521 -10.326 -17.833
  590   1HD2  LEU  77          1HD2      LEU  77  -3.231 -11.853 -14.523
  591   2HD2  LEU  77          2HD2      LEU  77  -2.883 -10.211 -13.982
  592   3HD2  LEU  77          3HD2      LEU  77  -4.537 -10.678 -14.373
  593    H    LEU  78           H        LEU  78   0.303  -7.941 -15.106
  594    HA   LEU  78           HA       LEU  78   0.512  -9.506 -12.557
  595   1HB   LEU  78          1HB       LEU  78   2.301  -7.853 -14.146
  596   2HB   LEU  78          2HB       LEU  78   2.191  -7.243 -12.495
  597    HG   LEU  78           HG       LEU  78   2.732 -10.142 -13.199
  598   1HD1  LEU  78          1HD1      LEU  78   4.523  -8.394 -13.845
  599   2HD1  LEU  78          2HD1      LEU  78   4.732  -8.160 -12.109
  600   3HD1  LEU  78          3HD1      LEU  78   5.037  -9.741 -12.829
  601   1HD2  LEU  78          1HD2      LEU  78   1.672  -9.375 -10.931
  602   2HD2  LEU  78          2HD2      LEU  78   3.044 -10.480 -10.895
  603   3HD2  LEU  78          3HD2      LEU  78   3.287  -8.763 -10.579
  604    H    CYS  79           H        CYS  79  -1.910  -8.073 -13.302
  605    HA   CYS  79           HA       CYS  79  -1.895  -5.958 -11.177
  606   1HB   CYS  79          1HB       CYS  79  -3.424  -4.678 -12.680
  607   2HB   CYS  79          2HB       CYS  79  -1.843  -4.949 -13.412
  608    HG   CYS  79           HG       CYS  79  -4.485  -6.068 -14.446
  609    H    GLU  80           H        GLU  80  -2.659  -8.441 -10.407
  610    HA   GLU  80           HA       GLU  80  -5.606  -8.684 -10.760
  611   1HB   GLU  80          1HB       GLU  80  -3.331 -10.418 -10.300
  612   2HB   GLU  80          2HB       GLU  80  -4.554 -10.689  -9.058
  613   1HG   GLU  80          1HG       GLU  80  -6.166 -11.363 -10.596
  614   2HG   GLU  80          2HG       GLU  80  -5.412 -10.483 -11.925
  615    H    THR  81           H        THR  81  -4.667  -6.429  -9.238
  616    HA   THR  81           HA       THR  81  -4.975  -7.134  -6.384
  617    HB   THR  81           HB       THR  81  -4.936  -4.303  -7.221
  618    HG1  THR  81           HG1      THR  81  -2.817  -6.063  -7.896
  619   1HG2  THR  81          1HG2      THR  81  -4.491  -5.130  -4.920
  620   2HG2  THR  81          2HG2      THR  81  -3.067  -5.976  -5.524
  621   3HG2  THR  81          3HG2      THR  81  -3.134  -4.214  -5.576
  622    H    GLU  82           H        GLU  82  -7.300  -7.799  -7.756
  623    HA   GLU  82           HA       GLU  82  -9.599  -7.243  -8.082
  624   1HB   GLU  82          1HB       GLU  82 -10.550  -6.768  -5.802
  625   2HB   GLU  82          2HB       GLU  82  -9.408  -8.109  -5.831
  626   1HG   GLU  82          1HG       GLU  82  -7.662  -6.756  -4.895
  627   2HG   GLU  82          2HG       GLU  82  -8.601  -5.280  -5.115
  628    H    GLY  83           H        GLY  83  -8.967  -5.343  -9.556
  629   1HA   GLY  83          2HA       GLY  83  -9.666  -2.741  -8.259
  630   2HA   GLY  83          1HA       GLY  83 -10.401  -3.229  -9.785
  631    H    ARG  84           H        ARG  84  -7.365  -4.432 -10.012
  632    HA   ARG  84           HA       ARG  84  -5.408  -3.728 -11.126
  633   1HB   ARG  84          1HB       ARG  84  -7.768  -2.512 -12.341
  634   2HB   ARG  84          2HB       ARG  84  -6.324  -1.533 -12.604
  635   1HG   ARG  84          1HG       ARG  84  -5.251  -3.909 -13.157
  636   2HG   ARG  84          2HG       ARG  84  -6.928  -4.310 -13.533
  637   1HD   ARG  84          1HD       ARG  84  -5.490  -1.886 -14.670
  638   2HD   ARG  84          2HD       ARG  84  -5.659  -3.433 -15.524
  639    HE   ARG  84           HE       ARG  84  -8.175  -2.346 -14.465
  640   1HH1  ARG  84          1HH1      ARG  84  -8.730  -0.495 -16.064
  641   2HH1  ARG  84          2HH1      ARG  84  -8.693  -1.011 -17.717
  642   1HH2  ARG  84          1HH2      ARG  84  -6.930  -3.920 -17.048
  643   2HH2  ARG  84          2HH2      ARG  84  -7.673  -2.950 -18.275
  644    H    VAL  85           H        VAL  85  -4.379  -2.935  -9.164
  645    HA   VAL  85           HA       VAL  85  -4.758  -0.203  -8.236
  646    HB   VAL  85           HB       VAL  85  -4.038  -2.101  -6.818
  647   1HG1  VAL  85          1HG1      VAL  85  -2.448  -2.795  -8.938
  648   2HG1  VAL  85          2HG1      VAL  85  -1.267  -2.070  -7.846
  649   3HG1  VAL  85          3HG1      VAL  85  -2.253  -3.428  -7.304
  650   1HG2  VAL  85          1HG2      VAL  85  -2.468   0.398  -7.118
  651   2HG2  VAL  85          2HG2      VAL  85  -3.294  -0.250  -5.701
  652   3HG2  VAL  85          3HG2      VAL  85  -1.706  -0.866  -6.152
  653    H    ARG  86           H        ARG  86  -3.405   1.596  -8.643
  654    HA   ARG  86           HA       ARG  86  -1.463   1.259 -10.908
  655   1HB   ARG  86          1HB       ARG  86  -3.501   2.578 -11.385
  656   2HB   ARG  86          2HB       ARG  86  -3.134   3.636 -10.023
  657   1HG   ARG  86          1HG       ARG  86  -2.311   4.776 -11.951
  658   2HG   ARG  86          2HG       ARG  86  -0.888   4.088 -11.166
  659   1HD   ARG  86          1HD       ARG  86  -1.389   2.022 -12.749
  660   2HD   ARG  86          2HD       ARG  86  -2.228   3.250 -13.719
  661    HE   ARG  86           HE       ARG  86   0.162   4.477 -13.070
  662   1HH1  ARG  86          1HH1      ARG  86  -0.471   3.654 -15.878
  663   2HH1  ARG  86          2HH1      ARG  86   0.826   2.565 -16.239
  664   1HH2  ARG  86          1HH2      ARG  86   1.732   2.121 -12.922
  665   2HH2  ARG  86          2HH2      ARG  86   2.073   1.696 -14.566
  666    H    VAL  87           H        VAL  87   0.411   0.929  -9.603
  667    HA   VAL  87           HA       VAL  87   1.130   3.196  -7.773
  668    HB   VAL  87           HB       VAL  87   2.029   0.295  -7.793
  669   1HG1  VAL  87          1HG1      VAL  87   3.392   2.398  -6.756
  670   2HG1  VAL  87          2HG1      VAL  87   2.330   2.022  -5.399
  671   3HG1  VAL  87          3HG1      VAL  87   3.413   0.786  -6.041
  672   1HG2  VAL  87          1HG2      VAL  87  -0.294   1.675  -6.631
  673   2HG2  VAL  87          2HG2      VAL  87  -0.014  -0.051  -6.862
  674   3HG2  VAL  87          3HG2      VAL  87   0.643   0.766  -5.444
  675    H    GLU  88           H        GLU  88   2.849   4.412  -8.461
  676    HA   GLU  88           HA       GLU  88   4.956   3.143 -10.145
  677   1HB   GLU  88          1HB       GLU  88   3.177   4.131 -11.598
  678   2HB   GLU  88          2HB       GLU  88   3.464   5.695 -10.835
  679   1HG   GLU  88          1HG       GLU  88   5.730   5.765 -11.659
  680   2HG   GLU  88          2HG       GLU  88   5.623   4.103 -12.239
  681    H    THR  89           H        THR  89   6.993   4.084  -9.820
  682    HA   THR  89           HA       THR  89   7.131   6.209  -7.714
  683    HB   THR  89           HB       THR  89   9.133   4.136  -8.675
  684    HG1  THR  89           HG1      THR  89   7.688   3.038  -7.534
  685   1HG2  THR  89          1HG2      THR  89  10.043   6.312  -7.693
  686   2HG2  THR  89          2HG2      THR  89   9.270   5.837  -6.181
  687   3HG2  THR  89          3HG2      THR  89  10.538   4.829  -6.877
  688    H    THR  90           H        THR  90   8.465   8.042  -8.093
  689    HA   THR  90           HA       THR  90   9.171   8.504 -10.957
  690    HB   THR  90           HB       THR  90   9.381  10.919  -9.832
  691    HG1  THR  90           HG1      THR  90   7.439   9.718  -8.185
  692   1HG2  THR  90          1HG2      THR  90   7.021   9.341 -10.753
  693   2HG2  THR  90          2HG2      THR  90   6.723  10.926 -10.038
  694   3HG2  THR  90          3HG2      THR  90   7.755  10.780 -11.460
  695    H    LYS  91           H        LYS  91  11.077  10.435 -10.752
  696    HA   LYS  91           HA       LYS  91  13.521   9.122 -10.465
  697   1HB   LYS  91          1HB       LYS  91  13.044  11.349 -11.507
  698   2HB   LYS  91          2HB       LYS  91  12.933  12.040  -9.888
  699   1HG   LYS  91          1HG       LYS  91  15.162  12.456 -10.283
  700   2HG   LYS  91          2HG       LYS  91  15.309  10.820  -9.639
  701   1HD   LYS  91          1HD       LYS  91  16.439  10.429 -11.583
  702   2HD   LYS  91          2HD       LYS  91  14.819  10.276 -12.261
  703   1HE   LYS  91          1HE       LYS  91  14.971  12.876 -12.574
  704   2HE   LYS  91          2HE       LYS  91  16.719  12.606 -12.433
  705   1HZ   LYS  91          1HZ       LYS  91  16.495  10.825 -14.102
  706   2HZ   LYS  91          2HZ       LYS  91  14.863  11.238 -14.309
  707   3HZ   LYS  91          3HZ       LYS  91  16.078  12.351 -14.723
  708    H    ASP  92           H        ASP  92  11.759  10.942  -7.936
  709    HA   ASP  92           HA       ASP  92  13.303   9.471  -5.874
  710   1HB   ASP  92          1HB       ASP  92  13.518  12.384  -6.548
  711   2HB   ASP  92          2HB       ASP  92  13.670  11.899  -4.859
  712    H    ARG  93           H        ARG  93  10.569   9.202  -6.402
  713    HA   ARG  93           HA       ARG  93   9.415   9.973  -3.835
  714   1HB   ARG  93          1HB       ARG  93   9.362  12.088  -5.165
  715   2HB   ARG  93          2HB       ARG  93   8.373  11.269  -6.373
  716   1HG   ARG  93          1HG       ARG  93   6.571  10.964  -4.836
  717   2HG   ARG  93          2HG       ARG  93   7.579  11.414  -3.460
  718   1HD   ARG  93          1HD       ARG  93   7.323  13.432  -5.646
  719   2HD   ARG  93          2HD       ARG  93   5.909  13.182  -4.602
  720    HE   ARG  93           HE       ARG  93   8.018  13.298  -2.814
  721   1HH1  ARG  93          1HH1      ARG  93   6.891  15.390  -1.856
  722   2HH1  ARG  93          2HH1      ARG  93   7.417  16.820  -2.680
  723   1HH2  ARG  93          1HH2      ARG  93   8.691  15.098  -5.407
  724   2HH2  ARG  93          2HH2      ARG  93   8.436  16.654  -4.691
  725    H    SER  94           H        SER  94   8.619   7.900  -3.531
  726    HA   SER  94           HA       SER  94   7.407   6.313  -5.641
  727   1HB   SER  94          1HB       SER  94   7.006   4.765  -3.800
  728   2HB   SER  94          2HB       SER  94   8.609   5.471  -3.611
  729    HG   SER  94           HG       SER  94   7.770   6.870  -2.080
  730    H    ILE  95           H        ILE  95   5.346   6.576  -6.396
  731    HA   ILE  95           HA       ILE  95   3.377   7.971  -4.624
  732    HB   ILE  95           HB       ILE  95   4.233   8.288  -7.353
  733   1HG1  ILE  95          1HG1      ILE  95   2.196  10.069  -7.008
  734   2HG1  ILE  95          2HG1      ILE  95   2.564   9.659  -5.333
  735   1HG2  ILE  95          1HG2      ILE  95   1.303   7.566  -7.017
  736   2HG2  ILE  95          2HG2      ILE  95   1.974   8.369  -8.438
  737   3HG2  ILE  95          3HG2      ILE  95   2.483   6.731  -8.028
  738   1HD1  ILE  95          1HD1      ILE  95   4.797  10.302  -7.242
  739   2HD1  ILE  95          2HD1      ILE  95   3.888  11.606  -6.479
  740   3HD1  ILE  95          3HD1      ILE  95   4.766  10.444  -5.483
  741    H    PHE  96           H        PHE  96   1.682   6.772  -3.905
  742    HA   PHE  96           HA       PHE  96   1.079   4.192  -5.312
  743   1HB   PHE  96          1HB       PHE  96   2.034   3.887  -3.083
  744   2HB   PHE  96          2HB       PHE  96   0.884   5.031  -2.398
  745    HD1  PHE  96           HD1      PHE  96   0.168   3.254  -0.788
  746    HD2  PHE  96           HD2      PHE  96  -0.301   2.801  -5.035
  747    HE1  PHE  96           HE1      PHE  96  -1.443   1.403  -0.417
  748    HE2  PHE  96           HE2      PHE  96  -1.912   0.955  -4.662
  749    HZ   PHE  96           HZ       PHE  96  -2.484   0.255  -2.355
  750    H    THR  97           H        THR  97  -0.566   5.039  -6.664
  751    HA   THR  97           HA       THR  97  -2.933   6.199  -5.232
  752    HB   THR  97           HB       THR  97  -1.972   7.915  -6.566
  753    HG1  THR  97           HG1      THR  97  -3.847   6.677  -8.288
  754   1HG2  THR  97          1HG2      THR  97  -1.648   5.799  -8.710
  755   2HG2  THR  97          2HG2      THR  97  -1.365   7.520  -8.974
  756   3HG2  THR  97          3HG2      THR  97  -0.363   6.626  -7.830
  757    H    VAL  98           H        VAL  98  -4.490   4.663  -5.166
  758    HA   VAL  98           HA       VAL  98  -5.004   3.041  -7.634
  759    HB   VAL  98           HB       VAL  98  -3.852   1.730  -5.894
  760   1HG1  VAL  98          1HG1      VAL  98  -4.612   3.166  -3.982
  761   2HG1  VAL  98          2HG1      VAL  98  -6.207   2.426  -4.116
  762   3HG1  VAL  98          3HG1      VAL  98  -4.809   1.442  -3.682
  763   1HG2  VAL  98          1HG2      VAL  98  -6.117   0.992  -7.211
  764   2HG2  VAL  98          2HG2      VAL  98  -5.199  -0.097  -6.172
  765   3HG2  VAL  98          3HG2      VAL  98  -6.621   0.732  -5.542
  766    H    GLU  99           H        GLU  99  -7.239   2.676  -8.067
  767    HA   GLU  99           HA       GLU  99  -9.105   4.382  -6.465
  768   1HB   GLU  99          1HB       GLU  99 -10.426   4.380  -8.579
  769   2HB   GLU  99          2HB       GLU  99  -8.789   4.987  -8.821
  770   1HG   GLU  99          1HG       GLU  99  -8.284   3.311 -10.247
  771   2HG   GLU  99          2HG       GLU  99  -8.915   2.091  -9.140
  772    H    GLY 100           H        GLY 100  -9.178   2.430  -4.933
  773   1HA   GLY 100          2HA       GLY 100 -11.118   0.403  -5.973
  774   2HA   GLY 100          1HA       GLY 100 -11.242   1.093  -4.354
  775    H    ALA 101           H        ALA 101  -8.468   1.019  -3.676
  776    HA   ALA 101           HA       ALA 101  -7.169  -1.467  -4.125
  777   1HB   ALA 101          1HB       ALA 101  -7.030   0.828  -2.316
  778   2HB   ALA 101          2HB       ALA 101  -6.533  -0.669  -1.526
  779   3HB   ALA 101          3HB       ALA 101  -5.720  -0.137  -2.997
  780    H    GLU 102           H        GLU 102  -8.357  -0.788  -0.855
  781    HA   GLU 102           HA       GLU 102  -9.914  -3.347  -0.903
  782   1HB   GLU 102          1HB       GLU 102  -7.607  -2.453   0.783
  783   2HB   GLU 102          2HB       GLU 102  -8.862  -3.422   1.557
  784   1HG   GLU 102          1HG       GLU 102  -7.560  -5.144   0.761
  785   2HG   GLU 102          2HG       GLU 102  -8.540  -4.877  -0.682
  786    H    LYS 103           H        LYS 103 -11.782  -3.289   0.465
  787    HA   LYS 103           HA       LYS 103 -12.560  -0.562   1.368
  788   1HB   LYS 103          1HB       LYS 103 -13.836  -3.030   0.404
  789   2HB   LYS 103          2HB       LYS 103 -14.687  -2.294   1.762
  790   1HG   LYS 103          1HG       LYS 103 -15.369  -0.517   0.528
  791   2HG   LYS 103          2HG       LYS 103 -13.802  -0.353  -0.266
  792   1HD   LYS 103          1HD       LYS 103 -15.359  -2.759  -1.022
  793   2HD   LYS 103          2HD       LYS 103 -16.048  -1.219  -1.538
  794   1HE   LYS 103          1HE       LYS 103 -14.611  -1.680  -3.328
  795   2HE   LYS 103          2HE       LYS 103 -13.532  -0.733  -2.283
  796   1HZ   LYS 103          1HZ       LYS 103 -13.815  -3.693  -2.217
  797   2HZ   LYS 103          2HZ       LYS 103 -12.524  -2.855  -2.937
  798   3HZ   LYS 103          3HZ       LYS 103 -12.761  -2.767  -1.259
  799    H    GLU 104           H        GLU 104 -12.998  -3.866   2.687
  800    HA   GLU 104           HA       GLU 104 -12.870  -2.743   5.441
  801   1HB   GLU 104          1HB       GLU 104 -13.836  -4.948   6.028
  802   2HB   GLU 104          2HB       GLU 104 -14.772  -4.157   4.762
  803   1HG   GLU 104          1HG       GLU 104 -14.448  -5.927   3.412
  804   2HG   GLU 104          2HG       GLU 104 -12.705  -5.670   3.493
  805    H    ASP 105           H        ASP 105 -10.761  -4.130   3.216
  806    HA   ASP 105           HA       ASP 105  -9.295  -5.918   4.974
  807   1HB   ASP 105          1HB       ASP 105  -9.495  -5.402   2.270
  808   2HB   ASP 105          2HB       ASP 105  -7.900  -4.761   2.661
  809    H    GLU 106           H        GLU 106  -8.422  -2.718   3.567
  810    HA   GLU 106           HA       GLU 106  -6.484  -1.412   4.173
  811   1HB   GLU 106          1HB       GLU 106  -7.257  -0.153   6.178
  812   2HB   GLU 106          2HB       GLU 106  -8.531  -0.412   5.009
  813   1HG   GLU 106          1HG       GLU 106  -9.731  -1.728   6.409
  814   2HG   GLU 106          2HG       GLU 106  -8.296  -2.556   6.997
  815    H    GLY 107           H        GLY 107  -6.108  -1.065   7.230
  816   1HA   GLY 107          2HA       GLY 107  -4.493  -3.528   7.710
  817   2HA   GLY 107          1HA       GLY 107  -5.123  -2.489   8.988
  818    H    VAL 108           H        VAL 108  -2.385  -3.240   7.267
  819    HA   VAL 108           HA       VAL 108  -1.204  -0.508   7.476
  820    HB   VAL 108           HB       VAL 108  -0.264  -3.044   8.851
  821   1HG1  VAL 108          1HG1      VAL 108   1.097  -0.401   8.349
  822   2HG1  VAL 108          2HG1      VAL 108   1.490  -1.354   9.779
  823   3HG1  VAL 108          3HG1      VAL 108   1.749  -2.030   8.171
  824   1HG2  VAL 108          1HG2      VAL 108  -1.283  -0.360   9.816
  825   2HG2  VAL 108          2HG2      VAL 108  -1.996  -1.946  10.105
  826   3HG2  VAL 108          3HG2      VAL 108  -0.467  -1.514  10.870
  827    H    TYR 109           H        TYR 109   0.857  -0.347   6.318
  828    HA   TYR 109           HA       TYR 109   1.356  -2.562   4.357
  829   1HB   TYR 109          1HB       TYR 109   0.988   0.413   3.956
  830   2HB   TYR 109          2HB       TYR 109   1.845  -0.569   2.770
  831    HD1  TYR 109           HD1      TYR 109   0.671  -1.883   1.201
  832    HD2  TYR 109           HD2      TYR 109  -1.393  -0.283   4.610
  833    HE1  TYR 109           HE1      TYR 109  -1.491  -2.619   0.236
  834    HE2  TYR 109           HE2      TYR 109  -3.556  -1.020   3.646
  835    HH   TYR 109           HH       TYR 109  -4.333  -2.782   2.012
  836    H    THR 110           H        THR 110   3.599  -2.526   3.511
  837    HA   THR 110           HA       THR 110   5.508  -0.927   5.174
  838    HB   THR 110           HB       THR 110   5.985  -3.810   4.412
  839    HG1  THR 110           HG1      THR 110   4.473  -4.339   5.746
  840   1HG2  THR 110          1HG2      THR 110   7.748  -2.129   5.343
  841   2HG2  THR 110          2HG2      THR 110   6.911  -2.355   6.879
  842   3HG2  THR 110          3HG2      THR 110   7.651  -3.735   6.066
  843    H    VAL 111           H        VAL 111   6.269   0.411   3.553
  844    HA   VAL 111           HA       VAL 111   6.819  -0.674   0.865
  845    HB   VAL 111           HB       VAL 111   5.702   1.531   1.407
  846   1HG1  VAL 111          1HG1      VAL 111   7.239   2.122   3.283
  847   2HG1  VAL 111          2HG1      VAL 111   8.519   2.383   2.098
  848   3HG1  VAL 111          3HG1      VAL 111   7.080   3.404   2.082
  849   1HG2  VAL 111          1HG2      VAL 111   8.171   1.367  -0.307
  850   2HG2  VAL 111          2HG2      VAL 111   6.481   1.310  -0.810
  851   3HG2  VAL 111          3HG2      VAL 111   7.185   2.830  -0.256
  852    H    THR 112           H        THR 112   8.857  -1.249   0.164
  853    HA   THR 112           HA       THR 112  11.147  -0.705   2.024
  854    HB   THR 112           HB       THR 112  10.635  -2.899  -0.010
  855    HG1  THR 112           HG1      THR 112   9.755  -3.883   1.602
  856   1HG2  THR 112          1HG2      THR 112  12.968  -2.249   1.776
  857   2HG2  THR 112          2HG2      THR 112  12.628  -3.921   1.326
  858   3HG2  THR 112          3HG2      THR 112  12.973  -2.724   0.078
  859    H    VAL 113           H        VAL 113  12.658   0.701   1.256
  860    HA   VAL 113           HA       VAL 113  12.752   1.302  -1.667
  861    HB   VAL 113           HB       VAL 113  13.896   3.336  -0.932
  862   1HG1  VAL 113          1HG1      VAL 113  11.404   3.197  -0.684
  863   2HG1  VAL 113          2HG1      VAL 113  11.643   2.740   1.002
  864   3HG1  VAL 113          3HG1      VAL 113  12.161   4.327   0.437
  865   1HG2  VAL 113          1HG2      VAL 113  13.861   2.064   1.824
  866   2HG2  VAL 113          2HG2      VAL 113  15.292   2.331   0.829
  867   3HG2  VAL 113          3HG2      VAL 113  14.392   3.707   1.465
  868    H    LYS 114           H        LYS 114  14.567   0.695  -2.879
  869    HA   LYS 114           HA       LYS 114  16.978  -0.261  -1.383
  870   1HB   LYS 114          1HB       LYS 114  15.055  -1.735  -3.068
  871   2HB   LYS 114          2HB       LYS 114  16.747  -2.044  -3.455
  872   1HG   LYS 114          1HG       LYS 114  17.153  -2.470  -1.007
  873   2HG   LYS 114          2HG       LYS 114  15.412  -2.353  -0.753
  874   1HD   LYS 114          1HD       LYS 114  16.497  -4.218  -2.847
  875   2HD   LYS 114          2HD       LYS 114  16.478  -4.710  -1.153
  876   1HE   LYS 114          1HE       LYS 114  13.952  -3.766  -1.346
  877   2HE   LYS 114          2HE       LYS 114  14.197  -4.302  -3.021
  878   1HZ   LYS 114          1HZ       LYS 114  15.121  -6.398  -2.087
  879   2HZ   LYS 114          2HZ       LYS 114  14.612  -5.893  -0.548
  880   3HZ   LYS 114          3HZ       LYS 114  13.469  -6.180  -1.772
  881    H    ASN 115           H        ASN 115  18.884  -0.513  -2.832
  882    HA   ASN 115           HA       ASN 115  18.939   0.556  -5.515
  883   1HB   ASN 115          1HB       ASN 115  18.906   2.393  -3.309
  884   2HB   ASN 115          2HB       ASN 115  20.487   2.484  -4.079
  885   1HD2  ASN 115          2HD2      ASN 115  18.463   4.592  -4.224
  886   2HD2  ASN 115          1HD2      ASN 115  18.015   4.743  -5.854
  887    HA   PRO 116           HA       PRO 116  22.952  -1.207  -5.410
  888   1HB   PRO 116          1HB       PRO 116  24.625   0.584  -6.628
  889   2HB   PRO 116          2HB       PRO 116  23.412  -0.370  -7.505
  890   1HG   PRO 116          1HG       PRO 116  23.313   2.467  -6.624
  891   2HG   PRO 116          2HG       PRO 116  22.704   1.723  -8.110
  892   1HD   PRO 116          1HD       PRO 116  21.121   2.399  -5.991
  893   2HD   PRO 116          2HD       PRO 116  20.727   1.108  -7.145
  894    H    VAL 117           H        VAL 117  22.471   1.635  -3.591
  895    HA   VAL 117           HA       VAL 117  25.221   1.531  -2.434
  896    HB   VAL 117           HB       VAL 117  22.952   3.506  -2.048
  897   1HG1  VAL 117          1HG1      VAL 117  24.633   3.381  -0.193
  898   2HG1  VAL 117          2HG1      VAL 117  25.901   3.722  -1.372
  899   3HG1  VAL 117          3HG1      VAL 117  24.655   4.927  -1.042
  900   1HG2  VAL 117          1HG2      VAL 117  25.103   3.200  -4.074
  901   2HG2  VAL 117          2HG2      VAL 117  23.533   3.990  -4.207
  902   3HG2  VAL 117          3HG2      VAL 117  24.877   4.826  -3.429
  903    H    GLY 118           H        GLY 118  21.789   1.077  -1.565
  904   1HA   GLY 118          2HA       GLY 118  22.086   0.895   1.244
  905   2HA   GLY 118          1HA       GLY 118  22.462  -0.698   0.587
  906    H    GLU 119           H        GLU 119  20.133   0.340   2.213
  907    HA   GLU 119           HA       GLU 119  17.789   0.270   0.492
  908   1HB   GLU 119          1HB       GLU 119  17.073  -2.006   1.181
  909   2HB   GLU 119          2HB       GLU 119  18.601  -2.055   0.301
  910   1HG   GLU 119          1HG       GLU 119  19.525  -1.747   2.835
  911   2HG   GLU 119          2HG       GLU 119  18.040  -2.644   3.155
  912    H    ASP 120           H        ASP 120  15.869   0.654   1.733
  913    HA   ASP 120           HA       ASP 120  16.204   0.855   4.697
  914   1HB   ASP 120          1HB       ASP 120  16.275   2.980   2.860
  915   2HB   ASP 120          2HB       ASP 120  14.658   3.041   3.562
  916    H    GLN 121           H        GLN 121  14.008   1.174   5.766
  917    HA   GLN 121           HA       GLN 121  11.759   0.085   4.124
  918   1HB   GLN 121          1HB       GLN 121  13.299  -1.215   6.209
  919   2HB   GLN 121          2HB       GLN 121  11.607  -1.088   6.689
  920   1HG   GLN 121          1HG       GLN 121  10.949  -2.066   4.490
  921   2HG   GLN 121          2HG       GLN 121  12.657  -2.288   4.111
  922   1HE2  GLN 121          2HE2      GLN 121  12.873  -4.560   4.254
  923   2HE2  GLN 121          1HE2      GLN 121  12.482  -5.461   5.638
  924    H    VAL 122           H        VAL 122   9.653   0.396   5.209
  925    HA   VAL 122           HA       VAL 122   9.422   2.134   7.538
  926    HB   VAL 122           HB       VAL 122   9.948   3.961   6.191
  927   1HG1  VAL 122          1HG1      VAL 122   9.091   2.149   4.011
  928   2HG1  VAL 122          2HG1      VAL 122   8.862   3.870   3.710
  929   3HG1  VAL 122          3HG1      VAL 122  10.467   3.245   4.089
  930   1HG2  VAL 122          1HG2      VAL 122   7.566   4.185   6.984
  931   2HG2  VAL 122          2HG2      VAL 122   7.913   5.108   5.522
  932   3HG2  VAL 122          3HG2      VAL 122   7.037   3.581   5.414
  933    H    ASN 123           H        ASN 123   7.115   2.465   8.065
  934    HA   ASN 123           HA       ASN 123   5.403   0.357   6.807
  935   1HB   ASN 123          1HB       ASN 123   5.103   1.803   9.455
  936   2HB   ASN 123          2HB       ASN 123   4.247   0.350   8.944
  937   1HD2  ASN 123          2HD2      ASN 123   7.275   1.556  10.252
  938   2HD2  ASN 123          1HD2      ASN 123   8.008   0.040  10.462
  939    H    LEU 124           H        LEU 124   3.452   0.928   5.905
  940    HA   LEU 124           HA       LEU 124   2.742   3.836   5.880
  941   1HB   LEU 124          1HB       LEU 124   3.471   3.007   3.725
  942   2HB   LEU 124          2HB       LEU 124   2.439   1.589   3.867
  943    HG   LEU 124           HG       LEU 124   0.754   3.874   4.176
  944   1HD1  LEU 124          1HD1      LEU 124   2.964   4.710   2.798
  945   2HD1  LEU 124          2HD1      LEU 124   1.947   4.121   1.484
  946   3HD1  LEU 124          3HD1      LEU 124   1.348   5.374   2.569
  947   1HD2  LEU 124          1HD2      LEU 124   1.165   1.592   2.296
  948   2HD2  LEU 124          2HD2      LEU 124  -0.286   2.073   3.176
  949   3HD2  LEU 124          3HD2      LEU 124   0.179   2.930   1.708
  950    H    THR 125           H        THR 125   0.985   4.174   7.187
  951    HA   THR 125           HA       THR 125  -0.814   2.027   7.982
  952    HB   THR 125           HB       THR 125  -0.100   3.955   9.400
  953    HG1  THR 125           HG1      THR 125  -2.868   3.730   8.837
  954   1HG2  THR 125          1HG2      THR 125  -1.840   5.537   7.487
  955   2HG2  THR 125          2HG2      THR 125  -1.174   6.157   8.997
  956   3HG2  THR 125          3HG2      THR 125  -0.095   5.700   7.680
  957    H    VAL 126           H        VAL 126  -3.139   2.021   7.575
  958    HA   VAL 126           HA       VAL 126  -4.039   3.597   5.211
  959    HB   VAL 126           HB       VAL 126  -3.174   1.451   4.402
  960   1HG1  VAL 126          1HG1      VAL 126  -4.728   0.448   6.728
  961   2HG1  VAL 126          2HG1      VAL 126  -4.732  -0.559   5.281
  962   3HG1  VAL 126          3HG1      VAL 126  -3.205  -0.132   6.053
  963   1HG2  VAL 126          1HG2      VAL 126  -5.370   2.456   3.512
  964   2HG2  VAL 126          2HG2      VAL 126  -5.081   0.752   3.162
  965   3HG2  VAL 126          3HG2      VAL 126  -6.186   1.211   4.457
  966    H    LYS 127           H        LYS 127  -6.412   3.641   5.024
  967    HA   LYS 127           HA       LYS 127  -8.053   2.527   7.186
  968   1HB   LYS 127          1HB       LYS 127  -6.877   5.222   7.255
  969   2HB   LYS 127          2HB       LYS 127  -8.628   5.227   7.469
  970   1HG   LYS 127          1HG       LYS 127  -8.257   4.682   9.627
  971   2HG   LYS 127          2HG       LYS 127  -7.757   3.093   9.050
  972   1HD   LYS 127          1HD       LYS 127  -5.773   3.591  10.039
  973   2HD   LYS 127          2HD       LYS 127  -5.491   4.574   8.603
  974   1HE   LYS 127          1HE       LYS 127  -6.843   5.618  11.116
  975   2HE   LYS 127          2HE       LYS 127  -5.124   5.851  10.737
  976   1HZ   LYS 127          1HZ       LYS 127  -5.814   6.782   8.577
  977   2HZ   LYS 127          2HZ       LYS 127  -7.435   6.686   9.067
  978   3HZ   LYS 127          3HZ       LYS 127  -6.360   7.712   9.890
  979    H    VAL 128           H        VAL 128  -9.785   1.889   5.949
  980    HA   VAL 128           HA       VAL 128 -10.534   3.378   3.521
  981    HB   VAL 128           HB       VAL 128 -11.840   0.993   4.873
  982   1HG1  VAL 128          1HG1      VAL 128 -12.808   2.496   2.840
  983   2HG1  VAL 128          2HG1      VAL 128 -11.810   1.365   1.926
  984   3HG1  VAL 128          3HG1      VAL 128 -13.095   0.762   2.971
  985   1HG2  VAL 128          1HG2      VAL 128  -9.235   1.069   3.972
  986   2HG2  VAL 128          2HG2      VAL 128 -10.230  -0.385   4.035
  987   3HG2  VAL 128          3HG2      VAL 128 -10.100   0.532   2.536
  988    H    ILE 129           H        ILE 129 -11.923   5.085   3.642
  989    HA   ILE 129           HA       ILE 129 -13.845   5.202   5.926
  990    HB   ILE 129           HB       ILE 129 -11.982   7.012   4.872
  991   1HG1  ILE 129          1HG1      ILE 129 -12.982   8.579   6.499
  992   2HG1  ILE 129          2HG1      ILE 129 -14.412   7.552   6.605
  993   1HG2  ILE 129          1HG2      ILE 129 -14.793   7.902   4.152
  994   2HG2  ILE 129          2HG2      ILE 129 -13.346   8.908   4.080
  995   3HG2  ILE 129          3HG2      ILE 129 -13.512   7.523   3.002
  996   1HD1  ILE 129          1HD1      ILE 129 -11.971   6.016   7.008
  997   2HD1  ILE 129          2HD1      ILE 129 -12.105   7.336   8.169
  998   3HD1  ILE 129          3HD1      ILE 129 -13.395   6.141   8.041
  999    H    ASP 130           H        ASP 130 -16.010   6.198   5.325
 1000    HA   ASP 130           HA       ASP 130 -16.915   5.082   2.699
 1001   1HB   ASP 130          1HB       ASP 130 -17.773   4.752   5.338
 1002   2HB   ASP 130          2HB       ASP 130 -18.958   5.858   4.645

  No H/Q in entry =        1002
  Start of MODEL    7
    1    H1   ARG   1          1H        ARG   1  26.146   2.766  -7.554
    2    H2   ARG   1          2H        ARG   1  27.645   1.968  -7.515
    3    H3   ARG   1          3H        ARG   1  27.171   2.944  -6.212
    4    HA   ARG   1           HA       ARG   1  28.728   4.228  -7.427
    5   1HB   ARG   1          1HB       ARG   1  28.448   4.419  -9.893
    6   2HB   ARG   1          2HB       ARG   1  28.653   2.742  -9.387
    7   1HG   ARG   1          1HG       ARG   1  26.245   2.367  -9.504
    8   2HG   ARG   1          2HG       ARG   1  25.972   4.067  -9.890
    9   1HD   ARG   1          1HD       ARG   1  27.493   3.694 -11.930
   10   2HD   ARG   1          2HD       ARG   1  27.302   1.958 -11.608
   11    HE   ARG   1           HE       ARG   1  24.915   2.185 -11.998
   12   1HH1  ARG   1          1HH1      ARG   1  26.463   3.925 -14.139
   13   2HH1  ARG   1          2HH1      ARG   1  25.362   5.257 -14.255
   14   1HH2  ARG   1          1HH2      ARG   1  23.604   4.399 -11.392
   15   2HH2  ARG   1          2HH2      ARG   1  23.744   5.527 -12.700
   16    H    GLN   2           H        GLN   2  26.063   4.605  -6.101
   17    HA   GLN   2           HA       GLN   2  25.529   7.328  -7.149
   18   1HB   GLN   2          1HB       GLN   2  23.010   6.662  -6.956
   19   2HB   GLN   2          2HB       GLN   2  23.913   6.162  -8.380
   20   1HG   GLN   2          1HG       GLN   2  23.771   3.975  -7.854
   21   2HG   GLN   2          2HG       GLN   2  24.099   4.265  -6.151
   22   1HE2  GLN   2          2HE2      GLN   2  22.146   5.415  -4.965
   23   2HE2  GLN   2          1HE2      GLN   2  20.599   4.843  -5.363
   24    H    GLU   3           H        GLU   3  23.242   7.820  -5.551
   25    HA   GLU   3           HA       GLU   3  24.496   8.112  -2.920
   26   1HB   GLU   3          1HB       GLU   3  21.932   8.953  -4.265
   27   2HB   GLU   3          2HB       GLU   3  22.175   9.226  -2.539
   28   1HG   GLU   3          1HG       GLU   3  24.414  10.035  -4.317
   29   2HG   GLU   3          2HG       GLU   3  22.945  11.005  -4.425
   30    HA   PRO   4           HA       PRO   4  22.716   4.524  -1.060
   31   1HB   PRO   4          1HB       PRO   4  22.590   5.390   1.537
   32   2HB   PRO   4          2HB       PRO   4  24.100   4.884   0.750
   33   1HG   PRO   4          1HG       PRO   4  23.015   7.637   1.160
   34   2HG   PRO   4          2HG       PRO   4  24.667   7.035   1.383
   35   1HD   PRO   4          1HD       PRO   4  23.965   8.403  -0.815
   36   2HD   PRO   4          2HD       PRO   4  25.128   7.059  -0.888
   37    HA   PRO   5           HA       PRO   5  18.408   5.625  -1.153
   38   1HB   PRO   5          1HB       PRO   5  17.432   3.137  -0.554
   39   2HB   PRO   5          2HB       PRO   5  18.051   3.567  -2.159
   40   1HG   PRO   5          1HG       PRO   5  19.404   2.130   0.075
   41   2HG   PRO   5          2HG       PRO   5  19.401   1.752  -1.655
   42   1HD   PRO   5          1HD       PRO   5  21.475   2.985  -0.475
   43   2HD   PRO   5          2HD       PRO   5  20.982   3.364  -2.142
   44    H    LYS   6           H        LYS   6  16.970   6.262   0.461
   45    HA   LYS   6           HA       LYS   6  16.856   5.021   3.082
   46   1HB   LYS   6          1HB       LYS   6  18.734   7.216   2.499
   47   2HB   LYS   6          2HB       LYS   6  17.707   7.518   3.900
   48   1HG   LYS   6          1HG       LYS   6  18.582   4.801   4.037
   49   2HG   LYS   6          2HG       LYS   6  19.996   5.806   3.720
   50   1HD   LYS   6          1HD       LYS   6  18.084   6.815   5.764
   51   2HD   LYS   6          2HD       LYS   6  19.042   5.400   6.207
   52   1HE   LYS   6          1HE       LYS   6  21.081   6.557   6.001
   53   2HE   LYS   6          2HE       LYS   6  20.370   7.810   4.964
   54   1HZ   LYS   6          1HZ       LYS   6  19.637   7.323   7.804
   55   2HZ   LYS   6          2HZ       LYS   6  20.643   8.581   7.263
   56   3HZ   LYS   6          3HZ       LYS   6  19.011   8.545   6.803
   57    H    ILE   7           H        ILE   7  15.103   5.885   4.305
   58    HA   ILE   7           HA       ILE   7  13.065   7.283   2.786
   59    HB   ILE   7           HB       ILE   7  13.222   6.784   5.776
   60   1HG1  ILE   7          1HG1      ILE   7  13.721   4.651   4.814
   61   2HG1  ILE   7          2HG1      ILE   7  11.998   4.613   5.172
   62   1HG2  ILE   7          1HG2      ILE   7  11.343   8.158   4.529
   63   2HG2  ILE   7          2HG2      ILE   7  10.758   6.553   4.088
   64   3HG2  ILE   7          3HG2      ILE   7  10.913   7.000   5.786
   65   1HD1  ILE   7          1HD1      ILE   7  13.188   5.261   2.453
   66   2HD1  ILE   7          2HD1      ILE   7  12.506   3.701   2.912
   67   3HD1  ILE   7          3HD1      ILE   7  11.470   5.125   2.832
   68    H    HIS   8           H        HIS   8  14.896   9.077   2.452
   69    HA   HIS   8           HA       HIS   8  14.620  11.151   4.602
   70   1HB   HIS   8          1HB       HIS   8  16.883  10.333   4.368
   71   2HB   HIS   8          2HB       HIS   8  16.804  10.455   2.614
   72    HD1  HIS   8           HD1      HIS   8  18.244  12.168   5.333
   73    HD2  HIS   8           HD2      HIS   8  16.149  13.443   1.965
   74    HE1  HIS   8           HE1      HIS   8  18.851  14.603   4.993
   75    H    LEU   9           H        LEU   9  14.246  13.339   3.844
   76    HA   LEU   9           HA       LEU   9  13.591  13.610   0.946
   77   1HB   LEU   9          1HB       LEU   9  11.566  15.027   1.998
   78   2HB   LEU   9          2HB       LEU   9  11.446  13.304   1.706
   79    HG   LEU   9           HG       LEU   9  12.138  12.879   4.062
   80   1HD1  LEU   9          1HD1      LEU   9  12.110  15.896   4.132
   81   2HD1  LEU   9          2HD1      LEU   9  11.873  14.940   5.590
   82   3HD1  LEU   9          3HD1      LEU   9  13.376  14.802   4.682
   83   1HD2  LEU   9          1HD2      LEU   9   9.692  14.448   3.338
   84   2HD2  LEU   9          2HD2      LEU   9   9.829  12.769   3.857
   85   3HD2  LEU   9          3HD2      LEU   9   9.983  14.071   5.036
   86    H    ASP  10           H        ASP  10  12.442  16.323   2.458
   87    HA   ASP  10           HA       ASP  10  14.295  18.130   1.425
   88   1HB   ASP  10          1HB       ASP  10  11.931  18.239   2.738
   89   2HB   ASP  10          2HB       ASP  10  13.007  18.787   4.023
   90    H    CYS  11           H        CYS  11  14.448  16.352   4.493
   91    HA   CYS  11           HA       CYS  11  17.269  16.742   4.746
   92   1HB   CYS  11          1HB       CYS  11  15.585  18.933   5.539
   93   2HB   CYS  11          2HB       CYS  11  16.404  18.300   6.966
   94    HG   CYS  11           HG       CYS  11  18.008  19.137   4.409
   95    HA   PRO  12           HA       PRO  12  15.724  15.078   8.952
   96   1HB   PRO  12          1HB       PRO  12  13.015  14.882   9.350
   97   2HB   PRO  12          2HB       PRO  12  13.977  16.296   9.823
   98   1HG   PRO  12          1HG       PRO  12  12.266  15.893   7.416
   99   2HG   PRO  12          2HG       PRO  12  12.461  17.327   8.436
  100   1HD   PRO  12          1HD       PRO  12  13.672  17.074   6.032
  101   2HD   PRO  12          2HD       PRO  12  14.390  17.988   7.374
  102    H    GLY  13           H        GLY  13  12.921  14.219   6.885
  103   1HA   GLY  13          2HA       GLY  13  13.972  11.419   6.859
  104   2HA   GLY  13          1HA       GLY  13  13.166  12.143   5.467
  105    H    ARG  14           H        ARG  14  11.005  13.391   6.630
  106    HA   ARG  14           HA       ARG  14   9.595  11.262   8.187
  107   1HB   ARG  14          1HB       ARG  14   9.056  14.215   7.721
  108   2HB   ARG  14          2HB       ARG  14   8.051  13.162   8.717
  109   1HG   ARG  14          1HG       ARG  14  10.438  12.615   9.824
  110   2HG   ARG  14          2HG       ARG  14  10.769  14.253   9.259
  111   1HD   ARG  14          1HD       ARG  14   8.929  15.155  10.527
  112   2HD   ARG  14          2HD       ARG  14   8.322  13.531  10.908
  113    HE   ARG  14           HE       ARG  14  10.828  13.353  11.900
  114   1HH1  ARG  14          1HH1      ARG  14   9.913  16.496  11.683
  115   2HH1  ARG  14          2HH1      ARG  14   9.827  16.811  13.384
  116   1HH2  ARG  14          1HH2      ARG  14  10.104  13.473  14.284
  117   2HH2  ARG  14          2HH2      ARG  14   9.936  15.099  14.857
  118    H    ILE  15           H        ILE  15   9.173   9.967   6.226
  119    HA   ILE  15           HA       ILE  15   7.633  11.125   4.023
  120    HB   ILE  15           HB       ILE  15   8.757   8.475   4.855
  121   1HG1  ILE  15          1HG1      ILE  15   8.766  10.042   2.254
  122   2HG1  ILE  15          2HG1      ILE  15  10.031  10.103   3.479
  123   1HG2  ILE  15          1HG2      ILE  15   6.353   8.855   3.116
  124   2HG2  ILE  15          2HG2      ILE  15   7.562   7.682   2.595
  125   3HG2  ILE  15          3HG2      ILE  15   6.776   7.501   4.164
  126   1HD1  ILE  15          1HD1      ILE  15   9.499   7.352   2.835
  127   2HD1  ILE  15          2HD1      ILE  15   9.772   8.247   1.342
  128   3HD1  ILE  15          3HD1      ILE  15  10.993   8.263   2.613
  129    HA   PRO  16           HA       PRO  16   3.840  10.630   6.361
  130   1HB   PRO  16          1HB       PRO  16   2.161  11.598   4.429
  131   2HB   PRO  16          2HB       PRO  16   3.148  12.647   5.465
  132   1HG   PRO  16          1HG       PRO  16   3.616  11.780   2.657
  133   2HG   PRO  16          2HG       PRO  16   3.916  13.350   3.419
  134   1HD   PRO  16          1HD       PRO  16   5.875  11.519   2.921
  135   2HD   PRO  16          2HD       PRO  16   5.954  12.711   4.236
  136    H    ASP  17           H        ASP  17   4.680   8.224   5.582
  137    HA   ASP  17           HA       ASP  17   3.312   6.948   3.411
  138   1HB   ASP  17          1HB       ASP  17   3.896   4.871   4.828
  139   2HB   ASP  17          2HB       ASP  17   5.238   5.905   4.347
  140    H    THR  18           H        THR  18   1.111   7.872   3.748
  141    HA   THR  18           HA       THR  18  -0.511   6.125   5.552
  142    HB   THR  18           HB       THR  18  -0.157   8.185   6.777
  143    HG1  THR  18           HG1      THR  18  -2.331   7.356   6.610
  144   1HG2  THR  18          1HG2      THR  18  -0.154   9.313   4.124
  145   2HG2  THR  18          2HG2      THR  18  -1.317  10.171   5.134
  146   3HG2  THR  18          3HG2      THR  18   0.368  10.048   5.640
  147    H    ILE  19           H        ILE  19  -1.834   5.083   4.103
  148    HA   ILE  19           HA       ILE  19  -2.824   6.637   1.746
  149    HB   ILE  19           HB       ILE  19  -1.438   4.580   1.410
  150   1HG1  ILE  19          1HG1      ILE  19  -3.058   3.486  -0.174
  151   2HG1  ILE  19          2HG1      ILE  19  -4.329   4.499   0.512
  152   1HG2  ILE  19          1HG2      ILE  19  -2.855   3.540   3.500
  153   2HG2  ILE  19          2HG2      ILE  19  -3.693   2.809   2.133
  154   3HG2  ILE  19          3HG2      ILE  19  -1.959   2.564   2.337
  155   1HD1  ILE  19          1HD1      ILE  19  -1.783   5.546  -0.758
  156   2HD1  ILE  19          2HD1      ILE  19  -3.353   5.487  -1.556
  157   3HD1  ILE  19          3HD1      ILE  19  -3.119   6.521  -0.148
  158    H    VAL  20           H        VAL  20  -4.930   7.294   1.879
  159    HA   VAL  20           HA       VAL  20  -6.820   5.640   3.513
  160    HB   VAL  20           HB       VAL  20  -6.707   8.639   3.046
  161   1HG1  VAL  20          1HG1      VAL  20  -8.554   6.927   4.737
  162   2HG1  VAL  20          2HG1      VAL  20  -8.503   8.689   4.776
  163   3HG1  VAL  20          3HG1      VAL  20  -9.009   7.853   3.307
  164   1HG2  VAL  20          1HG2      VAL  20  -5.834   6.817   5.274
  165   2HG2  VAL  20          2HG2      VAL  20  -4.998   8.209   4.586
  166   3HG2  VAL  20          3HG2      VAL  20  -6.381   8.451   5.652
  167    H    VAL  21           H        VAL  21  -8.961   5.463   2.658
  168    HA   VAL  21           HA       VAL  21  -9.497   6.554  -0.055
  169    HB   VAL  21           HB       VAL  21  -8.302   4.453  -0.414
  170   1HG1  VAL  21          1HG1      VAL  21  -9.025   3.621   1.955
  171   2HG1  VAL  21          2HG1      VAL  21 -10.436   2.981   1.116
  172   3HG1  VAL  21          3HG1      VAL  21  -8.821   2.434   0.671
  173   1HG2  VAL  21          1HG2      VAL  21 -10.596   5.070  -1.614
  174   2HG2  VAL  21          2HG2      VAL  21  -9.802   3.526  -1.922
  175   3HG2  VAL  21          3HG2      VAL  21 -11.153   3.613  -0.790
  176    H    VAL  22           H        VAL  22 -11.808   6.292  -0.629
  177    HA   VAL  22           HA       VAL  22 -13.526   6.158   1.805
  178    HB   VAL  22           HB       VAL  22 -14.017   7.186  -1.013
  179   1HG1  VAL  22          1HG1      VAL  22 -15.682   7.051   1.476
  180   2HG1  VAL  22          2HG1      VAL  22 -15.865   8.441   0.408
  181   3HG1  VAL  22          3HG1      VAL  22 -16.164   6.814  -0.202
  182   1HG2  VAL  22          1HG2      VAL  22 -12.347   8.287   0.838
  183   2HG2  VAL  22          2HG2      VAL  22 -13.264   9.237  -0.332
  184   3HG2  VAL  22          3HG2      VAL  22 -13.876   9.027   1.310
  185    H    ALA  23           H        ALA  23 -12.774   3.650   1.122
  186    HA   ALA  23           HA       ALA  23 -13.512   1.535   0.355
  187   1HB   ALA  23          1HB       ALA  23 -15.744   3.133   1.467
  188   2HB   ALA  23          3HB       ALA  23 -15.125   1.561   1.972
  189   3HB   ALA  23          2HB       ALA  23 -16.214   1.678   0.590
  190    H    GLY  24           H        GLY  24 -12.929   1.607  -1.888
  191   1HA   GLY  24          2HA       GLY  24 -15.197   1.537  -3.714
  192   2HA   GLY  24          1HA       GLY  24 -13.512   1.256  -4.147
  193    H    ASN  25           H        ASN  25 -12.310   3.627  -3.403
  194    HA   ASN  25           HA       ASN  25 -13.599   5.558  -5.289
  195   1HB   ASN  25          1HB       ASN  25 -13.196   5.752  -2.397
  196   2HB   ASN  25          2HB       ASN  25 -12.467   7.104  -3.262
  197   1HD2  ASN  25          2HD2      ASN  25 -13.993   8.773  -3.017
  198   2HD2  ASN  25          1HD2      ASN  25 -15.634   8.633  -3.423
  199    H    LYS  26           H        LYS  26 -12.003   7.263  -5.983
  200    HA   LYS  26           HA       LYS  26  -9.405   6.062  -6.600
  201   1HB   LYS  26          1HB       LYS  26 -10.619   8.806  -7.087
  202   2HB   LYS  26          2HB       LYS  26  -9.131   8.217  -7.832
  203   1HG   LYS  26          1HG       LYS  26 -10.892   6.166  -8.365
  204   2HG   LYS  26          2HG       LYS  26 -11.930   7.587  -8.488
  205   1HD   LYS  26          1HD       LYS  26  -9.256   7.321  -9.891
  206   2HD   LYS  26          2HD       LYS  26 -10.809   6.967 -10.652
  207   1HE   LYS  26          1HE       LYS  26 -11.067   9.167 -11.120
  208   2HE   LYS  26          2HE       LYS  26 -11.003   9.540  -9.385
  209   1HZ   LYS  26          1HZ       LYS  26  -8.594   8.990 -11.031
  210   2HZ   LYS  26          2HZ       LYS  26  -9.175  10.558 -10.731
  211   3HZ   LYS  26          3HZ       LYS  26  -8.645   9.592  -9.442
  212    H    LEU  27           H        LEU  27  -7.556   6.352  -5.398
  213    HA   LEU  27           HA       LEU  27  -7.467   8.656  -3.488
  214   1HB   LEU  27          1HB       LEU  27  -7.640   7.139  -1.836
  215   2HB   LEU  27          2HB       LEU  27  -7.669   5.829  -3.010
  216    HG   LEU  27           HG       LEU  27  -5.121   6.016  -3.081
  217   1HD1  LEU  27          1HD1      LEU  27  -5.566   8.326  -1.647
  218   2HD1  LEU  27          2HD1      LEU  27  -5.129   7.186  -0.374
  219   3HD1  LEU  27          3HD1      LEU  27  -4.025   7.473  -1.719
  220   1HD2  LEU  27          1HD2      LEU  27  -6.752   4.485  -1.604
  221   2HD2  LEU  27          2HD2      LEU  27  -4.998   4.395  -1.457
  222   3HD2  LEU  27          3HD2      LEU  27  -5.933   5.339  -0.297
  223    H    ARG  28           H        ARG  28  -5.396   9.567  -3.192
  224    HA   ARG  28           HA       ARG  28  -3.190   8.443  -4.889
  225   1HB   ARG  28          1HB       ARG  28  -4.388  11.187  -4.651
  226   2HB   ARG  28          2HB       ARG  28  -2.678  11.037  -5.058
  227   1HG   ARG  28          1HG       ARG  28  -4.527   9.271  -6.564
  228   2HG   ARG  28          2HG       ARG  28  -4.645  10.994  -6.919
  229   1HD   ARG  28          1HD       ARG  28  -1.865  10.366  -6.779
  230   2HD   ARG  28          2HD       ARG  28  -2.636   9.146  -7.812
  231    HE   ARG  28           HE       ARG  28  -2.747  12.091  -8.268
  232   1HH1  ARG  28          1HH1      ARG  28  -4.612  12.272  -9.855
  233   2HH1  ARG  28          2HH1      ARG  28  -4.509  11.175 -11.191
  234   1HH2  ARG  28          1HH2      ARG  28  -2.083   9.186  -9.714
  235   2HH2  ARG  28          2HH2      ARG  28  -3.078   9.428 -11.111
  236    H    LEU  29           H        LEU  29  -1.124   8.537  -3.938
  237    HA   LEU  29           HA       LEU  29  -0.887   9.866  -1.265
  238   1HB   LEU  29          1HB       LEU  29  -1.439   7.539  -0.870
  239   2HB   LEU  29          2HB       LEU  29  -0.237   7.008  -2.042
  240    HG   LEU  29           HG       LEU  29   1.555   7.936  -0.622
  241   1HD1  LEU  29          1HD1      LEU  29  -0.808   8.757   1.055
  242   2HD1  LEU  29          2HD1      LEU  29   0.782   8.528   1.781
  243   3HD1  LEU  29          3HD1      LEU  29   0.555   9.739   0.520
  244   1HD2  LEU  29          1HD2      LEU  29   0.049   5.636  -0.147
  245   2HD2  LEU  29          2HD2      LEU  29   1.640   5.988   0.526
  246   3HD2  LEU  29          3HD2      LEU  29   0.187   6.383   1.442
  247    H    ASP  30           H        ASP  30   1.009  11.025  -1.145
  248    HA   ASP  30           HA       ASP  30   3.177  10.360  -3.113
  249   1HB   ASP  30          1HB       ASP  30   1.540  12.670  -2.809
  250   2HB   ASP  30          2HB       ASP  30   3.169  13.125  -2.312
  251    H    VAL  31           H        VAL  31   5.155  10.025  -2.198
  252    HA   VAL  31           HA       VAL  31   5.825  11.294   0.404
  253    HB   VAL  31           HB       VAL  31   6.604   8.981   1.165
  254   1HG1  VAL  31          1HG1      VAL  31   4.485  10.147   1.898
  255   2HG1  VAL  31          2HG1      VAL  31   3.631   9.230   0.656
  256   3HG1  VAL  31          3HG1      VAL  31   4.421   8.386   1.989
  257   1HG2  VAL  31          1HG2      VAL  31   6.107   8.262  -1.425
  258   2HG2  VAL  31          2HG2      VAL  31   6.186   7.121  -0.085
  259   3HG2  VAL  31          3HG2      VAL  31   4.625   7.727  -0.636
  260    HA   PRO  32           HA       PRO  32   9.484  11.585  -2.174
  261   1HB   PRO  32          1HB       PRO  32  10.875  13.277  -0.541
  262   2HB   PRO  32          2HB       PRO  32   9.571  13.821  -1.613
  263   1HG   PRO  32          1HG       PRO  32   9.533  13.335   1.314
  264   2HG   PRO  32          2HG       PRO  32   8.690  14.564   0.361
  265   1HD   PRO  32          1HD       PRO  32   7.523  12.273   1.342
  266   2HD   PRO  32          2HD       PRO  32   6.916  13.200  -0.046
  267    H    ILE  33           H        ILE  33  11.621  10.731  -2.080
  268    HA   ILE  33           HA       ILE  33  12.580   9.578   0.491
  269    HB   ILE  33           HB       ILE  33  12.787   7.736  -1.810
  270   1HG1  ILE  33          1HG1      ILE  33  10.058   8.275  -0.584
  271   2HG1  ILE  33          2HG1      ILE  33  10.521   8.688  -2.235
  272   1HG2  ILE  33          1HG2      ILE  33  12.070   7.622   1.110
  273   2HG2  ILE  33          2HG2      ILE  33  11.794   6.227   0.070
  274   3HG2  ILE  33          3HG2      ILE  33  13.424   6.866   0.273
  275   1HD1  ILE  33          1HD1      ILE  33  11.085   5.891  -1.519
  276   2HD1  ILE  33          2HD1      ILE  33   9.372   6.303  -1.477
  277   3HD1  ILE  33          3HD1      ILE  33  10.302   6.549  -2.954
  278    H    SER  34           H        SER  34  14.841   8.440  -0.079
  279    HA   SER  34           HA       SER  34  16.400  10.462  -1.601
  280   1HB   SER  34          1HB       SER  34  16.884   9.610   0.774
  281   2HB   SER  34          2HB       SER  34  17.382   8.100   0.020
  282    HG   SER  34           HG       SER  34  18.631  10.546   0.107
  283    H    GLY  35           H        GLY  35  18.555   8.359  -1.999
  284   1HA   GLY  35          2HA       GLY  35  17.380   6.473  -3.919
  285   2HA   GLY  35          1HA       GLY  35  19.091   6.604  -3.508
  286    H    ASP  36           H        ASP  36  19.835   6.721  -5.661
  287    HA   ASP  36           HA       ASP  36  18.736   8.816  -7.446
  288   1HB   ASP  36          1HB       ASP  36  20.624   9.538  -5.686
  289   2HB   ASP  36          2HB       ASP  36  21.678   8.872  -6.933
  290    HA   PRO  37           HA       PRO  37  18.644   9.310  -9.302
  291   1HB   PRO  37          1HB       PRO  37  17.284   8.391 -11.490
  292   2HB   PRO  37          2HB       PRO  37  18.884   9.148 -11.589
  293   1HG   PRO  37          1HG       PRO  37  18.134   6.290 -11.761
  294   2HG   PRO  37          2HG       PRO  37  19.449   7.167 -12.552
  295   1HD   PRO  37          1HD       PRO  37  19.730   5.522 -10.340
  296   2HD   PRO  37          2HD       PRO  37  20.892   6.761 -10.856
  297    H    ALA  38           H        ALA  38  16.978   6.291 -10.301
  298    HA   ALA  38           HA       ALA  38  14.804   6.954  -8.373
  299   1HB   ALA  38          2HB       ALA  38  14.662   4.814 -10.466
  300   2HB   ALA  38          1HB       ALA  38  14.646   6.503 -10.976
  301   3HB   ALA  38          3HB       ALA  38  13.394   5.897  -9.892
  302    HA   PRO  39           HA       PRO  39  16.326   3.440  -6.073
  303   1HB   PRO  39          1HB       PRO  39  14.711   3.787  -3.899
  304   2HB   PRO  39          2HB       PRO  39  16.148   4.784  -4.198
  305   1HG   PRO  39          1HG       PRO  39  13.301   5.459  -4.484
  306   2HG   PRO  39          2HG       PRO  39  14.689   6.511  -4.195
  307   1HD   PRO  39          1HD       PRO  39  13.345   6.091  -6.648
  308   2HD   PRO  39          2HD       PRO  39  14.846   7.002  -6.390
  309    H    THR  40           H        THR  40  14.763   1.852  -4.481
  310    HA   THR  40           HA       THR  40  12.560   0.919  -6.297
  311    HB   THR  40           HB       THR  40  14.093  -0.918  -4.487
  312    HG1  THR  40           HG1      THR  40  15.765  -1.021  -5.879
  313   1HG2  THR  40          1HG2      THR  40  12.759  -1.109  -7.192
  314   2HG2  THR  40          2HG2      THR  40  13.750  -2.406  -6.524
  315   3HG2  THR  40          3HG2      THR  40  12.280  -1.902  -5.691
  316    H    VAL  41           H        VAL  41  11.053   2.155  -4.959
  317    HA   VAL  41           HA       VAL  41  10.806   1.426  -2.103
  318    HB   VAL  41           HB       VAL  41  10.568   3.755  -2.854
  319   1HG1  VAL  41          1HG1      VAL  41   9.276   2.628  -5.051
  320   2HG1  VAL  41          2HG1      VAL  41   7.967   3.404  -4.165
  321   3HG1  VAL  41          3HG1      VAL  41   9.362   4.350  -4.682
  322   1HG2  VAL  41          1HG2      VAL  41   9.185   2.834  -0.940
  323   2HG2  VAL  41          2HG2      VAL  41   8.521   4.275  -1.708
  324   3HG2  VAL  41          3HG2      VAL  41   7.842   2.689  -2.073
  325    H    ILE  42           H        ILE  42  10.029  -0.682  -1.997
  326    HA   ILE  42           HA       ILE  42   7.763  -1.532  -3.698
  327    HB   ILE  42           HB       ILE  42   9.539  -2.876  -1.640
  328   1HG1  ILE  42          1HG1      ILE  42   9.480  -3.082  -4.667
  329   2HG1  ILE  42          2HG1      ILE  42  10.636  -2.114  -3.752
  330   1HG2  ILE  42          1HG2      ILE  42   7.459  -4.028  -3.515
  331   2HG2  ILE  42          2HG2      ILE  42   8.621  -4.987  -2.598
  332   3HG2  ILE  42          3HG2      ILE  42   7.404  -4.031  -1.752
  333   1HD1  ILE  42          1HD1      ILE  42  10.360  -4.955  -2.927
  334   2HD1  ILE  42          2HD1      ILE  42  11.129  -4.667  -4.487
  335   3HD1  ILE  42          3HD1      ILE  42  11.803  -3.945  -3.025
  336    H    TRP  43           H        TRP  43   5.744  -0.923  -2.909
  337    HA   TRP  43           HA       TRP  43   5.197  -0.527  -0.066
  338   1HB   TRP  43          1HB       TRP  43   3.449  -0.772  -2.543
  339   2HB   TRP  43          2HB       TRP  43   2.851  -0.286  -0.958
  340    HD1  TRP  43           HD1      TRP  43   4.537   1.021  -4.015
  341    HE1  TRP  43           HE1      TRP  43   5.097   3.522  -3.721
  342    HE3  TRP  43           HE3      TRP  43   3.615   1.557   0.987
  343    HZ2  TRP  43           HZ2      TRP  43   5.147   5.480  -1.643
  344    HZ3  TRP  43           HZ3      TRP  43   3.957   3.722   2.098
  345    HH2  TRP  43           HH2      TRP  43   4.710   5.699   0.795
  346    H    GLN  44           H        GLN  44   5.165  -2.371   1.246
  347    HA   GLN  44           HA       GLN  44   4.232  -4.952   0.121
  348   1HB   GLN  44          1HB       GLN  44   5.305  -4.195   2.859
  349   2HB   GLN  44          2HB       GLN  44   5.099  -5.834   2.247
  350   1HG   GLN  44          1HG       GLN  44   6.638  -4.201   0.390
  351   2HG   GLN  44          2HG       GLN  44   7.390  -4.246   1.984
  352   1HE2  GLN  44          2HE2      GLN  44   8.174  -6.309   2.773
  353   2HE2  GLN  44          1HE2      GLN  44   8.274  -7.674   1.770
  354    H    LYS  45           H        LYS  45   2.707  -6.259   1.553
  355    HA   LYS  45           HA       LYS  45   0.536  -4.475   2.596
  356   1HB   LYS  45          1HB       LYS  45   0.686  -6.968   0.975
  357   2HB   LYS  45          2HB       LYS  45  -0.661  -6.853   2.107
  358   1HG   LYS  45          1HG       LYS  45  -1.488  -5.878   0.114
  359   2HG   LYS  45          2HG       LYS  45  -1.049  -4.502   1.124
  360   1HD   LYS  45          1HD       LYS  45   0.662  -3.876  -0.243
  361   2HD   LYS  45          2HD       LYS  45   1.139  -5.544  -0.567
  362   1HE   LYS  45          1HE       LYS  45  -0.942  -5.735  -2.032
  363   2HE   LYS  45          2HE       LYS  45  -1.096  -3.974  -1.882
  364   1HZ   LYS  45          1HZ       LYS  45   1.423  -5.317  -2.688
  365   2HZ   LYS  45          2HZ       LYS  45   0.281  -4.752  -3.812
  366   3HZ   LYS  45          3HZ       LYS  45   1.061  -3.663  -2.767
  367    H    ALA  46           H        ALA  46   1.521  -4.466   4.764
  368    HA   ALA  46           HA       ALA  46   2.090  -6.902   6.218
  369   1HB   ALA  46          3HB       ALA  46   3.055  -5.243   7.420
  370   2HB   ALA  46          2HB       ALA  46   1.448  -4.827   8.017
  371   3HB   ALA  46          1HB       ALA  46   2.096  -4.019   6.590
  372    H    ILE  47           H        ILE  47   0.733  -8.067   7.625
  373    HA   ILE  47           HA       ILE  47  -2.175  -7.593   7.308
  374    HB   ILE  47           HB       ILE  47  -0.569  -9.829   8.581
  375   1HG1  ILE  47          1HG1      ILE  47  -0.130  -9.599   6.166
  376   2HG1  ILE  47          2HG1      ILE  47  -1.076 -11.051   6.485
  377   1HG2  ILE  47          1HG2      ILE  47  -3.472  -9.301   8.247
  378   2HG2  ILE  47          2HG2      ILE  47  -2.935 -10.938   7.867
  379   3HG2  ILE  47          3HG2      ILE  47  -2.635 -10.261   9.467
  380   1HD1  ILE  47          1HD1      ILE  47  -3.011  -9.082   6.135
  381   2HD1  ILE  47          2HD1      ILE  47  -1.787  -8.677   4.932
  382   3HD1  ILE  47          3HD1      ILE  47  -2.527 -10.277   4.932
  383    H    THR  48           H        THR  48   0.125  -8.211   9.950
  384    HA   THR  48           HA       THR  48  -0.045  -7.766  12.273
  385    HB   THR  48           HB       THR  48  -0.434  -5.363  12.639
  386    HG1  THR  48           HG1      THR  48  -1.116  -5.085   9.933
  387   1HG2  THR  48          1HG2      THR  48   1.613  -6.361  11.337
  388   2HG2  THR  48          2HG2      THR  48   0.898  -5.531   9.953
  389   3HG2  THR  48          3HG2      THR  48   1.380  -4.613  11.380
  390    H    GLN  49           H        GLN  49  -2.454  -9.053  11.041
  391    HA   GLN  49           HA       GLN  49  -4.564  -7.968  12.880
  392   1HB   GLN  49          1HB       GLN  49  -4.535  -9.127  10.116
  393   2HB   GLN  49          2HB       GLN  49  -5.976  -9.366  11.106
  394   1HG   GLN  49          1HG       GLN  49  -6.180  -6.951  11.451
  395   2HG   GLN  49          2HG       GLN  49  -4.694  -6.678  10.538
  396   1HE2  GLN  49          2HE2      GLN  49  -7.837  -8.406  10.068
  397   2HE2  GLN  49          1HE2      GLN  49  -8.021  -7.925   8.450
  398    H    GLY  50           H        GLY  50  -6.245  -9.918  13.269
  399   1HA   GLY  50          2HA       GLY  50  -5.257 -12.599  13.390
  400   2HA   GLY  50          1HA       GLY  50  -6.624 -11.982  14.318
  401    H    ASN  51           H        ASN  51  -3.147 -12.495  14.322
  402    HA   ASN  51           HA       ASN  51  -2.720 -11.352  16.978
  403   1HB   ASN  51          1HB       ASN  51  -3.554 -14.160  16.540
  404   2HB   ASN  51          2HB       ASN  51  -2.179 -13.952  17.625
  405   1HD2  ASN  51          2HD2      ASN  51  -5.280 -14.501  17.996
  406   2HD2  ASN  51          1HD2      ASN  51  -5.687 -13.435  19.253
  407    H    LYS  52           H        LYS  52  -0.607 -10.715  16.867
  408    HA   LYS  52           HA       LYS  52   1.676 -10.668  16.246
  409   1HB   LYS  52          1HB       LYS  52   0.947 -13.170  17.330
  410   2HB   LYS  52          2HB       LYS  52   1.971 -13.536  15.941
  411   1HG   LYS  52          1HG       LYS  52   3.822 -12.514  16.855
  412   2HG   LYS  52          2HG       LYS  52   2.861 -11.347  17.762
  413   1HD   LYS  52          1HD       LYS  52   2.562 -14.209  18.524
  414   2HD   LYS  52          2HD       LYS  52   4.084 -13.427  18.950
  415   1HE   LYS  52          1HE       LYS  52   3.087 -12.023  20.480
  416   2HE   LYS  52          2HE       LYS  52   1.591 -11.895  19.534
  417   1HZ   LYS  52          1HZ       LYS  52   1.128 -14.231  20.078
  418   2HZ   LYS  52          2HZ       LYS  52   2.503 -14.267  21.075
  419   3HZ   LYS  52          3HZ       LYS  52   1.193 -13.259  21.466
  420    H    ALA  53           H        ALA  53   3.123 -12.423  14.603
  421    HA   ALA  53           HA       ALA  53   2.071 -11.659  11.945
  422   1HB   ALA  53          1HB       ALA  53   4.510 -11.545  13.024
  423   2HB   ALA  53          2HB       ALA  53   4.605 -13.189  12.391
  424   3HB   ALA  53          3HB       ALA  53   4.293 -11.840  11.298
  425    HA   PRO  54           HA       PRO  54   0.756 -15.696  10.814
  426   1HB   PRO  54          1HB       PRO  54   1.560 -15.891   8.208
  427   2HB   PRO  54          2HB       PRO  54   0.224 -14.846   8.730
  428   1HG   PRO  54          1HG       PRO  54   3.023 -14.139   8.041
  429   2HG   PRO  54          2HG       PRO  54   1.527 -13.238   7.758
  430   1HD   PRO  54          1HD       PRO  54   3.322 -12.692   9.773
  431   2HD   PRO  54          2HD       PRO  54   1.606 -12.231   9.799
  432    H    ALA  55           H        ALA  55   1.559 -17.876  10.022
  433    HA   ALA  55           HA       ALA  55   4.460 -18.286   9.822
  434   1HB   ALA  55          3HB       ALA  55   4.139 -17.939  12.230
  435   2HB   ALA  55          2HB       ALA  55   4.528 -19.631  11.926
  436   3HB   ALA  55          1HB       ALA  55   2.863 -19.155  12.254
  437    H    ARG  56           H        ARG  56   3.840 -19.405   7.868
  438    HA   ARG  56           HA       ARG  56   2.692 -22.118   8.368
  439   1HB   ARG  56          1HB       ARG  56   1.360 -21.775   6.246
  440   2HB   ARG  56          2HB       ARG  56   0.872 -20.733   7.580
  441   1HG   ARG  56          1HG       ARG  56   2.345 -18.931   6.632
  442   2HG   ARG  56          2HG       ARG  56   2.637 -19.967   5.236
  443   1HD   ARG  56          1HD       ARG  56   0.823 -18.755   4.435
  444   2HD   ARG  56          2HD       ARG  56  -0.053 -20.067   5.250
  445    HE   ARG  56           HE       ARG  56  -0.336 -18.587   7.196
  446   1HH1  ARG  56          1HH1      ARG  56   2.067 -16.948   5.768
  447   2HH1  ARG  56          2HH1      ARG  56   1.248 -15.431   5.599
  448   1HH2  ARG  56          1HH2      ARG  56  -1.875 -16.728   6.365
  449   2HH2  ARG  56          2HH2      ARG  56  -0.983 -15.306   5.938
  450    HA   PRO  57           HA       PRO  57   6.481 -22.148   5.702
  451   1HB   PRO  57          1HB       PRO  57   7.930 -23.890   7.232
  452   2HB   PRO  57          2HB       PRO  57   7.939 -22.136   7.496
  453   1HG   PRO  57          1HG       PRO  57   6.536 -24.267   9.001
  454   2HG   PRO  57          2HG       PRO  57   7.223 -22.741   9.573
  455   1HD   PRO  57          1HD       PRO  57   4.531 -23.211   9.119
  456   2HD   PRO  57          2HD       PRO  57   5.288 -21.607   9.211
  457    H    ALA  58           H        ALA  58   6.725 -23.721   4.107
  458    HA   ALA  58           HA       ALA  58   5.588 -26.441   4.629
  459   1HB   ALA  58          1HB       ALA  58   4.768 -24.319   2.747
  460   2HB   ALA  58          3HB       ALA  58   3.837 -25.676   3.381
  461   3HB   ALA  58          2HB       ALA  58   4.928 -25.916   2.016
  462    HA   PRO  59           HA       PRO  59   9.531 -27.405   2.769
  463   1HB   PRO  59          1HB       PRO  59   9.245 -30.126   2.770
  464   2HB   PRO  59          2HB       PRO  59   9.648 -29.198   4.227
  465   1HG   PRO  59          1HG       PRO  59   7.038 -30.332   3.367
  466   2HG   PRO  59          2HG       PRO  59   7.741 -30.218   4.987
  467   1HD   PRO  59          1HD       PRO  59   5.808 -28.529   4.043
  468   2HD   PRO  59          2HD       PRO  59   6.975 -28.091   5.309
  469    H    ASP  60           H        ASP  60   9.112 -26.600   0.633
  470    HA   ASP  60           HA       ASP  60   8.346 -28.693  -1.334
  471   1HB   ASP  60          1HB       ASP  60   7.032 -25.973  -1.027
  472   2HB   ASP  60          2HB       ASP  60   6.759 -27.061  -2.388
  473    H    ALA  61           H        ALA  61  10.815 -28.302  -1.550
  474    HA   ALA  61           HA       ALA  61  12.118 -25.989  -2.358
  475   1HB   ALA  61          1HB       ALA  61  12.319 -28.890  -2.856
  476   2HB   ALA  61          3HB       ALA  61  13.569 -27.749  -2.361
  477   3HB   ALA  61          2HB       ALA  61  13.133 -27.896  -4.063
  478    HA   PRO  62           HA       PRO  62   9.620 -25.364  -6.084
  479   1HB   PRO  62          1HB       PRO  62   9.360 -22.661  -5.801
  480   2HB   PRO  62          2HB       PRO  62   8.341 -23.819  -4.936
  481   1HG   PRO  62          1HG       PRO  62  10.452 -22.090  -3.910
  482   2HG   PRO  62          2HG       PRO  62   9.174 -22.946  -3.039
  483   1HD   PRO  62          1HD       PRO  62  11.948 -23.685  -3.355
  484   2HD   PRO  62          2HD       PRO  62  10.697 -24.467  -2.366
  485    H    GLU  63           H        GLU  63  10.494 -24.974  -8.108
  486    HA   GLU  63           HA       GLU  63  13.268 -24.073  -8.326
  487   1HB   GLU  63          1HB       GLU  63  12.871 -24.594 -10.719
  488   2HB   GLU  63          2HB       GLU  63  12.300 -25.897  -9.678
  489   1HG   GLU  63          1HG       GLU  63  10.108 -24.167  -9.886
  490   2HG   GLU  63          2HG       GLU  63  10.789 -24.209 -11.512
  491    H    ASP  64           H        ASP  64  13.914 -22.259  -9.742
  492    HA   ASP  64           HA       ASP  64  11.958 -20.269 -10.590
  493   1HB   ASP  64          1HB       ASP  64  13.139 -20.250  -7.901
  494   2HB   ASP  64          2HB       ASP  64  13.376 -18.732  -8.766
  495    H    THR  65           H        THR  65  13.075 -20.084 -12.550
  496    HA   THR  65           HA       THR  65  14.801 -19.461 -14.040
  497    HB   THR  65           HB       THR  65  15.805 -17.862 -11.676
  498    HG1  THR  65           HG1      THR  65  14.046 -16.721 -11.726
  499   1HG2  THR  65          1HG2      THR  65  16.819 -17.956 -14.128
  500   2HG2  THR  65          2HG2      THR  65  15.491 -16.847 -14.470
  501   3HG2  THR  65          3HG2      THR  65  16.698 -16.428 -13.255
  502    H    GLY  66           H        GLY  66  15.253 -21.817 -12.240
  503   1HA   GLY  66          2HA       GLY  66  17.010 -23.265 -11.662
  504   2HA   GLY  66          1HA       GLY  66  17.955 -21.825 -11.282
  505    H    ASP  67           H        ASP  67  16.536 -22.415 -14.449
  506    HA   ASP  67           HA       ASP  67  18.762 -23.676 -15.721
  507   1HB   ASP  67          1HB       ASP  67  16.616 -21.795 -16.760
  508   2HB   ASP  67          2HB       ASP  67  17.635 -22.812 -17.779
  509    H    SER  68           H        SER  68  19.731 -22.256 -17.747
  510    HA   SER  68           HA       SER  68  21.093 -19.924 -16.451
  511   1HB   SER  68          1HB       SER  68  22.902 -20.460 -18.035
  512   2HB   SER  68          2HB       SER  68  22.452 -21.895 -17.119
  513    HG   SER  68           HG       SER  68  22.587 -22.369 -19.330
  514    H    ASP  69           H        ASP  69  18.513 -19.514 -17.601
  515    HA   ASP  69           HA       ASP  69  18.739 -18.562 -20.345
  516   1HB   ASP  69          1HB       ASP  69  16.664 -19.408 -19.241
  517   2HB   ASP  69          2HB       ASP  69  16.687 -18.002 -18.176
  518    H    GLU  70           H        GLU  70  18.907 -16.382 -21.029
  519    HA   GLU  70           HA       GLU  70  20.512 -14.597 -19.489
  520   1HB   GLU  70          1HB       GLU  70  18.676 -14.237 -21.875
  521   2HB   GLU  70          2HB       GLU  70  19.773 -12.978 -21.303
  522   1HG   GLU  70          1HG       GLU  70  20.943 -15.683 -21.724
  523   2HG   GLU  70          2HG       GLU  70  20.502 -14.772 -23.169
  524    H    TRP  71           H        TRP  71  19.408 -12.116 -19.499
  525    HA   TRP  71           HA       TRP  71  17.322 -12.313 -17.397
  526   1HB   TRP  71          1HB       TRP  71  19.433 -10.971 -17.178
  527   2HB   TRP  71          2HB       TRP  71  18.860  -9.940 -18.489
  528    HD1  TRP  71           HD1      TRP  71  17.289  -8.041 -17.876
  529    HE1  TRP  71           HE1      TRP  71  16.035  -7.321 -15.739
  530    HE3  TRP  71           HE3      TRP  71  18.219 -12.088 -14.921
  531    HZ2  TRP  71           HZ2      TRP  71  15.500  -8.342 -13.125
  532    HZ3  TRP  71           HZ3      TRP  71  17.325 -12.196 -12.615
  533    HH2  TRP  71           HH2      TRP  71  15.966 -10.328 -11.709
  534    H    VAL  72           H        VAL  72  15.270 -11.337 -17.624
  535    HA   VAL  72           HA       VAL  72  14.261 -11.040 -20.352
  536    HB   VAL  72           HB       VAL  72  13.012 -10.548 -17.627
  537   1HG1  VAL  72          1HG1      VAL  72  11.948 -10.629 -20.432
  538   2HG1  VAL  72          2HG1      VAL  72  10.930 -11.203 -19.112
  539   3HG1  VAL  72          3HG1      VAL  72  11.524  -9.542 -19.110
  540   1HG2  VAL  72          1HG2      VAL  72  13.511 -12.983 -19.285
  541   2HG2  VAL  72          2HG2      VAL  72  13.479 -12.808 -17.530
  542   3HG2  VAL  72          3HG2      VAL  72  11.968 -12.881 -18.437
  543    H    PHE  73           H        PHE  73  13.107  -9.051 -21.056
  544    HA   PHE  73           HA       PHE  73  14.571  -6.605 -20.199
  545   1HB   PHE  73          1HB       PHE  73  14.068  -7.647 -22.628
  546   2HB   PHE  73          2HB       PHE  73  12.618  -6.657 -22.454
  547    HD1  PHE  73           HD1      PHE  73  12.725  -4.432 -23.130
  548    HD2  PHE  73           HD2      PHE  73  16.323  -6.419 -21.881
  549    HE1  PHE  73           HE1      PHE  73  14.039  -2.404 -23.688
  550    HE2  PHE  73           HE2      PHE  73  17.636  -4.391 -22.440
  551    HZ   PHE  73           HZ       PHE  73  16.495  -2.384 -23.344
  552    H    ASP  74           H        ASP  74  11.202  -7.298 -21.221
  553    HA   ASP  74           HA       ASP  74   9.158  -6.401 -20.446
  554   1HB   ASP  74          1HB       ASP  74  10.886  -7.104 -18.164
  555   2HB   ASP  74          2HB       ASP  74   9.608  -5.958 -17.759
  556    H    LYS  75           H        LYS  75   8.313  -4.434 -18.967
  557    HA   LYS  75           HA       LYS  75  10.087  -2.075 -19.520
  558   1HB   LYS  75          1HB       LYS  75   7.727  -2.761 -20.760
  559   2HB   LYS  75          2HB       LYS  75   7.165  -1.668 -19.495
  560   1HG   LYS  75          1HG       LYS  75   9.090  -0.114 -20.272
  561   2HG   LYS  75          2HG       LYS  75   9.115  -1.112 -21.727
  562   1HD   LYS  75          1HD       LYS  75   7.603   0.560 -22.333
  563   2HD   LYS  75          2HD       LYS  75   6.521  -0.693 -21.723
  564   1HE   LYS  75          1HE       LYS  75   6.795   0.496 -19.419
  565   2HE   LYS  75          2HE       LYS  75   7.368   1.873 -20.381
  566   1HZ   LYS  75          1HZ       LYS  75   5.382   1.682 -21.758
  567   2HZ   LYS  75          2HZ       LYS  75   4.821   0.397 -20.799
  568   3HZ   LYS  75          3HZ       LYS  75   4.966   1.955 -20.136
  569    H    LYS  76           H        LYS  76   8.553  -3.866 -17.107
  570    HA   LYS  76           HA       LYS  76   8.028  -3.410 -14.850
  571   1HB   LYS  76          1HB       LYS  76  10.363  -1.888 -15.713
  572   2HB   LYS  76          2HB       LYS  76   9.535  -1.095 -14.374
  573   1HG   LYS  76          1HG       LYS  76  10.268  -4.034 -14.370
  574   2HG   LYS  76          2HG       LYS  76  11.290  -2.777 -13.673
  575   1HD   LYS  76          1HD       LYS  76  10.063  -2.804 -11.788
  576   2HD   LYS  76          2HD       LYS  76   8.620  -2.386 -12.712
  577   1HE   LYS  76          1HE       LYS  76   8.080  -4.691 -13.097
  578   2HE   LYS  76          2HE       LYS  76   9.668  -5.227 -12.512
  579   1HZ   LYS  76          1HZ       LYS  76   7.687  -3.720 -10.886
  580   2HZ   LYS  76          2HZ       LYS  76   7.924  -5.400 -10.796
  581   3HZ   LYS  76          3HZ       LYS  76   9.174  -4.344 -10.347
  582    H    LEU  77           H        LEU  77   5.889  -2.640 -16.124
  583    HA   LEU  77           HA       LEU  77   4.972  -0.231 -14.769
  584   1HB   LEU  77          1HB       LEU  77   6.401   0.215 -17.042
  585   2HB   LEU  77          2HB       LEU  77   4.781   0.053 -17.718
  586    HG   LEU  77           HG       LEU  77   4.930   1.711 -15.279
  587   1HD1  LEU  77          1HD1      LEU  77   6.552   2.299 -17.717
  588   2HD1  LEU  77          2HD1      LEU  77   5.677   3.640 -16.974
  589   3HD1  LEU  77          3HD1      LEU  77   6.859   2.728 -16.034
  590   1HD2  LEU  77          1HD2      LEU  77   3.662   1.895 -18.022
  591   2HD2  LEU  77          2HD2      LEU  77   2.862   1.606 -16.478
  592   3HD2  LEU  77          3HD2      LEU  77   3.541   3.194 -16.835
  593    H    LEU  78           H        LEU  78   3.525  -2.130 -14.179
  594    HA   LEU  78           HA       LEU  78   1.075  -2.051 -15.759
  595   1HB   LEU  78          1HB       LEU  78   1.146  -4.468 -16.354
  596   2HB   LEU  78          2HB       LEU  78   2.467  -3.572 -17.104
  597    HG   LEU  78           HG       LEU  78   3.601  -4.296 -14.716
  598   1HD1  LEU  78          1HD1      LEU  78   1.428  -5.689 -14.398
  599   2HD1  LEU  78          2HD1      LEU  78   2.122  -6.763 -15.613
  600   3HD1  LEU  78          3HD1      LEU  78   2.976  -6.479 -14.096
  601   1HD2  LEU  78          1HD2      LEU  78   4.180  -4.630 -17.313
  602   2HD2  LEU  78          2HD2      LEU  78   5.034  -5.519 -16.051
  603   3HD2  LEU  78          3HD2      LEU  78   3.718  -6.290 -16.937
  604    H    CYS  79           H        CYS  79  -0.439  -3.941 -14.813
  605    HA   CYS  79           HA       CYS  79   0.087  -4.200 -11.874
  606   1HB   CYS  79          1HB       CYS  79  -2.327  -3.652 -11.560
  607   2HB   CYS  79          2HB       CYS  79  -1.443  -2.332 -12.326
  608    HG   CYS  79           HG       CYS  79  -3.451  -2.601 -13.870
  609    H    GLU  80           H        GLU  80  -0.402  -6.228 -11.055
  610    HA   GLU  80           HA       GLU  80  -1.573  -8.214 -12.968
  611   1HB   GLU  80          1HB       GLU  80   0.829  -8.212 -11.742
  612   2HB   GLU  80          2HB       GLU  80  -0.120  -9.019 -10.495
  613   1HG   GLU  80          1HG       GLU  80  -0.323 -10.913 -11.719
  614   2HG   GLU  80          2HG       GLU  80  -0.693 -10.017 -13.194
  615    H    THR  81           H        THR  81  -3.323  -6.510 -11.455
  616    HA   THR  81           HA       THR  81  -4.589  -8.546  -9.656
  617    HB   THR  81           HB       THR  81  -5.220  -6.403  -8.298
  618    HG1  THR  81           HG1      THR  81  -3.481  -4.838  -8.546
  619   1HG2  THR  81          1HG2      THR  81  -2.723  -7.981  -8.385
  620   2HG2  THR  81          2HG2      THR  81  -2.620  -6.469  -7.483
  621   3HG2  THR  81          3HG2      THR  81  -3.821  -7.682  -7.038
  622    H    GLU  82           H        GLU  82  -5.439  -8.340 -12.251
  623    HA   GLU  82           HA       GLU  82  -7.329  -7.868 -13.594
  624   1HB   GLU  82          1HB       GLU  82  -8.512  -7.437 -10.828
  625   2HB   GLU  82          2HB       GLU  82  -9.417  -7.819 -12.293
  626   1HG   GLU  82          1HG       GLU  82  -7.748  -9.873 -12.398
  627   2HG   GLU  82          2HG       GLU  82  -7.622  -9.576 -10.665
  628    H    GLY  83           H        GLY  83  -5.528  -5.601 -12.672
  629   1HA   GLY  83          2HA       GLY  83  -7.027  -3.430 -13.814
  630   2HA   GLY  83          1HA       GLY  83  -5.466  -3.276 -13.004
  631    H    ARG  84           H        ARG  84  -5.889  -3.951 -10.456
  632    HA   ARG  84           HA       ARG  84  -8.298  -2.446  -9.516
  633   1HB   ARG  84          1HB       ARG  84  -6.705  -4.773  -8.641
  634   2HB   ARG  84          2HB       ARG  84  -7.165  -3.681  -7.335
  635   1HG   ARG  84          1HG       ARG  84  -9.477  -3.912  -8.903
  636   2HG   ARG  84          2HG       ARG  84  -8.819  -5.547  -8.837
  637   1HD   ARG  84          1HD       ARG  84  -9.051  -5.691  -6.520
  638   2HD   ARG  84          2HD       ARG  84  -8.967  -3.931  -6.302
  639    HE   ARG  84           HE       ARG  84 -11.280  -3.800  -6.814
  640   1HH1  ARG  84          1HH1      ARG  84 -12.550  -4.657  -8.802
  641   2HH1  ARG  84          2HH1      ARG  84 -12.929  -6.343  -8.673
  642   1HH2  ARG  84          1HH2      ARG  84 -10.637  -6.934  -6.139
  643   2HH2  ARG  84          2HH2      ARG  84 -11.847  -7.632  -7.164
  644    H    VAL  85           H        VAL  85  -4.909  -2.951  -8.431
  645    HA   VAL  85           HA       VAL  85  -4.912  -0.135  -7.428
  646    HB   VAL  85           HB       VAL  85  -4.517  -1.937  -5.798
  647   1HG1  VAL  85          1HG1      VAL  85  -2.965  -3.016  -7.973
  648   2HG1  VAL  85          2HG1      VAL  85  -1.931  -2.847  -6.555
  649   3HG1  VAL  85          3HG1      VAL  85  -3.417  -3.789  -6.455
  650   1HG2  VAL  85          1HG2      VAL  85  -2.802   0.272  -6.300
  651   2HG2  VAL  85          2HG2      VAL  85  -3.075  -0.548  -4.764
  652   3HG2  VAL  85          3HG2      VAL  85  -1.765  -1.071  -5.823
  653    H    ARG  86           H        ARG  86  -3.274   1.290  -8.080
  654    HA   ARG  86           HA       ARG  86  -1.376   0.299 -10.182
  655   1HB   ARG  86          1HB       ARG  86  -3.567   1.796 -10.673
  656   2HB   ARG  86          2HB       ARG  86  -2.432   3.085 -10.272
  657   1HG   ARG  86          1HG       ARG  86  -0.965   2.503 -12.029
  658   2HG   ARG  86          2HG       ARG  86  -1.692   0.907 -12.222
  659   1HD   ARG  86          1HD       ARG  86  -3.436   1.710 -13.494
  660   2HD   ARG  86          2HD       ARG  86  -3.497   3.252 -12.618
  661    HE   ARG  86           HE       ARG  86  -1.001   3.054 -14.018
  662   1HH1  ARG  86          1HH1      ARG  86  -2.777   2.171 -16.217
  663   2HH1  ARG  86          2HH1      ARG  86  -3.296   3.669 -16.915
  664   1HH2  ARG  86          1HH2      ARG  86  -2.358   5.576 -14.176
  665   2HH2  ARG  86          2HH2      ARG  86  -3.059   5.596 -15.759
  666    H    VAL  87           H        VAL  87   0.447   0.284  -8.799
  667    HA   VAL  87           HA       VAL  87   1.079   2.798  -7.316
  668    HB   VAL  87           HB       VAL  87   2.201  -0.022  -7.219
  669   1HG1  VAL  87          1HG1      VAL  87   3.410   2.363  -6.384
  670   2HG1  VAL  87          2HG1      VAL  87   2.703   1.691  -4.915
  671   3HG1  VAL  87          3HG1      VAL  87   3.841   0.734  -5.864
  672   1HG2  VAL  87          1HG2      VAL  87  -0.166   0.342  -6.396
  673   2HG2  VAL  87          2HG2      VAL  87   0.952  -0.245  -5.165
  674   3HG2  VAL  87          3HG2      VAL  87   0.492   1.458  -5.199
  675    H    GLU  88           H        GLU  88   2.864   4.025  -7.898
  676    HA   GLU  88           HA       GLU  88   4.911   2.934  -9.729
  677   1HB   GLU  88          1HB       GLU  88   3.007   3.642 -11.160
  678   2HB   GLU  88          2HB       GLU  88   3.097   5.257 -10.458
  679   1HG   GLU  88          1HG       GLU  88   5.680   4.935 -11.220
  680   2HG   GLU  88          2HG       GLU  88   4.874   3.959 -12.448
  681    H    THR  89           H        THR  89   6.855   3.852  -9.180
  682    HA   THR  89           HA       THR  89   6.826   6.256  -7.412
  683    HB   THR  89           HB       THR  89   7.902   4.070  -6.736
  684    HG1  THR  89           HG1      THR  89   9.665   6.267  -7.069
  685   1HG2  THR  89          1HG2      THR  89   8.834   3.990  -9.283
  686   2HG2  THR  89          2HG2      THR  89  10.241   4.658  -8.457
  687   3HG2  THR  89          3HG2      THR  89   9.577   3.106  -7.950
  688    H    THR  90           H        THR  90   8.354   7.986  -7.859
  689    HA   THR  90           HA       THR  90   8.916   8.303 -10.773
  690    HB   THR  90           HB       THR  90   9.219  10.735  -9.944
  691    HG1  THR  90           HG1      THR  90   8.150  11.061  -7.916
  692   1HG2  THR  90          1HG2      THR  90   7.081   9.442 -10.897
  693   2HG2  THR  90          2HG2      THR  90   6.464   9.807  -9.286
  694   3HG2  THR  90          3HG2      THR  90   6.986  11.115 -10.348
  695    H    LYS  91           H        LYS  91  10.945  10.115 -10.767
  696    HA   LYS  91           HA       LYS  91  13.313   8.619 -10.456
  697   1HB   LYS  91          1HB       LYS  91  14.405  10.837 -10.692
  698   2HB   LYS  91          2HB       LYS  91  13.053  10.660 -11.809
  699   1HG   LYS  91          1HG       LYS  91  11.598  11.862 -10.165
  700   2HG   LYS  91          2HG       LYS  91  13.020  12.132  -9.157
  701   1HD   LYS  91          1HD       LYS  91  13.086  14.087 -10.369
  702   2HD   LYS  91          2HD       LYS  91  13.994  13.058 -11.478
  703   1HE   LYS  91          1HE       LYS  91  12.193  12.835 -12.958
  704   2HE   LYS  91          2HE       LYS  91  10.991  13.194 -11.702
  705   1HZ   LYS  91          1HZ       LYS  91  12.036  15.441 -11.538
  706   2HZ   LYS  91          2HZ       LYS  91  12.930  15.077 -12.933
  707   3HZ   LYS  91          3HZ       LYS  91  11.234  15.150 -13.007
  708    H    ASP  92           H        ASP  92  11.643  10.684  -8.106
  709    HA   ASP  92           HA       ASP  92  13.283   9.504  -5.942
  710   1HB   ASP  92          1HB       ASP  92  14.461  11.533  -6.949
  711   2HB   ASP  92          2HB       ASP  92  13.122  12.503  -6.336
  712    H    ARG  93           H        ARG  93  10.547   9.123  -6.390
  713    HA   ARG  93           HA       ARG  93   9.403  10.100  -3.900
  714   1HB   ARG  93          1HB       ARG  93   9.211  11.689  -6.301
  715   2HB   ARG  93          2HB       ARG  93   7.599  11.143  -5.836
  716   1HG   ARG  93          1HG       ARG  93   7.876  12.050  -3.601
  717   2HG   ARG  93          2HG       ARG  93   9.557  12.463  -3.935
  718   1HD   ARG  93          1HD       ARG  93   8.506  14.521  -4.321
  719   2HD   ARG  93          2HD       ARG  93   8.475  13.823  -5.953
  720    HE   ARG  93           HE       ARG  93   6.177  12.927  -4.482
  721   1HH1  ARG  93          1HH1      ARG  93   6.535  16.007  -4.072
  722   2HH1  ARG  93          2HH1      ARG  93   5.461  16.592  -5.299
  723   1HH2  ARG  93          1HH2      ARG  93   5.217  13.534  -6.916
  724   2HH2  ARG  93          2HH2      ARG  93   4.715  15.192  -6.909
  725    H    SER  94           H        SER  94   8.612   8.047  -3.441
  726    HA   SER  94           HA       SER  94   7.366   6.321  -5.424
  727   1HB   SER  94          1HB       SER  94   6.982   4.904  -3.481
  728   2HB   SER  94          2HB       SER  94   8.588   5.615  -3.348
  729    HG   SER  94           HG       SER  94   7.677   7.192  -1.968
  730    H    ILE  95           H        ILE  95   5.218   6.289  -6.014
  731    HA   ILE  95           HA       ILE  95   3.331   7.936  -4.367
  732    HB   ILE  95           HB       ILE  95   4.149   8.080  -7.118
  733   1HG1  ILE  95          1HG1      ILE  95   2.199   9.928  -6.898
  734   2HG1  ILE  95          2HG1      ILE  95   2.450   9.572  -5.189
  735   1HG2  ILE  95          1HG2      ILE  95   1.215   7.419  -6.708
  736   2HG2  ILE  95          2HG2      ILE  95   1.881   8.123  -8.180
  737   3HG2  ILE  95          3HG2      ILE  95   2.372   6.507  -7.678
  738   1HD1  ILE  95          1HD1      ILE  95   4.897   9.947  -6.838
  739   2HD1  ILE  95          2HD1      ILE  95   3.934  11.389  -6.517
  740   3HD1  ILE  95          3HD1      ILE  95   4.576  10.440  -5.175
  741    H    PHE  96           H        PHE  96   1.636   6.820  -3.551
  742    HA   PHE  96           HA       PHE  96   1.036   4.115  -4.688
  743   1HB   PHE  96          1HB       PHE  96   1.835   4.298  -2.317
  744   2HB   PHE  96          2HB       PHE  96   0.436   5.306  -1.959
  745    HD1  PHE  96           HD1      PHE  96  -1.897   4.338  -2.436
  746    HD2  PHE  96           HD2      PHE  96   1.664   1.952  -2.258
  747    HE1  PHE  96           HE1      PHE  96  -3.280   2.309  -2.099
  748    HE2  PHE  96           HE2      PHE  96   0.282  -0.085  -1.923
  749    HZ   PHE  96           HZ       PHE  96  -2.196   0.099  -1.848
  750    H    THR  97           H        THR  97  -0.489   4.738  -6.274
  751    HA   THR  97           HA       THR  97  -2.946   6.110  -5.232
  752    HB   THR  97           HB       THR  97  -1.911   7.635  -6.714
  753    HG1  THR  97           HG1      THR  97  -3.195   7.433  -8.661
  754   1HG2  THR  97          1HG2      THR  97  -1.298   5.249  -8.479
  755   2HG2  THR  97          2HG2      THR  97  -0.995   6.925  -8.935
  756   3HG2  THR  97          3HG2      THR  97  -0.138   6.215  -7.567
  757    H    VAL  98           H        VAL  98  -4.376   4.452  -4.966
  758    HA   VAL  98           HA       VAL  98  -4.637   2.437  -7.173
  759    HB   VAL  98           HB       VAL  98  -3.875   1.443  -5.111
  760   1HG1  VAL  98          1HG1      VAL  98  -6.067   3.097  -3.852
  761   2HG1  VAL  98          2HG1      VAL  98  -5.318   1.737  -3.015
  762   3HG1  VAL  98          3HG1      VAL  98  -4.342   3.125  -3.495
  763   1HG2  VAL  98          1HG2      VAL  98  -6.283   0.727  -6.324
  764   2HG2  VAL  98          2HG2      VAL  98  -5.350  -0.267  -5.207
  765   3HG2  VAL  98          3HG2      VAL  98  -6.666   0.739  -4.603
  766    H    GLU  99           H        GLU  99  -6.640   2.245  -8.134
  767    HA   GLU  99           HA       GLU  99  -8.798   4.071  -7.182
  768   1HB   GLU  99          1HB       GLU  99  -8.325   2.568  -9.779
  769   2HB   GLU  99          2HB       GLU  99  -9.666   3.677  -9.492
  770   1HG   GLU  99          1HG       GLU  99  -8.340   5.534  -9.639
  771   2HG   GLU  99          2HG       GLU  99  -6.962   4.736  -8.881
  772    H    GLY 100           H        GLY 100  -8.399   1.727  -5.670
  773   1HA   GLY 100          2HA       GLY 100  -9.840  -0.569  -6.375
  774   2HA   GLY 100          1HA       GLY 100 -11.030   0.565  -5.731
  775    H    ALA 101           H        ALA 101  -8.927   1.764  -3.940
  776    HA   ALA 101           HA       ALA 101  -8.011  -0.331  -2.148
  777   1HB   ALA 101          1HB       ALA 101  -7.384   2.275  -2.661
  778   2HB   ALA 101          2HB       ALA 101  -8.324   2.451  -1.184
  779   3HB   ALA 101          3HB       ALA 101  -6.892   1.426  -1.198
  780    H    GLU 102           H        GLU 102 -10.013  -1.454  -1.688
  781    HA   GLU 102           HA       GLU 102 -12.110   0.045  -0.200
  782   1HB   GLU 102          1HB       GLU 102 -12.214  -1.823  -2.174
  783   2HB   GLU 102          2HB       GLU 102 -12.348  -2.861  -0.753
  784   1HG   GLU 102          1HG       GLU 102 -14.377  -1.971  -0.119
  785   2HG   GLU 102          2HG       GLU 102 -14.015  -0.387  -0.805
  786    H    LYS 103           H        LYS 103 -13.118  -1.828   1.482
  787    HA   LYS 103           HA       LYS 103 -11.491  -1.771   3.784
  788   1HB   LYS 103          1HB       LYS 103 -14.026  -2.384   3.264
  789   2HB   LYS 103          2HB       LYS 103 -13.398  -4.032   3.299
  790   1HG   LYS 103          1HG       LYS 103 -12.771  -3.889   5.543
  791   2HG   LYS 103          2HG       LYS 103 -12.683  -2.128   5.508
  792   1HD   LYS 103          1HD       LYS 103 -15.283  -2.385   4.951
  793   2HD   LYS 103          2HD       LYS 103 -15.064  -3.902   5.822
  794   1HE   LYS 103          1HE       LYS 103 -13.716  -2.124   7.445
  795   2HE   LYS 103          2HE       LYS 103 -15.079  -1.148   6.862
  796   1HZ   LYS 103          1HZ       LYS 103 -16.573  -2.967   7.415
  797   2HZ   LYS 103          2HZ       LYS 103 -15.271  -3.888   7.999
  798   3HZ   LYS 103          3HZ       LYS 103 -15.722  -2.460   8.795
  799    H    GLU 104           H        GLU 104 -11.742  -4.268   1.260
  800    HA   GLU 104           HA       GLU 104 -10.199  -6.307   2.512
  801   1HB   GLU 104          1HB       GLU 104  -9.862  -7.049   0.145
  802   2HB   GLU 104          2HB       GLU 104 -11.539  -6.624   0.489
  803   1HG   GLU 104          1HG       GLU 104 -11.508  -4.840  -0.921
  804   2HG   GLU 104          2HG       GLU 104  -9.876  -4.370  -0.445
  805    H    ASP 105           H        ASP 105  -9.250  -3.254   1.139
  806    HA   ASP 105           HA       ASP 105  -6.399  -4.045   0.915
  807   1HB   ASP 105          1HB       ASP 105  -8.066  -2.366  -0.480
  808   2HB   ASP 105          2HB       ASP 105  -7.226  -1.229   0.574
  809    H    GLU 106           H        GLU 106  -8.578  -2.381   3.084
  810    HA   GLU 106           HA       GLU 106  -6.907  -0.662   4.535
  811   1HB   GLU 106          1HB       GLU 106  -9.451  -1.464   4.696
  812   2HB   GLU 106          2HB       GLU 106  -8.796  -2.473   5.984
  813   1HG   GLU 106          1HG       GLU 106  -7.970   0.387   5.973
  814   2HG   GLU 106          2HG       GLU 106  -9.640   0.039   6.425
  815    H    GLY 107           H        GLY 107  -5.931  -1.086   6.737
  816   1HA   GLY 107          2HA       GLY 107  -4.576  -3.752   6.777
  817   2HA   GLY 107          1HA       GLY 107  -5.169  -2.999   8.259
  818    H    VAL 108           H        VAL 108  -2.423  -3.489   6.512
  819    HA   VAL 108           HA       VAL 108  -1.209  -0.841   7.158
  820    HB   VAL 108           HB       VAL 108  -0.322  -3.570   8.147
  821   1HG1  VAL 108          1HG1      VAL 108   1.009  -0.854   8.404
  822   2HG1  VAL 108          2HG1      VAL 108   1.510  -2.307   9.271
  823   3HG1  VAL 108          3HG1      VAL 108   1.636  -2.241   7.513
  824   1HG2  VAL 108          1HG2      VAL 108  -1.612  -1.153   9.362
  825   2HG2  VAL 108          2HG2      VAL 108  -1.939  -2.861   9.656
  826   3HG2  VAL 108          3HG2      VAL 108  -0.504  -2.106  10.349
  827    H    TYR 109           H        TYR 109   0.818  -0.496   6.032
  828    HA   TYR 109           HA       TYR 109   1.461  -2.468   3.872
  829   1HB   TYR 109          1HB       TYR 109   0.789   0.475   3.674
  830   2HB   TYR 109          2HB       TYR 109   1.699  -0.349   2.410
  831    HD1  TYR 109           HD1      TYR 109  -1.497  -0.499   4.343
  832    HD2  TYR 109           HD2      TYR 109   0.605  -1.654   0.779
  833    HE1  TYR 109           HE1      TYR 109  -3.608  -1.378   3.382
  834    HE2  TYR 109           HE2      TYR 109  -1.504  -2.534  -0.180
  835    HH   TYR 109           HH       TYR 109  -3.698  -3.392   0.684
  836    H    THR 110           H        THR 110   3.636  -2.923   4.089
  837    HA   THR 110           HA       THR 110   5.396  -0.865   5.347
  838    HB   THR 110           HB       THR 110   6.108  -3.715   4.633
  839    HG1  THR 110           HG1      THR 110   5.324  -4.213   6.755
  840   1HG2  THR 110          1HG2      THR 110   7.769  -1.940   5.507
  841   2HG2  THR 110          2HG2      THR 110   6.921  -2.099   7.045
  842   3HG2  THR 110          3HG2      THR 110   7.731  -3.496   6.337
  843    H    VAL 111           H        VAL 111   6.255   0.487   3.810
  844    HA   VAL 111           HA       VAL 111   6.798  -0.524   1.095
  845    HB   VAL 111           HB       VAL 111   5.691   1.668   1.704
  846   1HG1  VAL 111          1HG1      VAL 111   7.273   2.207   3.569
  847   2HG1  VAL 111          2HG1      VAL 111   8.521   2.507   2.360
  848   3HG1  VAL 111          3HG1      VAL 111   7.077   3.519   2.407
  849   1HG2  VAL 111          1HG2      VAL 111   8.151   1.542  -0.030
  850   2HG2  VAL 111          2HG2      VAL 111   6.464   1.437  -0.526
  851   3HG2  VAL 111          3HG2      VAL 111   7.125   2.975   0.026
  852    H    THR 112           H        THR 112   8.799  -1.183   0.432
  853    HA   THR 112           HA       THR 112  11.122  -0.633   2.245
  854    HB   THR 112           HB       THR 112  10.361  -2.871   0.358
  855    HG1  THR 112           HG1      THR 112  10.634  -4.052   2.307
  856   1HG2  THR 112          1HG2      THR 112  13.043  -2.077   1.395
  857   2HG2  THR 112          2HG2      THR 112  12.644  -3.796   1.399
  858   3HG2  THR 112          3HG2      THR 112  12.615  -2.888  -0.112
  859    H    VAL 113           H        VAL 113  12.549   0.840   1.437
  860    HA   VAL 113           HA       VAL 113  12.640   1.353  -1.498
  861    HB   VAL 113           HB       VAL 113  13.747   3.418  -0.829
  862   1HG1  VAL 113          1HG1      VAL 113  11.295   3.335  -0.547
  863   2HG1  VAL 113          2HG1      VAL 113  11.509   2.757   1.106
  864   3HG1  VAL 113          3HG1      VAL 113  12.042   4.378   0.662
  865   1HG2  VAL 113          1HG2      VAL 113  13.857   2.139   1.918
  866   2HG2  VAL 113          2HG2      VAL 113  15.228   2.565   0.896
  867   3HG2  VAL 113          3HG2      VAL 113  14.227   3.832   1.600
  868    H    LYS 114           H        LYS 114  14.350   0.535  -2.692
  869    HA   LYS 114           HA       LYS 114  16.846  -0.234  -1.223
  870   1HB   LYS 114          1HB       LYS 114  15.342  -2.171  -1.478
  871   2HB   LYS 114          2HB       LYS 114  15.261  -1.886  -3.216
  872   1HG   LYS 114          1HG       LYS 114  17.997  -2.098  -2.105
  873   2HG   LYS 114          2HG       LYS 114  17.045  -3.582  -2.046
  874   1HD   LYS 114          1HD       LYS 114  16.592  -3.432  -4.440
  875   2HD   LYS 114          2HD       LYS 114  17.438  -1.888  -4.531
  876   1HE   LYS 114          1HE       LYS 114  19.555  -2.911  -4.046
  877   2HE   LYS 114          2HE       LYS 114  18.779  -4.441  -3.587
  878   1HZ   LYS 114          1HZ       LYS 114  18.459  -3.199  -6.262
  879   2HZ   LYS 114          2HZ       LYS 114  19.653  -4.359  -5.924
  880   3HZ   LYS 114          3HZ       LYS 114  18.009  -4.763  -5.787
  881    H    ASN 115           H        ASN 115  18.731  -0.359  -2.583
  882    HA   ASN 115           HA       ASN 115  18.597   0.422  -5.410
  883   1HB   ASN 115          1HB       ASN 115  18.782   2.355  -3.301
  884   2HB   ASN 115          2HB       ASN 115  20.319   2.340  -4.161
  885   1HD2  ASN 115          2HD2      ASN 115  18.575   4.589  -4.349
  886   2HD2  ASN 115          1HD2      ASN 115  17.960   4.670  -5.930
  887    HA   PRO 116           HA       PRO 116  22.539  -1.507  -5.505
  888   1HB   PRO 116          1HB       PRO 116  24.213   0.181  -6.862
  889   2HB   PRO 116          2HB       PRO 116  22.916  -0.742  -7.645
  890   1HG   PRO 116          1HG       PRO 116  22.973   2.117  -6.822
  891   2HG   PRO 116          2HG       PRO 116  22.272   1.370  -8.267
  892   1HD   PRO 116          1HD       PRO 116  20.800   2.143  -6.112
  893   2HD   PRO 116          2HD       PRO 116  20.323   0.820  -7.197
  894    H    VAL 117           H        VAL 117  22.259   1.391  -3.745
  895    HA   VAL 117           HA       VAL 117  25.056   1.211  -2.716
  896    HB   VAL 117           HB       VAL 117  22.906   3.294  -2.238
  897   1HG1  VAL 117          1HG1      VAL 117  25.910   3.308  -1.825
  898   2HG1  VAL 117          2HG1      VAL 117  24.842   4.688  -1.571
  899   3HG1  VAL 117          3HG1      VAL 117  24.693   3.258  -0.550
  900   1HG2  VAL 117          1HG2      VAL 117  25.008   2.985  -4.375
  901   2HG2  VAL 117          2HG2      VAL 117  23.313   3.441  -4.551
  902   3HG2  VAL 117          3HG2      VAL 117  24.470   4.588  -3.877
  903    H    GLY 118           H        GLY 118  21.645   1.012  -1.661
  904   1HA   GLY 118          2HA       GLY 118  22.042   0.888   1.130
  905   2HA   GLY 118          1HA       GLY 118  22.310  -0.745   0.521
  906    H    GLU 119           H        GLU 119  20.083   0.440   2.196
  907    HA   GLU 119           HA       GLU 119  17.692   0.470   0.538
  908   1HB   GLU 119          1HB       GLU 119  16.873  -1.756   1.262
  909   2HB   GLU 119          2HB       GLU 119  18.377  -1.895   0.352
  910   1HG   GLU 119          1HG       GLU 119  19.628  -1.953   2.517
  911   2HG   GLU 119          2HG       GLU 119  18.084  -1.957   3.369
  912    H    ASP 120           H        ASP 120  15.765   0.780   1.841
  913    HA   ASP 120           HA       ASP 120  16.183   1.089   4.782
  914   1HB   ASP 120          1HB       ASP 120  16.137   3.173   2.867
  915   2HB   ASP 120          2HB       ASP 120  14.580   3.237   3.692
  916    H    GLN 121           H        GLN 121  13.959   1.468   5.864
  917    HA   GLN 121           HA       GLN 121  11.718   0.285   4.284
  918   1HB   GLN 121          1HB       GLN 121  13.324  -0.981   6.334
  919   2HB   GLN 121          2HB       GLN 121  11.645  -0.876   6.862
  920   1HG   GLN 121          1HG       GLN 121  10.976  -1.827   4.613
  921   2HG   GLN 121          2HG       GLN 121  12.687  -2.130   4.310
  922   1HE2  GLN 121          2HE2      GLN 121  12.493  -4.463   4.388
  923   2HE2  GLN 121          1HE2      GLN 121  12.138  -5.288   5.828
  924    H    VAL 122           H        VAL 122   9.628   0.486   5.489
  925    HA   VAL 122           HA       VAL 122   9.375   2.221   7.791
  926    HB   VAL 122           HB       VAL 122   9.900   4.084   6.505
  927   1HG1  VAL 122          1HG1      VAL 122   9.137   2.315   4.264
  928   2HG1  VAL 122          2HG1      VAL 122   8.837   4.031   3.997
  929   3HG1  VAL 122          3HG1      VAL 122  10.462   3.470   4.389
  930   1HG2  VAL 122          1HG2      VAL 122   7.508   4.275   7.261
  931   2HG2  VAL 122          2HG2      VAL 122   7.869   5.233   5.826
  932   3HG2  VAL 122          3HG2      VAL 122   7.007   3.703   5.669
  933    H    ASN 123           H        ASN 123   7.037   2.609   8.263
  934    HA   ASN 123           HA       ASN 123   5.339   0.511   6.963
  935   1HB   ASN 123          1HB       ASN 123   4.076   0.655   9.127
  936   2HB   ASN 123          2HB       ASN 123   5.760   0.183   9.331
  937   1HD2  ASN 123          2HD2      ASN 123   3.428   2.276  10.546
  938   2HD2  ASN 123          1HD2      ASN 123   4.452   3.443  11.232
  939    H    LEU 124           H        LEU 124   3.384   1.081   6.090
  940    HA   LEU 124           HA       LEU 124   2.654   3.988   6.118
  941   1HB   LEU 124          1HB       LEU 124   3.408   3.174   3.948
  942   2HB   LEU 124          2HB       LEU 124   2.323   1.791   4.050
  943    HG   LEU 124           HG       LEU 124   0.724   4.126   4.419
  944   1HD1  LEU 124          1HD1      LEU 124   2.958   4.929   3.072
  945   2HD1  LEU 124          2HD1      LEU 124   1.939   4.398   1.735
  946   3HD1  LEU 124          3HD1      LEU 124   1.364   5.642   2.844
  947   1HD2  LEU 124          1HD2      LEU 124   1.086   1.974   2.345
  948   2HD2  LEU 124          2HD2      LEU 124  -0.286   2.265   3.414
  949   3HD2  LEU 124          3HD2      LEU 124  -0.016   3.311   2.020
  950    H    THR 125           H        THR 125   0.844   4.314   7.357
  951    HA   THR 125           HA       THR 125  -0.939   2.112   8.083
  952    HB   THR 125           HB       THR 125  -1.357   5.070   8.544
  953    HG1  THR 125           HG1      THR 125   0.409   3.287   9.861
  954   1HG2  THR 125          1HG2      THR 125  -2.872   2.960   9.278
  955   2HG2  THR 125          2HG2      THR 125  -1.744   2.995  10.634
  956   3HG2  THR 125          3HG2      THR 125  -2.721   4.416  10.263
  957    H    VAL 126           H        VAL 126  -3.102   1.855   7.396
  958    HA   VAL 126           HA       VAL 126  -4.023   3.667   5.199
  959    HB   VAL 126           HB       VAL 126  -3.062   1.607   4.273
  960   1HG1  VAL 126          1HG1      VAL 126  -4.624   0.409   6.487
  961   2HG1  VAL 126          2HG1      VAL 126  -4.651  -0.488   4.970
  962   3HG1  VAL 126          3HG1      VAL 126  -3.113  -0.129   5.753
  963   1HG2  VAL 126          1HG2      VAL 126  -5.427   2.635   3.566
  964   2HG2  VAL 126          2HG2      VAL 126  -4.799   1.172   2.810
  965   3HG2  VAL 126          3HG2      VAL 126  -5.995   1.054   4.100
  966    H    LYS 127           H        LYS 127  -6.396   3.683   4.952
  967    HA   LYS 127           HA       LYS 127  -8.069   2.333   6.948
  968   1HB   LYS 127          1HB       LYS 127  -6.971   5.042   7.302
  969   2HB   LYS 127          2HB       LYS 127  -8.721   4.961   7.502
  970   1HG   LYS 127          1HG       LYS 127  -8.230   2.888   8.995
  971   2HG   LYS 127          2HG       LYS 127  -6.583   3.514   9.054
  972   1HD   LYS 127          1HD       LYS 127  -8.027   5.784   9.557
  973   2HD   LYS 127          2HD       LYS 127  -9.037   4.557  10.322
  974   1HE   LYS 127          1HE       LYS 127  -6.086   4.423  10.820
  975   2HE   LYS 127          2HE       LYS 127  -7.020   5.676  11.662
  976   1HZ   LYS 127          1HZ       LYS 127  -8.618   3.950  12.316
  977   2HZ   LYS 127          2HZ       LYS 127  -7.637   2.768  11.597
  978   3HZ   LYS 127          3HZ       LYS 127  -7.068   3.641  12.939
  979    H    VAL 128           H        VAL 128  -9.638   1.728   5.461
  980    HA   VAL 128           HA       VAL 128 -10.476   3.518   3.285
  981    HB   VAL 128           HB       VAL 128 -11.464   0.825   4.294
  982   1HG1  VAL 128          1HG1      VAL 128 -12.953   2.457   2.778
  983   2HG1  VAL 128          2HG1      VAL 128 -11.935   1.782   1.508
  984   3HG1  VAL 128          3HG1      VAL 128 -12.919   0.716   2.508
  985   1HG2  VAL 128          1HG2      VAL 128  -9.069   1.448   3.045
  986   2HG2  VAL 128          2HG2      VAL 128  -9.841  -0.138   3.033
  987   3HG2  VAL 128          3HG2      VAL 128 -10.103   0.980   1.694
  988    H    ILE 129           H        ILE 129 -11.962   5.100   3.630
  989    HA   ILE 129           HA       ILE 129 -13.738   5.010   5.992
  990    HB   ILE 129           HB       ILE 129 -13.143   7.044   3.818
  991   1HG1  ILE 129          1HG1      ILE 129 -11.277   6.603   5.371
  992   2HG1  ILE 129          2HG1      ILE 129 -11.944   8.213   5.638
  993   1HG2  ILE 129          1HG2      ILE 129 -15.024   7.076   6.159
  994   2HG2  ILE 129          2HG2      ILE 129 -14.261   8.573   5.625
  995   3HG2  ILE 129          3HG2      ILE 129 -15.285   7.660   4.515
  996   1HD1  ILE 129          1HD1      ILE 129 -13.385   7.187   7.467
  997   2HD1  ILE 129          2HD1      ILE 129 -12.414   5.724   7.296
  998   3HD1  ILE 129          3HD1      ILE 129 -11.655   7.231   7.808
  999    H    ASP 130           H        ASP 130 -16.086   5.420   5.660
 1000    HA   ASP 130           HA       ASP 130 -17.082   4.454   2.998
 1001   1HB   ASP 130          1HB       ASP 130 -17.039   2.939   5.194
 1002   2HB   ASP 130          2HB       ASP 130 -18.514   3.837   5.555

  No H/Q in entry =        1002
  Start of MODEL    8
    1    H1   ARG   1          1H        ARG   1  25.843   1.831  -6.723
    2    H2   ARG   1          2H        ARG   1  26.638   1.470  -8.179
    3    H3   ARG   1          3H        ARG   1  27.144   0.744  -6.730
    4    HA   ARG   1           HA       ARG   1  28.005   2.774  -5.885
    5   1HB   ARG   1          1HB       ARG   1  28.609   1.810  -8.632
    6   2HB   ARG   1          2HB       ARG   1  29.330   3.357  -8.182
    7   1HG   ARG   1          1HG       ARG   1  30.960   1.946  -7.360
    8   2HG   ARG   1          2HG       ARG   1  29.906   2.007  -5.948
    9   1HD   ARG   1          1HD       ARG   1  29.808  -0.261  -6.097
   10   2HD   ARG   1          2HD       ARG   1  28.801  -0.021  -7.539
   11    HE   ARG   1           HE       ARG   1  31.360   0.313  -8.511
   12   1HH1  ARG   1          1HH1      ARG   1  32.754  -1.361  -6.753
   13   2HH1  ARG   1          2HH1      ARG   1  32.427  -2.980  -7.275
   14   1HH2  ARG   1          1HH2      ARG   1  29.642  -2.097  -9.142
   15   2HH2  ARG   1          2HH2      ARG   1  30.664  -3.397  -8.626
   16    H    GLN   2           H        GLN   2  26.388   4.400  -5.498
   17    HA   GLN   2           HA       GLN   2  26.404   6.602  -7.431
   18   1HB   GLN   2          1HB       GLN   2  23.772   6.499  -7.388
   19   2HB   GLN   2          2HB       GLN   2  24.663   5.459  -8.494
   20   1HG   GLN   2          1HG       GLN   2  24.155   3.554  -7.342
   21   2HG   GLN   2          2HG       GLN   2  24.175   4.367  -5.781
   22   1HE2  GLN   2          2HE2      GLN   2  22.178   5.149  -4.947
   23   2HE2  GLN   2          1HE2      GLN   2  20.702   5.006  -5.772
   24    H    GLU   3           H        GLU   3  23.583   6.423  -5.436
   25    HA   GLU   3           HA       GLU   3  24.936   8.104  -3.355
   26   1HB   GLU   3          1HB       GLU   3  22.266   8.398  -4.761
   27   2HB   GLU   3          2HB       GLU   3  22.721   9.344  -3.344
   28   1HG   GLU   3          1HG       GLU   3  24.907   9.799  -4.809
   29   2HG   GLU   3          2HG       GLU   3  23.787   9.474  -6.131
   30    HA   PRO   4           HA       PRO   4  23.180   5.300  -0.447
   31   1HB   PRO   4          1HB       PRO   4  22.901   6.962   1.715
   32   2HB   PRO   4          2HB       PRO   4  24.468   6.324   1.175
   33   1HG   PRO   4          1HG       PRO   4  23.235   8.992   0.661
   34   2HG   PRO   4          2HG       PRO   4  24.910   8.586   1.072
   35   1HD   PRO   4          1HD       PRO   4  24.147   9.147  -1.454
   36   2HD   PRO   4          2HD       PRO   4  25.438   7.978  -1.089
   37    HA   PRO   5           HA       PRO   5  18.847   6.261  -1.130
   38   1HB   PRO   5          1HB       PRO   5  17.897   3.846  -0.257
   39   2HB   PRO   5          2HB       PRO   5  18.619   4.071  -1.862
   40   1HG   PRO   5          1HG       PRO   5  19.840   2.985   0.631
   41   2HG   PRO   5          2HG       PRO   5  19.980   2.396  -1.032
   42   1HD   PRO   5          1HD       PRO   5  21.915   3.854   0.148
   43   2HD   PRO   5          2HD       PRO   5  21.569   3.961  -1.593
   44    H    LYS   6           H        LYS   6  17.057   6.732   0.302
   45    HA   LYS   6           HA       LYS   6  17.080   5.995   3.102
   46   1HB   LYS   6          1HB       LYS   6  17.520   8.375   3.892
   47   2HB   LYS   6          2HB       LYS   6  18.919   7.533   3.231
   48   1HG   LYS   6          1HG       LYS   6  18.509   8.629   1.035
   49   2HG   LYS   6          2HG       LYS   6  17.171   9.523   1.757
   50   1HD   LYS   6          1HD       LYS   6  18.579  11.039   2.650
   51   2HD   LYS   6          2HD       LYS   6  19.550   9.770   3.394
   52   1HE   LYS   6          1HE       LYS   6  21.182  10.130   1.870
   53   2HE   LYS   6          2HE       LYS   6  20.048   9.751   0.559
   54   1HZ   LYS   6          1HZ       LYS   6  19.134  12.029   0.847
   55   2HZ   LYS   6          2HZ       LYS   6  20.414  12.369   1.911
   56   3HZ   LYS   6          3HZ       LYS   6  20.738  12.005   0.287
   57    H    ILE   7           H        ILE   7  15.187   6.721   4.192
   58    HA   ILE   7           HA       ILE   7  12.929   7.300   2.455
   59    HB   ILE   7           HB       ILE   7  13.142   7.178   5.477
   60   1HG1  ILE   7          1HG1      ILE   7  14.078   5.138   4.630
   61   2HG1  ILE   7          2HG1      ILE   7  12.413   4.762   5.070
   62   1HG2  ILE   7          1HG2      ILE   7  11.005   8.077   4.401
   63   2HG2  ILE   7          2HG2      ILE   7  10.796   6.471   3.702
   64   3HG2  ILE   7          3HG2      ILE   7  10.805   6.677   5.453
   65   1HD1  ILE   7          1HD1      ILE   7  11.747   5.141   2.685
   66   2HD1  ILE   7          2HD1      ILE   7  13.449   5.367   2.283
   67   3HD1  ILE   7          3HD1      ILE   7  12.882   3.807   2.878
   68    H    HIS   8           H        HIS   8  15.220   9.361   3.722
   69    HA   HIS   8           HA       HIS   8  13.234  11.602   3.853
   70   1HB   HIS   8          1HB       HIS   8  14.565  12.568   5.639
   71   2HB   HIS   8          2HB       HIS   8  14.210  10.895   6.056
   72    HD1  HIS   8           HD1      HIS   8  16.603  12.018   7.431
   73    HD2  HIS   8           HD2      HIS   8  16.879  10.299   3.648
   74    HE1  HIS   8           HE1      HIS   8  19.024  11.338   7.129
   75    H    LEU   9           H        LEU   9  14.284  13.763   3.375
   76    HA   LEU   9           HA       LEU   9  16.693  13.632   1.654
   77   1HB   LEU   9          1HB       LEU   9  15.120  15.086   0.000
   78   2HB   LEU   9          2HB       LEU   9  15.289  13.349  -0.139
   79    HG   LEU   9           HG       LEU   9  12.918  14.249  -0.233
   80   1HD1  LEU   9          1HD1      LEU   9  13.908  11.903   0.785
   81   2HD1  LEU   9          2HD1      LEU   9  12.855  12.454   2.090
   82   3HD1  LEU   9          3HD1      LEU   9  12.205  12.229   0.467
   83   1HD2  LEU   9          1HD2      LEU   9  13.715  15.279   2.396
   84   2HD2  LEU   9          2HD2      LEU   9  12.379  15.757   1.358
   85   3HD2  LEU   9          3HD2      LEU   9  12.208  14.376   2.437
   86    H    ASP  10           H        ASP  10  16.149  16.327   0.552
   87    HA   ASP  10           HA       ASP  10  17.332  17.982   2.506
   88   1HB   ASP  10          1HB       ASP  10  17.152  18.434   0.065
   89   2HB   ASP  10          2HB       ASP  10  15.419  18.704   0.255
   90    H    CYS  11           H        CYS  11  13.977  17.148   1.915
   91    HA   CYS  11           HA       CYS  11  13.140  18.854   4.217
   92   1HB   CYS  11          1HB       CYS  11  12.211  19.056   1.769
   93   2HB   CYS  11          2HB       CYS  11  11.303  17.602   2.181
   94    HG   CYS  11           HG       CYS  11   9.782  18.966   3.580
   95    HA   PRO  12           HA       PRO  12  13.015  14.391   5.489
   96   1HB   PRO  12          1HB       PRO  12  13.981  14.830   8.016
   97   2HB   PRO  12          2HB       PRO  12  15.026  14.558   6.606
   98   1HG   PRO  12          1HG       PRO  12  14.262  17.120   7.926
   99   2HG   PRO  12          2HG       PRO  12  15.831  16.607   7.282
  100   1HD   PRO  12          1HD       PRO  12  14.185  18.288   5.948
  101   2HD   PRO  12          2HD       PRO  12  15.274  17.151   5.122
  102    H    GLY  13           H        GLY  13  12.240  13.817   8.045
  103   1HA   GLY  13          2HA       GLY  13   9.732  15.405   8.424
  104   2HA   GLY  13          1HA       GLY  13  10.596  14.629   9.754
  105    H    ARG  14           H        ARG  14  11.181  12.201   8.236
  106    HA   ARG  14           HA       ARG  14  10.225  10.082   7.885
  107   1HB   ARG  14          1HB       ARG  14   7.900  11.384   9.345
  108   2HB   ARG  14          2HB       ARG  14   8.170   9.652   9.164
  109   1HG   ARG  14          1HG       ARG  14  10.197  11.479  10.469
  110   2HG   ARG  14          2HG       ARG  14   8.927  10.665  11.382
  111   1HD   ARG  14          1HD       ARG  14   9.929   8.578   9.911
  112   2HD   ARG  14          2HD       ARG  14  11.392   9.542  10.204
  113    HE   ARG  14           HE       ARG  14  10.814   9.481  12.636
  114   1HH1  ARG  14          1HH1      ARG  14   8.624   8.649  13.673
  115   2HH1  ARG  14          2HH1      ARG  14   8.458   6.934  13.502
  116   1HH2  ARG  14          1HH2      ARG  14  10.874   6.680  11.028
  117   2HH2  ARG  14          2HH2      ARG  14   9.731   5.819  12.004
  118    H    ILE  15           H        ILE  15   8.984   9.080   6.276
  119    HA   ILE  15           HA       ILE  15   7.813  10.833   4.245
  120    HB   ILE  15           HB       ILE  15   8.655   8.015   4.609
  121   1HG1  ILE  15          1HG1      ILE  15   8.600   9.857   2.198
  122   2HG1  ILE  15          2HG1      ILE  15   9.925   9.759   3.356
  123   1HG2  ILE  15          1HG2      ILE  15   6.257   8.747   2.933
  124   2HG2  ILE  15          2HG2      ILE  15   7.325   7.431   2.441
  125   3HG2  ILE  15          3HG2      ILE  15   6.483   7.352   3.988
  126   1HD1  ILE  15          1HD1      ILE  15   9.253   7.102   2.472
  127   2HD1  ILE  15          2HD1      ILE  15   9.508   8.133   1.066
  128   3HD1  ILE  15          3HD1      ILE  15  10.773   7.973   2.282
  129    HA   PRO  16           HA       PRO  16   3.714  10.547   5.906
  130   1HB   PRO  16          1HB       PRO  16   2.326  11.424   3.718
  131   2HB   PRO  16          2HB       PRO  16   3.254  12.509   4.772
  132   1HG   PRO  16          1HG       PRO  16   3.960  11.397   2.109
  133   2HG   PRO  16          2HG       PRO  16   4.302  12.991   2.797
  134   1HD   PRO  16          1HD       PRO  16   6.135  10.957   2.638
  135   2HD   PRO  16          2HD       PRO  16   6.209  12.279   3.824
  136    H    ASP  17           H        ASP  17   4.544   8.041   5.359
  137    HA   ASP  17           HA       ASP  17   3.138   6.731   3.183
  138   1HB   ASP  17          1HB       ASP  17   3.858   4.679   4.537
  139   2HB   ASP  17          2HB       ASP  17   5.157   5.766   4.048
  140    H    THR  18           H        THR  18   0.952   7.682   3.700
  141    HA   THR  18           HA       THR  18  -0.515   5.881   5.576
  142    HB   THR  18           HB       THR  18  -1.242   8.784   5.442
  143    HG1  THR  18           HG1      THR  18   0.890   7.704   6.971
  144   1HG2  THR  18          1HG2      THR  18  -2.334   6.743   6.750
  145   2HG2  THR  18          2HG2      THR  18  -1.075   7.130   7.922
  146   3HG2  THR  18          3HG2      THR  18  -2.262   8.352   7.468
  147    H    ILE  19           H        ILE  19  -1.985   4.875   4.245
  148    HA   ILE  19           HA       ILE  19  -3.064   6.424   1.943
  149    HB   ILE  19           HB       ILE  19  -2.420   3.580   2.580
  150   1HG1  ILE  19          1HG1      ILE  19  -0.910   4.908   1.203
  151   2HG1  ILE  19          2HG1      ILE  19  -1.658   3.663   0.202
  152   1HG2  ILE  19          1HG2      ILE  19  -4.804   4.460   1.022
  153   2HG2  ILE  19          2HG2      ILE  19  -3.847   3.131   0.371
  154   3HG2  ILE  19          3HG2      ILE  19  -4.562   3.001   1.977
  155   1HD1  ILE  19          1HD1      ILE  19  -3.448   5.492  -0.313
  156   2HD1  ILE  19          2HD1      ILE  19  -2.226   6.620   0.271
  157   3HD1  ILE  19          3HD1      ILE  19  -1.884   5.596  -1.121
  158    H    VAL  20           H        VAL  20  -5.099   7.182   2.132
  159    HA   VAL  20           HA       VAL  20  -7.019   5.703   3.895
  160    HB   VAL  20           HB       VAL  20  -6.670   8.696   3.499
  161   1HG1  VAL  20          1HG1      VAL  20  -8.580   7.047   5.176
  162   2HG1  VAL  20          2HG1      VAL  20  -8.322   8.776   5.412
  163   3HG1  VAL  20          3HG1      VAL  20  -8.994   8.184   3.892
  164   1HG2  VAL  20          1HG2      VAL  20  -4.894   7.582   4.869
  165   2HG2  VAL  20          2HG2      VAL  20  -5.883   8.695   5.813
  166   3HG2  VAL  20          3HG2      VAL  20  -6.152   6.956   5.934
  167    H    VAL  21           H        VAL  21  -9.188   5.674   3.110
  168    HA   VAL  21           HA       VAL  21  -9.771   6.983   0.511
  169    HB   VAL  21           HB       VAL  21  -8.653   4.870  -0.032
  170   1HG1  VAL  21          1HG1      VAL  21  -9.434   3.874   2.262
  171   2HG1  VAL  21          2HG1      VAL  21 -10.858   3.366   1.358
  172   3HG1  VAL  21          3HG1      VAL  21  -9.260   2.797   0.880
  173   1HG2  VAL  21          1HG2      VAL  21 -10.786   5.698  -1.259
  174   2HG2  VAL  21          2HG2      VAL  21 -10.270   4.035  -1.538
  175   3HG2  VAL  21          3HG2      VAL  21 -11.602   4.371  -0.431
  176    H    VAL  22           H        VAL  22 -12.088   6.855  -0.011
  177    HA   VAL  22           HA       VAL  22 -13.755   6.642   2.438
  178    HB   VAL  22           HB       VAL  22 -14.296   7.732  -0.345
  179   1HG1  VAL  22          1HG1      VAL  22 -15.923   7.508   2.153
  180   2HG1  VAL  22          2HG1      VAL  22 -16.087   8.978   1.193
  181   3HG1  VAL  22          3HG1      VAL  22 -16.436   7.409   0.469
  182   1HG2  VAL  22          1HG2      VAL  22 -13.184   8.895   2.179
  183   2HG2  VAL  22          2HG2      VAL  22 -12.756   9.242   0.505
  184   3HG2  VAL  22          3HG2      VAL  22 -14.236   9.909   1.192
  185    H    ALA  23           H        ALA  23 -13.030   4.157   1.686
  186    HA   ALA  23           HA       ALA  23 -13.785   2.059   0.893
  187   1HB   ALA  23          1HB       ALA  23 -16.096   3.619   1.981
  188   2HB   ALA  23          3HB       ALA  23 -15.296   2.197   2.649
  189   3HB   ALA  23          2HB       ALA  23 -16.401   2.027   1.286
  190    H    GLY  24           H        GLY  24 -13.157   2.666  -1.395
  191   1HA   GLY  24          2HA       GLY  24 -15.555   2.497  -3.128
  192   2HA   GLY  24          1HA       GLY  24 -13.904   2.127  -3.620
  193    H    ASN  25           H        ASN  25 -12.517   4.401  -2.960
  194    HA   ASN  25           HA       ASN  25 -13.798   6.424  -4.751
  195   1HB   ASN  25          1HB       ASN  25 -13.045   6.615  -1.890
  196   2HB   ASN  25          2HB       ASN  25 -12.559   7.984  -2.888
  197   1HD2  ASN  25          2HD2      ASN  25 -14.156   9.507  -2.221
  198   2HD2  ASN  25          1HD2      ASN  25 -15.821   9.266  -2.445
  199    H    LYS  26           H        LYS  26 -12.180   7.948  -5.646
  200    HA   LYS  26           HA       LYS  26  -9.770   6.652  -6.530
  201   1HB   LYS  26          1HB       LYS  26 -11.045   9.354  -6.671
  202   2HB   LYS  26          2HB       LYS  26  -9.340   9.233  -7.105
  203   1HG   LYS  26          1HG       LYS  26  -9.838   8.272  -9.082
  204   2HG   LYS  26          2HG       LYS  26 -10.855   7.063  -8.299
  205   1HD   LYS  26          1HD       LYS  26 -12.784   8.305  -8.570
  206   2HD   LYS  26          2HD       LYS  26 -11.923   9.844  -8.534
  207   1HE   LYS  26          1HE       LYS  26 -12.720   9.422 -10.817
  208   2HE   LYS  26          2HE       LYS  26 -10.951   9.278 -10.793
  209   1HZ   LYS  26          1HZ       LYS  26 -12.819   7.001 -10.406
  210   2HZ   LYS  26          2HZ       LYS  26 -12.070   7.371 -11.882
  211   3HZ   LYS  26          3HZ       LYS  26 -11.128   6.919 -10.543
  212    H    LEU  27           H        LEU  27  -7.903   6.398  -5.357
  213    HA   LEU  27           HA       LEU  27  -7.344   8.385  -3.182
  214   1HB   LEU  27          1HB       LEU  27  -7.778   6.453  -2.006
  215   2HB   LEU  27          2HB       LEU  27  -7.347   5.410  -3.357
  216    HG   LEU  27           HG       LEU  27  -4.952   5.870  -2.949
  217   1HD1  LEU  27          1HD1      LEU  27  -6.073   7.987  -1.322
  218   2HD1  LEU  27          2HD1      LEU  27  -4.998   6.982  -0.352
  219   3HD1  LEU  27          3HD1      LEU  27  -4.400   7.744  -1.825
  220   1HD2  LEU  27          1HD2      LEU  27  -6.448   4.117  -1.645
  221   2HD2  LEU  27          2HD2      LEU  27  -4.767   4.374  -1.180
  222   3HD2  LEU  27          3HD2      LEU  27  -6.063   5.141  -0.263
  223    H    ARG  28           H        ARG  28  -5.307   9.289  -3.173
  224    HA   ARG  28           HA       ARG  28  -3.239   8.181  -5.038
  225   1HB   ARG  28          1HB       ARG  28  -4.486  10.094  -6.036
  226   2HB   ARG  28          2HB       ARG  28  -4.042  11.085  -4.645
  227   1HG   ARG  28          1HG       ARG  28  -1.594  10.163  -5.371
  228   2HG   ARG  28          2HG       ARG  28  -2.389  10.207  -6.945
  229   1HD   ARG  28          1HD       ARG  28  -3.017  12.613  -5.444
  230   2HD   ARG  28          2HD       ARG  28  -1.260  12.402  -5.587
  231    HE   ARG  28           HE       ARG  28  -3.089  12.252  -7.956
  232   1HH1  ARG  28          1HH1      ARG  28  -0.223  11.392  -8.255
  233   2HH1  ARG  28          2HH1      ARG  28   0.526  12.841  -8.837
  234   1HH2  ARG  28          1HH2      ARG  28  -2.106  14.893  -7.897
  235   2HH2  ARG  28          2HH2      ARG  28  -0.540  14.824  -8.633
  236    H    LEU  29           H        LEU  29  -1.071   8.473  -4.263
  237    HA   LEU  29           HA       LEU  29  -0.745   9.858  -1.636
  238   1HB   LEU  29          1HB       LEU  29  -1.270   7.564  -1.115
  239   2HB   LEU  29          2HB       LEU  29  -0.142   6.975  -2.328
  240    HG   LEU  29           HG       LEU  29   1.737   7.953  -1.054
  241   1HD1  LEU  29          1HD1      LEU  29  -0.406   9.316   0.278
  242   2HD1  LEU  29          2HD1      LEU  29   0.479   8.367   1.471
  243   3HD1  LEU  29          3HD1      LEU  29   1.330   9.549   0.477
  244   1HD2  LEU  29          1HD2      LEU  29   0.081   5.743  -0.262
  245   2HD2  LEU  29          2HD2      LEU  29   1.827   5.917  -0.100
  246   3HD2  LEU  29          3HD2      LEU  29   0.762   6.489   1.183
  247    H    ASP  30           H        ASP  30   1.159  11.003  -1.606
  248    HA   ASP  30           HA       ASP  30   3.292  10.242  -3.574
  249   1HB   ASP  30          1HB       ASP  30   1.703  12.299  -3.974
  250   2HB   ASP  30          2HB       ASP  30   2.712  13.075  -2.752
  251    H    VAL  31           H        VAL  31   4.853   9.406  -2.198
  252    HA   VAL  31           HA       VAL  31   5.575  11.023   0.220
  253    HB   VAL  31           HB       VAL  31   6.570   8.821   0.982
  254   1HG1  VAL  31          1HG1      VAL  31   3.971   9.715   1.064
  255   2HG1  VAL  31          2HG1      VAL  31   3.778   8.097   0.391
  256   3HG1  VAL  31          3HG1      VAL  31   4.580   8.315   1.946
  257   1HG2  VAL  31          1HG2      VAL  31   6.742   7.950  -1.428
  258   2HG2  VAL  31          2HG2      VAL  31   6.127   6.814  -0.230
  259   3HG2  VAL  31          3HG2      VAL  31   5.012   7.633  -1.322
  260    HA   PRO  32           HA       PRO  32   9.259  11.797  -2.150
  261   1HB   PRO  32          1HB       PRO  32  10.475  13.452  -0.354
  262   2HB   PRO  32          2HB       PRO  32   9.125  13.966  -1.383
  263   1HG   PRO  32          1HG       PRO  32   9.158  13.305   1.492
  264   2HG   PRO  32          2HG       PRO  32   8.112  14.414   0.596
  265   1HD   PRO  32          1HD       PRO  32   7.442  11.836   1.471
  266   2HD   PRO  32          2HD       PRO  32   6.534  12.825   0.308
  267    H    ILE  33           H        ILE  33  11.370  10.988  -2.181
  268    HA   ILE  33           HA       ILE  33  12.564   9.887   0.298
  269    HB   ILE  33           HB       ILE  33  12.732   7.948  -1.879
  270   1HG1  ILE  33          1HG1      ILE  33   9.957   8.495  -0.768
  271   2HG1  ILE  33          2HG1      ILE  33  10.464   8.875  -2.412
  272   1HG2  ILE  33          1HG2      ILE  33  12.188   8.092   1.025
  273   2HG2  ILE  33          2HG2      ILE  33  11.501   6.699   0.191
  274   3HG2  ILE  33          3HG2      ILE  33  13.240   6.997   0.130
  275   1HD1  ILE  33          1HD1      ILE  33  11.191   6.163  -1.867
  276   2HD1  ILE  33          2HD1      ILE  33   9.504   6.384  -1.407
  277   3HD1  ILE  33          3HD1      ILE  33  10.028   6.765  -3.047
  278    H    SER  34           H        SER  34  14.752   8.656  -0.598
  279    HA   SER  34           HA       SER  34  16.115  10.760  -2.229
  280   1HB   SER  34          1HB       SER  34  17.027  10.215  -0.033
  281   2HB   SER  34          2HB       SER  34  17.087   8.506  -0.445
  282    HG   SER  34           HG       SER  34  19.060   9.076  -1.002
  283    H    GLY  35           H        GLY  35  18.229   8.482  -2.679
  284   1HA   GLY  35          2HA       GLY  35  16.809   6.875  -4.718
  285   2HA   GLY  35          1HA       GLY  35  18.462   6.609  -4.163
  286    H    ASP  36           H        ASP  36  19.743   6.871  -5.931
  287    HA   ASP  36           HA       ASP  36  19.139   9.056  -7.867
  288   1HB   ASP  36          1HB       ASP  36  20.860   9.412  -5.785
  289   2HB   ASP  36          2HB       ASP  36  21.962   8.779  -7.008
  290    HA   PRO  37           HA       PRO  37  18.924   9.272  -9.767
  291   1HB   PRO  37          1HB       PRO  37  17.448   8.026 -11.708
  292   2HB   PRO  37          2HB       PRO  37  19.027   8.775 -12.015
  293   1HG   PRO  37          1HG       PRO  37  18.340   5.908 -11.620
  294   2HG   PRO  37          2HG       PRO  37  19.503   6.649 -12.728
  295   1HD   PRO  37          1HD       PRO  37  20.221   5.442 -10.395
  296   2HD   PRO  37          2HD       PRO  37  21.149   6.759 -11.143
  297    H    ALA  38           H        ALA  38  17.440   6.003  -9.977
  298    HA   ALA  38           HA       ALA  38  15.362   6.960  -8.036
  299   1HB   ALA  38          2HB       ALA  38  14.887   4.747  -9.996
  300   2HB   ALA  38          1HB       ALA  38  14.937   6.403 -10.601
  301   3HB   ALA  38          3HB       ALA  38  13.756   5.948  -9.373
  302    HA   PRO  39           HA       PRO  39  16.834   3.488  -5.669
  303   1HB   PRO  39          1HB       PRO  39  15.092   3.746  -3.580
  304   2HB   PRO  39          2HB       PRO  39  16.489   4.819  -3.803
  305   1HG   PRO  39          1HG       PRO  39  13.622   5.322  -4.294
  306   2HG   PRO  39          2HG       PRO  39  14.908   6.446  -3.839
  307   1HD   PRO  39          1HD       PRO  39  13.826   6.114  -6.400
  308   2HD   PRO  39          2HD       PRO  39  15.323   6.978  -5.998
  309    H    THR  40           H        THR  40  15.249   1.836  -4.146
  310    HA   THR  40           HA       THR  40  13.204   0.793  -6.081
  311    HB   THR  40           HB       THR  40  14.598  -1.022  -4.171
  312    HG1  THR  40           HG1      THR  40  15.839   0.080  -6.471
  313   1HG2  THR  40          1HG2      THR  40  12.861  -1.549  -6.049
  314   2HG2  THR  40          2HG2      THR  40  14.243  -1.391  -7.132
  315   3HG2  THR  40          3HG2      THR  40  14.259  -2.608  -5.856
  316    H    VAL  41           H        VAL  41  11.561   1.976  -4.865
  317    HA   VAL  41           HA       VAL  41  11.188   1.313  -2.010
  318    HB   VAL  41           HB       VAL  41  10.865   3.597  -2.875
  319   1HG1  VAL  41          1HG1      VAL  41   9.685   2.287  -5.053
  320   2HG1  VAL  41          2HG1      VAL  41   8.342   3.104  -4.257
  321   3HG1  VAL  41          3HG1      VAL  41   9.745   4.029  -4.792
  322   1HG2  VAL  41          1HG2      VAL  41   9.479   2.750  -0.964
  323   2HG2  VAL  41          2HG2      VAL  41   8.689   4.031  -1.882
  324   3HG2  VAL  41          3HG2      VAL  41   8.206   2.352  -2.118
  325    H    ILE  42           H        ILE  42  10.469  -0.798  -1.806
  326    HA   ILE  42           HA       ILE  42   8.378  -1.849  -3.621
  327    HB   ILE  42           HB       ILE  42  10.149  -2.956  -1.428
  328   1HG1  ILE  42          1HG1      ILE  42  10.754  -4.380  -3.600
  329   2HG1  ILE  42          2HG1      ILE  42  10.124  -2.951  -4.419
  330   1HG2  ILE  42          1HG2      ILE  42   7.835  -4.191  -2.885
  331   2HG2  ILE  42          2HG2      ILE  42   9.214  -5.195  -2.437
  332   3HG2  ILE  42          3HG2      ILE  42   8.298  -4.347  -1.190
  333   1HD1  ILE  42          1HD1      ILE  42  11.857  -2.163  -2.243
  334   2HD1  ILE  42          2HD1      ILE  42  12.699  -3.281  -3.317
  335   3HD1  ILE  42          3HD1      ILE  42  12.000  -1.796  -3.962
  336    H    TRP  43           H        TRP  43   6.311  -1.171  -2.999
  337    HA   TRP  43           HA       TRP  43   5.544  -0.641  -0.248
  338   1HB   TRP  43          1HB       TRP  43   4.048  -1.119  -2.845
  339   2HB   TRP  43          2HB       TRP  43   3.231  -0.690  -1.344
  340    HD1  TRP  43           HD1      TRP  43   4.921   0.797  -4.267
  341    HE1  TRP  43           HE1      TRP  43   5.255   3.330  -3.932
  342    HE3  TRP  43           HE3      TRP  43   3.855   1.184   0.719
  343    HZ2  TRP  43           HZ2      TRP  43   5.095   5.263  -1.835
  344    HZ3  TRP  43           HZ3      TRP  43   3.972   3.364   1.863
  345    HH2  TRP  43           HH2      TRP  43   4.584   5.414   0.594
  346    H    GLN  44           H        GLN  44   5.770  -2.473   1.110
  347    HA   GLN  44           HA       GLN  44   4.898  -5.130   0.179
  348   1HB   GLN  44          1HB       GLN  44   6.873  -4.346   1.767
  349   2HB   GLN  44          2HB       GLN  44   5.626  -4.458   3.009
  350   1HG   GLN  44          1HG       GLN  44   6.216  -6.654   3.094
  351   2HG   GLN  44          2HG       GLN  44   5.230  -6.798   1.639
  352   1HE2  GLN  44          2HE2      GLN  44   6.429  -8.223   0.332
  353   2HE2  GLN  44          1HE2      GLN  44   8.058  -7.992  -0.085
  354    H    LYS  45           H        LYS  45   3.042  -6.202   0.887
  355    HA   LYS  45           HA       LYS  45   1.029  -4.528   2.334
  356   1HB   LYS  45          1HB       LYS  45   0.749  -7.030   0.631
  357   2HB   LYS  45          2HB       LYS  45  -0.579  -6.045   1.243
  358   1HG   LYS  45          1HG       LYS  45   0.544  -4.082   0.004
  359   2HG   LYS  45          2HG       LYS  45   1.486  -5.315  -0.834
  360   1HD   LYS  45          1HD       LYS  45  -1.469  -5.701  -0.693
  361   2HD   LYS  45          2HD       LYS  45  -0.861  -4.460  -1.788
  362   1HE   LYS  45          1HE       LYS  45   0.839  -6.424  -2.465
  363   2HE   LYS  45          2HE       LYS  45  -0.523  -7.424  -1.923
  364   1HZ   LYS  45          1HZ       LYS  45  -1.997  -6.048  -3.295
  365   2HZ   LYS  45          2HZ       LYS  45  -0.653  -5.188  -3.877
  366   3HZ   LYS  45          3HZ       LYS  45  -0.821  -6.836  -4.235
  367    H    ALA  46           H        ALA  46   0.507  -5.122   4.410
  368    HA   ALA  46           HA       ALA  46   1.349  -7.842   5.346
  369   1HB   ALA  46          1HB       ALA  46   2.128  -5.398   6.223
  370   2HB   ALA  46          2HB       ALA  46   0.718  -5.652   7.252
  371   3HB   ALA  46          3HB       ALA  46   2.047  -6.811   7.275
  372    H    ILE  47           H        ILE  47  -0.641  -8.891   4.787
  373    HA   ILE  47           HA       ILE  47  -3.123  -7.860   6.095
  374    HB   ILE  47           HB       ILE  47  -2.631  -9.988   3.982
  375   1HG1  ILE  47          1HG1      ILE  47  -3.845  -7.230   3.665
  376   2HG1  ILE  47          2HG1      ILE  47  -2.138  -7.563   3.377
  377   1HG2  ILE  47          1HG2      ILE  47  -5.052  -9.033   5.434
  378   2HG2  ILE  47          2HG2      ILE  47  -5.222  -9.318   3.701
  379   3HG2  ILE  47          3HG2      ILE  47  -4.698 -10.625   4.762
  380   1HD1  ILE  47          1HD1      ILE  47  -3.197  -9.543   1.898
  381   2HD1  ILE  47          2HD1      ILE  47  -4.521  -8.383   1.791
  382   3HD1  ILE  47          3HD1      ILE  47  -2.907  -7.931   1.242
  383    H    THR  48           H        THR  48  -0.698 -10.307   6.348
  384    HA   THR  48           HA       THR  48  -2.075 -12.487   7.505
  385    HB   THR  48           HB       THR  48   0.274 -12.526   6.845
  386    HG1  THR  48           HG1      THR  48  -0.410 -13.873   8.594
  387   1HG2  THR  48          1HG2      THR  48   0.504 -10.370   8.940
  388   2HG2  THR  48          2HG2      THR  48   1.906 -11.328   8.465
  389   3HG2  THR  48          3HG2      THR  48   1.065 -10.345   7.267
  390    H    GLN  49           H        GLN  49  -1.375  -9.330   8.838
  391    HA   GLN  49           HA       GLN  49  -2.556 -10.225  11.447
  392   1HB   GLN  49          1HB       GLN  49  -0.963  -8.703  12.538
  393   2HB   GLN  49          2HB       GLN  49  -0.093  -9.853  11.523
  394   1HG   GLN  49          1HG       GLN  49  -0.614  -7.790   9.762
  395   2HG   GLN  49          2HG       GLN  49  -0.315  -6.932  11.273
  396   1HE2  GLN  49          2HE2      GLN  49   1.819  -6.177  10.831
  397   2HE2  GLN  49          1HE2      GLN  49   3.134  -7.217  10.565
  398    H    GLY  50           H        GLY  50  -2.904  -7.828  12.674
  399   1HA   GLY  50          2HA       GLY  50  -4.492  -6.192  10.737
  400   2HA   GLY  50          1HA       GLY  50  -3.737  -5.530  12.189
  401    H    ASN  51           H        ASN  51  -5.456  -8.616  12.037
  402    HA   ASN  51           HA       ASN  51  -7.159  -7.845  14.281
  403   1HB   ASN  51          1HB       ASN  51  -7.932  -7.051  11.723
  404   2HB   ASN  51          2HB       ASN  51  -8.866  -8.522  11.999
  405   1HD2  ASN  51          2HD2      ASN  51 -10.472  -8.499  13.702
  406   2HD2  ASN  51          1HD2      ASN  51 -10.924  -7.069  14.494
  407    H    LYS  52           H        LYS  52  -7.354 -10.033  11.439
  408    HA   LYS  52           HA       LYS  52  -8.166 -12.286  13.133
  409   1HB   LYS  52          1HB       LYS  52  -8.387 -13.414  11.003
  410   2HB   LYS  52          2HB       LYS  52  -8.984 -11.768  10.800
  411   1HG   LYS  52          1HG       LYS  52  -6.236 -11.595  10.265
  412   2HG   LYS  52          2HG       LYS  52  -6.750 -13.089   9.483
  413   1HD   LYS  52          1HD       LYS  52  -7.716 -11.913   7.826
  414   2HD   LYS  52          2HD       LYS  52  -8.742 -11.081   8.995
  415   1HE   LYS  52          1HE       LYS  52  -6.934  -9.437   9.414
  416   2HE   LYS  52          2HE       LYS  52  -5.922 -10.259   8.210
  417   1HZ   LYS  52          1HZ       LYS  52  -7.799  -9.982   6.621
  418   2HZ   LYS  52          2HZ       LYS  52  -8.571  -8.993   7.762
  419   3HZ   LYS  52          3HZ       LYS  52  -7.082  -8.517   7.097
  420    H    ALA  53           H        ALA  53  -6.777 -14.348  11.786
  421    HA   ALA  53           HA       ALA  53  -3.939 -13.896  12.657
  422   1HB   ALA  53          1HB       ALA  53  -5.823 -15.387  13.959
  423   2HB   ALA  53          3HB       ALA  53  -4.093 -15.719  14.032
  424   3HB   ALA  53          2HB       ALA  53  -5.114 -16.605  12.899
  425    HA   PRO  54           HA       PRO  54  -2.724 -15.735   8.854
  426   1HB   PRO  54          1HB       PRO  54  -0.670 -17.397   9.560
  427   2HB   PRO  54          2HB       PRO  54  -0.525 -15.628   9.567
  428   1HG   PRO  54          1HG       PRO  54  -0.958 -17.500  11.836
  429   2HG   PRO  54          2HG       PRO  54   0.018 -16.026  11.758
  430   1HD   PRO  54          1HD       PRO  54  -2.455 -16.153  12.917
  431   2HD   PRO  54          2HD       PRO  54  -1.760 -14.670  12.228
  432    H    ALA  55           H        ALA  55  -2.543 -17.863   7.661
  433    HA   ALA  55           HA       ALA  55  -3.513 -19.942   7.086
  434   1HB   ALA  55          2HB       ALA  55  -3.496 -21.343   9.460
  435   2HB   ALA  55          1HB       ALA  55  -2.323 -20.065   9.779
  436   3HB   ALA  55          3HB       ALA  55  -2.097 -21.146   8.403
  437    H    ARG  56           H        ARG  56  -5.684 -19.214   6.675
  438    HA   ARG  56           HA       ARG  56  -7.600 -19.715   8.930
  439   1HB   ARG  56          1HB       ARG  56  -8.974 -17.919   7.797
  440   2HB   ARG  56          2HB       ARG  56  -7.442 -17.350   8.455
  441   1HG   ARG  56          1HG       ARG  56  -6.484 -17.068   6.364
  442   2HG   ARG  56          2HG       ARG  56  -7.499 -18.303   5.618
  443   1HD   ARG  56          1HD       ARG  56  -8.879 -15.876   6.693
  444   2HD   ARG  56          2HD       ARG  56  -7.961 -15.704   5.184
  445    HE   ARG  56           HE       ARG  56  -9.611 -18.102   5.206
  446   1HH1  ARG  56          1HH1      ARG  56  -8.885 -15.811   3.114
  447   2HH1  ARG  56          2HH1      ARG  56 -10.493 -15.322   2.694
  448   1HH2  ARG  56          1HH2      ARG  56 -11.979 -17.000   5.340
  449   2HH2  ARG  56          2HH2      ARG  56 -12.245 -15.996   3.954
  450    HA   PRO  57           HA       PRO  57  -8.587 -22.426   5.305
  451   1HB   PRO  57          1HB       PRO  57  -8.617 -24.788   6.682
  452   2HB   PRO  57          2HB       PRO  57  -7.142 -24.105   5.968
  453   1HG   PRO  57          1HG       PRO  57  -8.041 -24.130   8.791
  454   2HG   PRO  57          2HG       PRO  57  -6.405 -24.215   8.123
  455   1HD   PRO  57          1HD       PRO  57  -7.562 -21.953   9.222
  456   2HD   PRO  57          2HD       PRO  57  -6.169 -21.955   8.120
  457    H    ALA  58           H        ALA  58 -10.724 -22.993   4.842
  458    HA   ALA  58           HA       ALA  58 -12.641 -23.153   7.145
  459   1HB   ALA  58          2HB       ALA  58 -13.088 -21.777   4.478
  460   2HB   ALA  58          1HB       ALA  58 -12.556 -20.933   5.933
  461   3HB   ALA  58          3HB       ALA  58 -14.136 -21.713   5.894
  462    HA   PRO  59           HA       PRO  59 -14.122 -26.757   5.097
  463   1HB   PRO  59          1HB       PRO  59 -16.738 -26.766   5.903
  464   2HB   PRO  59          2HB       PRO  59 -15.393 -27.172   6.988
  465   1HG   PRO  59          1HG       PRO  59 -16.935 -24.641   6.752
  466   2HG   PRO  59          2HG       PRO  59 -16.300 -25.446   8.194
  467   1HD   PRO  59          1HD       PRO  59 -15.117 -23.282   7.017
  468   2HD   PRO  59          2HD       PRO  59 -14.235 -24.491   7.975
  469    H    ASP  60           H        ASP  60 -14.174 -26.412   2.865
  470    HA   ASP  60           HA       ASP  60 -16.739 -25.455   1.712
  471   1HB   ASP  60          1HB       ASP  60 -13.999 -24.267   1.159
  472   2HB   ASP  60          2HB       ASP  60 -15.451 -23.890   0.232
  473    H    ALA  61           H        ALA  61 -16.597 -27.912   1.285
  474    HA   ALA  61           HA       ALA  61 -14.754 -29.301  -0.244
  475   1HB   ALA  61          2HB       ALA  61 -17.649 -29.460  -1.002
  476   2HB   ALA  61          1HB       ALA  61 -17.209 -29.785   0.675
  477   3HB   ALA  61          3HB       ALA  61 -16.522 -30.763  -0.621
  478    HA   PRO  62           HA       PRO  62 -15.078 -26.619  -3.880
  479   1HB   PRO  62          1HB       PRO  62 -12.403 -26.544  -4.417
  480   2HB   PRO  62          2HB       PRO  62 -13.168 -25.509  -3.205
  481   1HG   PRO  62          1HG       PRO  62 -11.382 -27.785  -2.833
  482   2HG   PRO  62          2HG       PRO  62 -11.831 -26.507  -1.696
  483   1HD   PRO  62          1HD       PRO  62 -12.847 -29.203  -1.867
  484   2HD   PRO  62          2HD       PRO  62 -13.203 -27.959  -0.650
  485    H    GLU  63           H        GLU  63 -15.656 -27.601  -5.785
  486    HA   GLU  63           HA       GLU  63 -14.973 -30.322  -6.438
  487   1HB   GLU  63          1HB       GLU  63 -16.126 -29.730  -8.570
  488   2HB   GLU  63          2HB       GLU  63 -17.034 -29.194  -7.157
  489   1HG   GLU  63          1HG       GLU  63 -16.404 -26.934  -7.464
  490   2HG   GLU  63          2HG       GLU  63 -15.076 -27.361  -8.543
  491    H    ASP  64           H        ASP  64 -13.614 -31.063  -8.193
  492    HA   ASP  64           HA       ASP  64 -11.247 -29.330  -8.651
  493   1HB   ASP  64          1HB       ASP  64 -11.474 -31.891  -7.920
  494   2HB   ASP  64          2HB       ASP  64 -11.518 -32.131  -9.667
  495    H    THR  65           H        THR  65 -12.145 -27.879 -10.256
  496    HA   THR  65           HA       THR  65 -12.157 -29.018 -12.984
  497    HB   THR  65           HB       THR  65 -14.422 -27.769 -13.315
  498    HG1  THR  65           HG1      THR  65 -15.313 -27.034 -11.576
  499   1HG2  THR  65          1HG2      THR  65 -13.896 -30.328 -13.105
  500   2HG2  THR  65          2HG2      THR  65 -14.657 -30.168 -11.523
  501   3HG2  THR  65          3HG2      THR  65 -15.567 -29.777 -12.983
  502    H    GLY  66           H        GLY  66 -13.557 -25.979 -11.761
  503   1HA   GLY  66          2HA       GLY  66 -11.290 -24.308 -12.116
  504   2HA   GLY  66          1HA       GLY  66 -12.961 -23.749 -12.179
  505    H    ASP  67           H        ASP  67 -10.523 -23.132 -13.889
  506    HA   ASP  67           HA       ASP  67 -11.876 -23.557 -16.520
  507   1HB   ASP  67          1HB       ASP  67  -9.815 -21.579 -15.494
  508   2HB   ASP  67          2HB       ASP  67 -10.407 -21.608 -17.156
  509    H    SER  68           H        SER  68  -9.715 -23.134 -18.207
  510    HA   SER  68           HA       SER  68  -8.149 -25.636 -17.806
  511   1HB   SER  68          1HB       SER  68  -9.577 -24.726 -19.901
  512   2HB   SER  68          2HB       SER  68  -8.025 -23.994 -20.293
  513    HG   SER  68           HG       SER  68  -7.100 -26.088 -20.090
  514    H    ASP  69           H        ASP  69  -7.466 -23.188 -16.305
  515    HA   ASP  69           HA       ASP  69  -5.089 -22.052 -17.624
  516   1HB   ASP  69          1HB       ASP  69  -6.952 -21.280 -15.685
  517   2HB   ASP  69          2HB       ASP  69  -5.462 -21.522 -14.773
  518    H    GLU  70           H        GLU  70  -3.104 -21.913 -15.933
  519    HA   GLU  70           HA       GLU  70  -2.594 -24.697 -14.932
  520   1HB   GLU  70          1HB       GLU  70  -0.780 -22.714 -16.344
  521   2HB   GLU  70          2HB       GLU  70  -0.240 -24.259 -15.684
  522   1HG   GLU  70          1HG       GLU  70  -2.202 -25.245 -17.127
  523   2HG   GLU  70          2HG       GLU  70  -2.052 -23.732 -18.021
  524    H    TRP  71           H        TRP  71  -0.345 -24.424 -13.536
  525    HA   TRP  71           HA       TRP  71  -1.035 -22.445 -11.411
  526   1HB   TRP  71          1HB       TRP  71  -0.872 -24.916 -10.968
  527   2HB   TRP  71          2HB       TRP  71   0.840 -24.826 -11.385
  528    HD1  TRP  71           HD1      TRP  71   2.450 -24.130  -9.549
  529    HE1  TRP  71           HE1      TRP  71   2.203 -23.214  -7.149
  530    HE3  TRP  71           HE3      TRP  71  -2.579 -23.302  -9.449
  531    HZ2  TRP  71           HZ2      TRP  71   0.135 -22.254  -5.426
  532    HZ3  TRP  71           HZ3      TRP  71  -3.664 -22.384  -7.422
  533    HH2  TRP  71           HH2      TRP  71  -2.316 -21.858  -5.408
  534    H    VAL  72           H        VAL  72   0.468 -20.885 -10.769
  535    HA   VAL  72           HA       VAL  72   2.786 -20.456 -12.576
  536    HB   VAL  72           HB       VAL  72   1.527 -18.778 -10.378
  537   1HG1  VAL  72          1HG1      VAL  72   3.730 -18.292 -12.373
  538   2HG1  VAL  72          2HG1      VAL  72   2.747 -16.950 -11.789
  539   3HG1  VAL  72          3HG1      VAL  72   3.693 -17.911 -10.652
  540   1HG2  VAL  72          1HG2      VAL  72   0.002 -19.221 -12.275
  541   2HG2  VAL  72          2HG2      VAL  72   0.511 -17.531 -12.253
  542   3HG2  VAL  72          3HG2      VAL  72   1.240 -18.659 -13.399
  543    H    PHE  73           H        PHE  73   4.865 -19.721 -11.488
  544    HA   PHE  73           HA       PHE  73   5.683 -21.660  -9.469
  545   1HB   PHE  73          1HB       PHE  73   6.848 -20.131 -11.485
  546   2HB   PHE  73          2HB       PHE  73   7.471 -19.399 -10.006
  547    HD1  PHE  73           HD1      PHE  73   8.287 -21.720 -12.384
  548    HD2  PHE  73           HD2      PHE  73   7.914 -21.414  -8.115
  549    HE1  PHE  73           HE1      PHE  73   9.863 -23.615 -12.109
  550    HE2  PHE  73           HE2      PHE  73   9.490 -23.308  -7.841
  551    HZ   PHE  73           HZ       PHE  73  10.465 -24.409  -9.838
  552    H    ASP  74           H        ASP  74   5.441 -18.083  -9.530
  553    HA   ASP  74           HA       ASP  74   5.098 -18.152  -6.554
  554   1HB   ASP  74          1HB       ASP  74   6.542 -16.083  -6.538
  555   2HB   ASP  74          2HB       ASP  74   7.394 -17.534  -7.062
  556    H    LYS  75           H        LYS  75   2.793 -18.039  -7.769
  557    HA   LYS  75           HA       LYS  75   1.890 -15.250  -7.478
  558   1HB   LYS  75          1HB       LYS  75   2.790 -16.078  -9.936
  559   2HB   LYS  75          2HB       LYS  75   1.068 -16.449 -10.053
  560   1HG   LYS  75          1HG       LYS  75   1.118 -14.228 -10.769
  561   2HG   LYS  75          2HG       LYS  75   0.765 -14.040  -9.050
  562   1HD   LYS  75          1HD       LYS  75   2.774 -13.073  -8.619
  563   2HD   LYS  75          2HD       LYS  75   3.641 -14.195  -9.665
  564   1HE   LYS  75          1HE       LYS  75   3.890 -12.201 -10.863
  565   2HE   LYS  75          2HE       LYS  75   2.394 -12.825 -11.587
  566   1HZ   LYS  75          1HZ       LYS  75   1.135 -11.612  -9.896
  567   2HZ   LYS  75          2HZ       LYS  75   2.577 -10.964  -9.276
  568   3HZ   LYS  75          3HZ       LYS  75   2.065 -10.557 -10.844
  569    H    LYS  76           H        LYS  76   0.598 -16.263  -5.783
  570    HA   LYS  76           HA       LYS  76  -1.745 -17.794  -6.859
  571   1HB   LYS  76          1HB       LYS  76  -1.631 -19.114  -4.737
  572   2HB   LYS  76          2HB       LYS  76  -0.185 -19.305  -5.726
  573   1HG   LYS  76          1HG       LYS  76   1.117 -17.955  -4.317
  574   2HG   LYS  76          2HG       LYS  76  -0.293 -17.170  -3.607
  575   1HD   LYS  76          1HD       LYS  76  -0.422 -20.026  -3.159
  576   2HD   LYS  76          2HD       LYS  76   1.118 -19.393  -2.581
  577   1HE   LYS  76          1HE       LYS  76  -0.862 -17.519  -1.774
  578   2HE   LYS  76          2HE       LYS  76  -1.479 -19.131  -1.362
  579   1HZ   LYS  76          1HZ       LYS  76   0.663 -19.661  -0.372
  580   2HZ   LYS  76          2HZ       LYS  76   1.246 -18.114  -0.748
  581   3HZ   LYS  76          3HZ       LYS  76  -0.014 -18.295   0.378
  582    H    LEU  77           H        LEU  77  -1.408 -14.900  -6.239
  583    HA   LEU  77           HA       LEU  77  -3.646 -14.668  -4.283
  584   1HB   LEU  77          1HB       LEU  77  -1.044 -14.311  -3.544
  585   2HB   LEU  77          2HB       LEU  77  -1.464 -12.675  -4.050
  586    HG   LEU  77           HG       LEU  77  -3.665 -13.252  -2.609
  587   1HD1  LEU  77          1HD1      LEU  77  -2.339 -15.517  -2.124
  588   2HD1  LEU  77          2HD1      LEU  77  -1.582 -14.520  -0.881
  589   3HD1  LEU  77          3HD1      LEU  77  -3.331 -14.751  -0.883
  590   1HD2  LEU  77          1HD2      LEU  77  -0.988 -12.124  -1.839
  591   2HD2  LEU  77          2HD2      LEU  77  -2.524 -11.288  -2.061
  592   3HD2  LEU  77          3HD2      LEU  77  -2.252 -12.262  -0.617
  593    H    LEU  78           H        LEU  78  -4.878 -14.144  -6.252
  594    HA   LEU  78           HA       LEU  78  -4.106 -11.807  -7.855
  595   1HB   LEU  78          1HB       LEU  78  -6.169 -13.940  -7.802
  596   2HB   LEU  78          2HB       LEU  78  -6.671 -12.416  -8.536
  597    HG   LEU  78           HG       LEU  78  -4.586 -12.491  -9.943
  598   1HD1  LEU  78          1HD1      LEU  78  -4.414 -15.299  -8.807
  599   2HD1  LEU  78          2HD1      LEU  78  -3.408 -14.656 -10.104
  600   3HD1  LEU  78          3HD1      LEU  78  -3.282 -13.988  -8.476
  601   1HD2  LEU  78          1HD2      LEU  78  -6.764 -14.551 -10.077
  602   2HD2  LEU  78          2HD2      LEU  78  -6.461 -13.181 -11.143
  603   3HD2  LEU  78          3HD2      LEU  78  -5.449 -14.622 -11.249
  604    H    CYS  79           H        CYS  79  -4.153  -9.991  -6.443
  605    HA   CYS  79           HA       CYS  79  -6.159  -9.419  -4.500
  606   1HB   CYS  79          1HB       CYS  79  -4.287  -7.731  -6.178
  607   2HB   CYS  79          2HB       CYS  79  -5.290  -7.041  -4.902
  608    HG   CYS  79           HG       CYS  79  -2.967  -7.736  -3.865
  609    H    GLU  80           H        GLU  80  -8.223  -8.611  -4.709
  610    HA   GLU  80           HA       GLU  80  -9.131  -7.830  -7.460
  611   1HB   GLU  80          1HB       GLU  80 -10.532  -9.101  -5.088
  612   2HB   GLU  80          2HB       GLU  80 -11.367  -8.590  -6.555
  613   1HG   GLU  80          1HG       GLU  80  -9.916 -10.085  -7.894
  614   2HG   GLU  80          2HG       GLU  80  -9.117 -10.618  -6.414
  615    H    THR  81           H        THR  81  -8.304  -5.600  -6.820
  616    HA   THR  81           HA       THR  81 -10.084  -4.202  -4.866
  617    HB   THR  81           HB       THR  81  -8.237  -2.395  -5.333
  618    HG1  THR  81           HG1      THR  81  -6.772  -4.694  -6.037
  619   1HG2  THR  81          1HG2      THR  81  -7.858  -4.997  -3.852
  620   2HG2  THR  81          2HG2      THR  81  -6.665  -3.701  -3.772
  621   3HG2  THR  81          3HG2      THR  81  -8.308  -3.422  -3.198
  622    H    GLU  82           H        GLU  82 -11.715  -4.527  -6.805
  623    HA   GLU  82           HA       GLU  82 -12.975  -3.535  -8.531
  624   1HB   GLU  82          1HB       GLU  82 -11.458  -1.200  -7.333
  625   2HB   GLU  82          2HB       GLU  82 -12.749  -0.997  -8.517
  626   1HG   GLU  82          1HG       GLU  82 -13.293  -2.720  -6.136
  627   2HG   GLU  82          2HG       GLU  82 -13.264  -0.971  -5.904
  628    H    GLY  83           H        GLY  83 -10.338  -1.221  -8.979
  629   1HA   GLY  83          2HA       GLY  83  -9.547  -0.722 -11.239
  630   2HA   GLY  83          1HA       GLY  83  -9.902  -2.392 -11.687
  631    H    ARG  84           H        ARG  84  -8.681  -3.356  -9.110
  632    HA   ARG  84           HA       ARG  84  -6.577  -4.184  -8.435
  633   1HB   ARG  84          1HB       ARG  84  -6.677  -4.494 -11.060
  634   2HB   ARG  84          2HB       ARG  84  -5.454  -3.224 -11.050
  635   1HG   ARG  84          1HG       ARG  84  -3.911  -4.532  -9.878
  636   2HG   ARG  84          2HG       ARG  84  -5.160  -5.586  -9.215
  637   1HD   ARG  84          1HD       ARG  84  -5.580  -6.440 -11.559
  638   2HD   ARG  84          2HD       ARG  84  -4.149  -5.527 -12.078
  639    HE   ARG  84           HE       ARG  84  -4.085  -7.701 -10.019
  640   1HH1  ARG  84          1HH1      ARG  84  -1.708  -6.948  -9.308
  641   2HH1  ARG  84          2HH1      ARG  84  -0.583  -7.183 -10.604
  642   1HH2  ARG  84          1HH2      ARG  84  -3.039  -7.459 -13.037
  643   2HH2  ARG  84          2HH2      ARG  84  -1.337  -7.472 -12.716
  644    H    VAL  85           H        VAL  85  -5.220  -3.162  -7.027
  645    HA   VAL  85           HA       VAL  85  -4.927  -0.330  -6.884
  646    HB   VAL  85           HB       VAL  85  -4.649  -1.867  -4.993
  647   1HG1  VAL  85          1HG1      VAL  85  -3.193  -3.394  -6.800
  648   2HG1  VAL  85          2HG1      VAL  85  -1.955  -2.784  -5.704
  649   3HG1  VAL  85          3HG1      VAL  85  -3.320  -3.700  -5.068
  650   1HG2  VAL  85          1HG2      VAL  85  -2.726   0.173  -5.740
  651   2HG2  VAL  85          2HG2      VAL  85  -3.382  -0.203  -4.147
  652   3HG2  VAL  85          3HG2      VAL  85  -1.957  -1.057  -4.739
  653    H    ARG  86           H        ARG  86  -3.640   1.022  -8.056
  654    HA   ARG  86           HA       ARG  86  -1.437  -0.180  -9.693
  655   1HB   ARG  86          1HB       ARG  86  -3.342   0.918 -10.855
  656   2HB   ARG  86          2HB       ARG  86  -2.994   2.411  -9.983
  657   1HG   ARG  86          1HG       ARG  86  -0.535   1.618 -11.103
  658   2HG   ARG  86          2HG       ARG  86  -1.732   1.358 -12.372
  659   1HD   ARG  86          1HD       ARG  86  -1.412   3.942 -10.798
  660   2HD   ARG  86          2HD       ARG  86  -0.840   3.676 -12.458
  661    HE   ARG  86           HE       ARG  86  -3.656   2.988 -12.096
  662   1HH1  ARG  86          1HH1      ARG  86  -2.159   5.915 -11.641
  663   2HH1  ARG  86          2HH1      ARG  86  -2.921   6.731 -12.965
  664   1HH2  ARG  86          1HH2      ARG  86  -4.310   3.845 -14.293
  665   2HH2  ARG  86          2HH2      ARG  86  -4.139   5.559 -14.466
  666    H    VAL  87           H        VAL  87   0.390   0.026  -8.374
  667    HA   VAL  87           HA       VAL  87   0.934   2.737  -7.209
  668    HB   VAL  87           HB       VAL  87   1.950  -0.024  -6.453
  669   1HG1  VAL  87          1HG1      VAL  87   2.532   2.753  -5.492
  670   2HG1  VAL  87          2HG1      VAL  87   2.507   1.442  -4.313
  671   3HG1  VAL  87          3HG1      VAL  87   3.625   1.381  -5.675
  672   1HG2  VAL  87          1HG2      VAL  87  -0.501   0.474  -6.009
  673   2HG2  VAL  87          2HG2      VAL  87   0.453   0.116  -4.569
  674   3HG2  VAL  87          3HG2      VAL  87   0.032   1.784  -4.956
  675    H    GLU  88           H        GLU  88   2.503   3.844  -8.303
  676    HA   GLU  88           HA       GLU  88   4.715   2.281  -9.590
  677   1HB   GLU  88          1HB       GLU  88   3.126   4.628 -10.678
  678   2HB   GLU  88          2HB       GLU  88   4.532   3.919 -11.472
  679   1HG   GLU  88          1HG       GLU  88   3.320   1.702 -11.444
  680   2HG   GLU  88          2HG       GLU  88   1.886   2.567 -10.887
  681    H    THR  89           H        THR  89   6.758   3.283  -9.473
  682    HA   THR  89           HA       THR  89   6.911   5.696  -7.705
  683    HB   THR  89           HB       THR  89   8.887   3.482  -8.352
  684    HG1  THR  89           HG1      THR  89   7.325   2.693  -7.038
  685   1HG2  THR  89          1HG2      THR  89   9.889   5.736  -7.794
  686   2HG2  THR  89          2HG2      THR  89   9.088   5.628  -6.228
  687   3HG2  THR  89          3HG2      THR  89  10.316   4.444  -6.673
  688    H    THR  90           H        THR  90   8.026   7.512  -8.454
  689    HA   THR  90           HA       THR  90   8.736   7.537 -11.331
  690    HB   THR  90           HB       THR  90   7.274   9.267 -10.326
  691    HG1  THR  90           HG1      THR  90   8.540   9.884 -12.066
  692   1HG2  THR  90          1HG2      THR  90   9.056   9.125  -8.198
  693   2HG2  THR  90          2HG2      THR  90   9.411  10.687  -8.935
  694   3HG2  THR  90          3HG2      THR  90   7.772  10.318  -8.397
  695    H    LYS  91           H        LYS  91  10.698   9.434 -11.451
  696    HA   LYS  91           HA       LYS  91  13.114   8.054 -11.084
  697   1HB   LYS  91          1HB       LYS  91  12.221  10.856 -11.514
  698   2HB   LYS  91          2HB       LYS  91  13.895  10.642 -10.999
  699   1HG   LYS  91          1HG       LYS  91  14.287   9.078 -12.851
  700   2HG   LYS  91          2HG       LYS  91  12.604   9.236 -13.355
  701   1HD   LYS  91          1HD       LYS  91  13.890  10.711 -14.754
  702   2HD   LYS  91          2HD       LYS  91  13.022  11.726 -13.602
  703   1HE   LYS  91          1HE       LYS  91  15.054  11.807 -12.164
  704   2HE   LYS  91          2HE       LYS  91  15.927  10.857 -13.383
  705   1HZ   LYS  91          1HZ       LYS  91  14.514  13.411 -13.940
  706   2HZ   LYS  91          2HZ       LYS  91  16.189  13.284 -13.685
  707   3HZ   LYS  91          3HZ       LYS  91  15.470  12.525 -15.025
  708    H    ASP  92           H        ASP  92  11.425  10.171  -8.773
  709    HA   ASP  92           HA       ASP  92  13.166   9.128  -6.612
  710   1HB   ASP  92          1HB       ASP  92  13.223  11.874  -7.779
  711   2HB   ASP  92          2HB       ASP  92  13.381  11.740  -6.027
  712    H    ARG  93           H        ARG  93  10.433   8.632  -6.912
  713    HA   ARG  93           HA       ARG  93   9.363   9.674  -4.425
  714   1HB   ARG  93          1HB       ARG  93   9.124  11.286  -6.738
  715   2HB   ARG  93          2HB       ARG  93   7.527  10.589  -6.472
  716   1HG   ARG  93          1HG       ARG  93   7.170  12.029  -4.784
  717   2HG   ARG  93          2HG       ARG  93   8.572  11.385  -3.931
  718   1HD   ARG  93          1HD       ARG  93   9.131  13.665  -4.201
  719   2HD   ARG  93          2HD       ARG  93   9.940  12.909  -5.589
  720    HE   ARG  93           HE       ARG  93   7.526  13.414  -6.674
  721   1HH1  ARG  93          1HH1      ARG  93   7.421  15.365  -4.205
  722   2HH1  ARG  93          2HH1      ARG  93   7.785  16.856  -5.009
  723   1HH2  ARG  93          1HH2      ARG  93   8.904  15.323  -7.912
  724   2HH2  ARG  93          2HH2      ARG  93   8.624  16.832  -7.108
  725    H    SER  94           H        SER  94   8.464   7.742  -3.793
  726    HA   SER  94           HA       SER  94   7.204   5.914  -5.718
  727   1HB   SER  94          1HB       SER  94   7.050   4.478  -3.778
  728   2HB   SER  94          2HB       SER  94   8.606   5.299  -3.694
  729    HG   SER  94           HG       SER  94   7.122   5.251  -1.756
  730    H    ILE  95           H        ILE  95   5.145   6.410  -6.413
  731    HA   ILE  95           HA       ILE  95   3.317   7.822  -4.528
  732    HB   ILE  95           HB       ILE  95   4.006   8.173  -7.214
  733   1HG1  ILE  95          1HG1      ILE  95   1.362   9.195  -6.286
  734   2HG1  ILE  95          2HG1      ILE  95   2.778   9.620  -5.325
  735   1HG2  ILE  95          1HG2      ILE  95   2.544   6.230  -7.791
  736   2HG2  ILE  95          2HG2      ILE  95   1.183   7.075  -7.055
  737   3HG2  ILE  95          3HG2      ILE  95   1.964   7.743  -8.487
  738   1HD1  ILE  95          1HD1      ILE  95   3.895  10.391  -7.449
  739   2HD1  ILE  95          2HD1      ILE  95   2.356  10.147  -8.275
  740   3HD1  ILE  95          3HD1      ILE  95   2.486  11.346  -6.988
  741    H    PHE  96           H        PHE  96   1.415   6.870  -3.849
  742    HA   PHE  96           HA       PHE  96   0.849   4.100  -4.851
  743   1HB   PHE  96          1HB       PHE  96   1.706   4.276  -2.508
  744   2HB   PHE  96          2HB       PHE  96   0.339   5.316  -2.115
  745    HD1  PHE  96           HD1      PHE  96  -2.033   4.392  -2.561
  746    HD2  PHE  96           HD2      PHE  96   1.486   1.939  -2.394
  747    HE1  PHE  96           HE1      PHE  96  -3.449   2.395  -2.183
  748    HE2  PHE  96           HE2      PHE  96   0.068  -0.064  -2.015
  749    HZ   PHE  96           HZ       PHE  96  -2.403   0.168  -1.911
  750    H    THR  97           H        THR  97  -0.739   4.647  -6.375
  751    HA   THR  97           HA       THR  97  -3.152   6.071  -5.302
  752    HB   THR  97           HB       THR  97  -2.199   7.558  -6.860
  753    HG1  THR  97           HG1      THR  97  -3.785   5.920  -8.533
  754   1HG2  THR  97          1HG2      THR  97  -1.558   5.140  -8.570
  755   2HG2  THR  97          2HG2      THR  97  -1.262   6.812  -9.046
  756   3HG2  THR  97          3HG2      THR  97  -0.405   6.122  -7.669
  757    H    VAL  98           H        VAL  98  -4.723   4.565  -5.058
  758    HA   VAL  98           HA       VAL  98  -4.993   2.428  -7.146
  759    HB   VAL  98           HB       VAL  98  -4.204   1.464  -5.096
  760   1HG1  VAL  98          1HG1      VAL  98  -6.334   3.148  -3.752
  761   2HG1  VAL  98          2HG1      VAL  98  -5.415   1.884  -2.932
  762   3HG1  VAL  98          3HG1      VAL  98  -4.585   3.302  -3.572
  763   1HG2  VAL  98          1HG2      VAL  98  -6.540   0.668  -6.223
  764   2HG2  VAL  98          2HG2      VAL  98  -5.795  -0.168  -4.859
  765   3HG2  VAL  98          3HG2      VAL  98  -7.092   0.996  -4.580
  766    H    GLU  99           H        GLU  99  -6.988   2.308  -8.110
  767    HA   GLU  99           HA       GLU  99  -9.122   4.145  -7.146
  768   1HB   GLU  99          1HB       GLU  99  -8.716   2.550  -9.700
  769   2HB   GLU  99          2HB       GLU  99 -10.048   3.673  -9.422
  770   1HG   GLU  99          1HG       GLU  99  -8.021   5.309  -8.797
  771   2HG   GLU  99          2HG       GLU  99  -7.159   4.240  -9.904
  772    H    GLY 100           H        GLY 100  -8.682   1.845  -5.573
  773   1HA   GLY 100          2HA       GLY 100 -10.086  -0.488  -6.094
  774   2HA   GLY 100          1HA       GLY 100 -11.328   0.663  -5.593
  775    H    ALA 101           H        ALA 101  -9.274   2.055  -3.856
  776    HA   ALA 101           HA       ALA 101  -8.410   0.141  -1.851
  777   1HB   ALA 101          1HB       ALA 101  -8.604   3.141  -2.111
  778   2HB   ALA 101          2HB       ALA 101  -8.095   2.396  -0.596
  779   3HB   ALA 101          3HB       ALA 101  -7.158   2.134  -2.063
  780    H    GLU 102           H        GLU 102 -10.417  -0.948  -1.348
  781    HA   GLU 102           HA       GLU 102 -12.434   0.704   0.130
  782   1HB   GLU 102          1HB       GLU 102 -12.681  -1.061  -1.990
  783   2HB   GLU 102          2HB       GLU 102 -13.121  -2.059  -0.603
  784   1HG   GLU 102          1HG       GLU 102 -14.499   0.170   0.023
  785   2HG   GLU 102          2HG       GLU 102 -14.497   0.325  -1.734
  786    H    LYS 103           H        LYS 103 -13.674  -1.210   1.625
  787    HA   LYS 103           HA       LYS 103 -12.115  -1.533   3.940
  788   1HB   LYS 103          1HB       LYS 103 -14.637  -1.812   3.506
  789   2HB   LYS 103          2HB       LYS 103 -14.255  -3.462   3.012
  790   1HG   LYS 103          1HG       LYS 103 -13.065  -2.592   5.584
  791   2HG   LYS 103          2HG       LYS 103 -14.821  -2.763   5.576
  792   1HD   LYS 103          1HD       LYS 103 -13.912  -5.019   4.199
  793   2HD   LYS 103          2HD       LYS 103 -12.765  -4.832   5.526
  794   1HE   LYS 103          1HE       LYS 103 -15.141  -4.370   6.820
  795   2HE   LYS 103          2HE       LYS 103 -15.620  -5.585   5.617
  796   1HZ   LYS 103          1HZ       LYS 103 -13.623  -6.868   6.255
  797   2HZ   LYS 103          2HZ       LYS 103 -13.334  -5.759   7.509
  798   3HZ   LYS 103          3HZ       LYS 103 -14.738  -6.715   7.524
  799    H    GLU 104           H        GLU 104 -12.283  -3.569   1.069
  800    HA   GLU 104           HA       GLU 104 -10.904  -5.854   2.223
  801   1HB   GLU 104          1HB       GLU 104 -11.325  -4.920  -0.637
  802   2HB   GLU 104          2HB       GLU 104 -10.805  -6.538  -0.165
  803   1HG   GLU 104          1HG       GLU 104 -12.915  -6.760   1.177
  804   2HG   GLU 104          2HG       GLU 104 -13.444  -5.211   0.518
  805    H    ASP 105           H        ASP 105  -9.908  -2.805   0.847
  806    HA   ASP 105           HA       ASP 105  -7.152  -3.683   0.293
  807   1HB   ASP 105          1HB       ASP 105  -8.688  -1.887  -0.868
  808   2HB   ASP 105          2HB       ASP 105  -8.116  -0.837   0.429
  809    H    GLU 106           H        GLU 106  -8.940  -2.063   2.858
  810    HA   GLU 106           HA       GLU 106  -6.952  -0.731   4.302
  811   1HB   GLU 106          1HB       GLU 106  -9.553  -1.320   4.644
  812   2HB   GLU 106          2HB       GLU 106  -8.864  -2.472   5.789
  813   1HG   GLU 106          1HG       GLU 106  -7.424  -0.293   6.455
  814   2HG   GLU 106          2HG       GLU 106  -8.887   0.501   5.875
  815    H    GLY 107           H        GLY 107  -5.903  -1.531   6.399
  816   1HA   GLY 107          2HA       GLY 107  -4.640  -4.177   5.896
  817   2HA   GLY 107          1HA       GLY 107  -5.304  -3.830   7.494
  818    H    VAL 108           H        VAL 108  -2.452  -4.101   6.177
  819    HA   VAL 108           HA       VAL 108  -1.283  -1.537   7.157
  820    HB   VAL 108           HB       VAL 108  -0.715  -4.348   8.142
  821   1HG1  VAL 108          1HG1      VAL 108   0.838  -1.788   8.644
  822   2HG1  VAL 108          2HG1      VAL 108   1.085  -3.304   9.511
  823   3HG1  VAL 108          3HG1      VAL 108   1.428  -3.210   7.784
  824   1HG2  VAL 108          1HG2      VAL 108  -1.553  -1.772   9.508
  825   2HG2  VAL 108          2HG2      VAL 108  -2.576  -3.180   9.232
  826   3HG2  VAL 108          3HG2      VAL 108  -1.207  -3.289  10.339
  827    H    TYR 109           H        TYR 109   0.797  -1.106   6.249
  828    HA   TYR 109           HA       TYR 109   1.794  -3.063   4.213
  829   1HB   TYR 109          1HB       TYR 109   1.216  -0.103   3.845
  830   2HB   TYR 109          2HB       TYR 109   2.051  -1.108   2.662
  831    HD1  TYR 109           HD1      TYR 109   0.874  -2.628   1.252
  832    HD2  TYR 109           HD2      TYR 109  -1.170  -0.624   4.453
  833    HE1  TYR 109           HE1      TYR 109  -1.301  -3.405   0.347
  834    HE2  TYR 109           HE2      TYR 109  -3.346  -1.401   3.549
  835    HH   TYR 109           HH       TYR 109  -3.941  -3.661   1.884
  836    H    THR 110           H        THR 110   4.042  -2.683   3.619
  837    HA   THR 110           HA       THR 110   5.579  -0.847   5.403
  838    HB   THR 110           HB       THR 110   6.190  -3.780   4.893
  839    HG1  THR 110           HG1      THR 110   4.964  -4.127   6.540
  840   1HG2  THR 110          1HG2      THR 110   7.506  -1.639   6.580
  841   2HG2  THR 110          2HG2      THR 110   7.839  -3.360   6.775
  842   3HG2  THR 110          3HG2      THR 110   8.224  -2.554   5.254
  843    H    VAL 111           H        VAL 111   6.248   0.491   3.705
  844    HA   VAL 111           HA       VAL 111   7.101  -0.634   1.143
  845    HB   VAL 111           HB       VAL 111   5.864   1.555   1.643
  846   1HG1  VAL 111          1HG1      VAL 111   7.372   2.328   3.438
  847   2HG1  VAL 111          2HG1      VAL 111   8.680   2.469   2.263
  848   3HG1  VAL 111          3HG1      VAL 111   7.259   3.503   2.128
  849   1HG2  VAL 111          1HG2      VAL 111   8.329   1.449  -0.100
  850   2HG2  VAL 111          2HG2      VAL 111   6.659   1.139  -0.575
  851   3HG2  VAL 111          3HG2      VAL 111   7.168   2.776  -0.161
  852    H    THR 112           H        THR 112   9.193  -1.067   0.526
  853    HA   THR 112           HA       THR 112  11.365  -0.361   2.476
  854    HB   THR 112           HB       THR 112  10.627  -2.804   0.901
  855    HG1  THR 112           HG1      THR 112  10.150  -2.831   3.042
  856   1HG2  THR 112          1HG2      THR 112  13.421  -1.885   1.509
  857   2HG2  THR 112          2HG2      THR 112  13.038  -3.605   1.563
  858   3HG2  THR 112          3HG2      THR 112  12.805  -2.696   0.070
  859    H    VAL 113           H        VAL 113  12.871   1.015   1.638
  860    HA   VAL 113           HA       VAL 113  13.048   1.373  -1.314
  861    HB   VAL 113           HB       VAL 113  14.145   3.464  -0.730
  862   1HG1  VAL 113          1HG1      VAL 113  11.642   3.256  -0.404
  863   2HG1  VAL 113          2HG1      VAL 113  11.961   3.043   1.317
  864   3HG1  VAL 113          3HG1      VAL 113  12.411   4.549   0.518
  865   1HG2  VAL 113          1HG2      VAL 113  14.174   2.396   2.110
  866   2HG2  VAL 113          2HG2      VAL 113  15.583   2.607   1.073
  867   3HG2  VAL 113          3HG2      VAL 113  14.679   4.013   1.625
  868    H    LYS 114           H        LYS 114  14.851   0.604  -2.429
  869    HA   LYS 114           HA       LYS 114  17.215  -0.257  -0.796
  870   1HB   LYS 114          1HB       LYS 114  15.522  -2.067  -1.468
  871   2HB   LYS 114          2HB       LYS 114  16.061  -1.801  -3.125
  872   1HG   LYS 114          1HG       LYS 114  18.316  -2.426  -2.583
  873   2HG   LYS 114          2HG       LYS 114  17.962  -2.428  -0.855
  874   1HD   LYS 114          1HD       LYS 114  17.096  -4.519  -0.925
  875   2HD   LYS 114          2HD       LYS 114  16.173  -4.176  -2.389
  876   1HE   LYS 114          1HE       LYS 114  18.395  -4.345  -3.664
  877   2HE   LYS 114          2HE       LYS 114  19.065  -5.051  -2.180
  878   1HZ   LYS 114          1HZ       LYS 114  16.604  -5.999  -3.553
  879   2HZ   LYS 114          2HZ       LYS 114  18.124  -6.749  -3.668
  880   3HZ   LYS 114          3HZ       LYS 114  17.320  -6.692  -2.177
  881    H    ASN 115           H        ASN 115  19.208  -0.400  -2.030
  882    HA   ASN 115           HA       ASN 115  19.378   0.487  -4.792
  883   1HB   ASN 115          1HB       ASN 115  19.170   2.423  -2.688
  884   2HB   ASN 115          2HB       ASN 115  20.804   2.510  -3.346
  885   1HD2  ASN 115          2HD2      ASN 115  18.859   4.607  -3.753
  886   2HD2  ASN 115          1HD2      ASN 115  18.486   4.660  -5.408
  887    HA   PRO 116           HA       PRO 116  23.333  -1.349  -4.386
  888   1HB   PRO 116          1HB       PRO 116  24.972   0.226  -5.911
  889   2HB   PRO 116          2HB       PRO 116  23.758  -0.871  -6.600
  890   1HG   PRO 116          1HG       PRO 116  23.620   2.071  -6.168
  891   2HG   PRO 116          2HG       PRO 116  23.045   1.105  -7.536
  892   1HD   PRO 116          1HD       PRO 116  21.400   2.049  -5.594
  893   2HD   PRO 116          2HD       PRO 116  21.084   0.541  -6.483
  894    H    VAL 117           H        VAL 117  22.867   1.803  -3.128
  895    HA   VAL 117           HA       VAL 117  25.609   1.861  -1.946
  896    HB   VAL 117           HB       VAL 117  23.407   3.949  -1.993
  897   1HG1  VAL 117          1HG1      VAL 117  26.337   4.051  -1.221
  898   2HG1  VAL 117          2HG1      VAL 117  25.315   5.474  -1.422
  899   3HG1  VAL 117          3HG1      VAL 117  24.956   4.303  -0.153
  900   1HG2  VAL 117          1HG2      VAL 117  24.506   3.177  -4.227
  901   2HG2  VAL 117          2HG2      VAL 117  24.471   4.903  -3.873
  902   3HG2  VAL 117          3HG2      VAL 117  25.951   3.981  -3.615
  903    H    GLY 118           H        GLY 118  22.159   1.709  -1.060
  904   1HA   GLY 118          2HA       GLY 118  22.238   2.157   1.677
  905   2HA   GLY 118          1HA       GLY 118  22.847   0.511   1.500
  906    H    GLU 119           H        GLU 119  20.376   1.273   2.792
  907    HA   GLU 119           HA       GLU 119  18.127   0.757   1.023
  908   1HB   GLU 119          1HB       GLU 119  17.706  -1.544   1.819
  909   2HB   GLU 119          2HB       GLU 119  19.286  -1.439   1.043
  910   1HG   GLU 119          1HG       GLU 119  20.028  -0.860   3.559
  911   2HG   GLU 119          2HG       GLU 119  18.609  -1.847   3.913
  912    H    ASP 120           H        ASP 120  16.146   1.035   2.157
  913    HA   ASP 120           HA       ASP 120  16.281   1.346   5.123
  914   1HB   ASP 120          1HB       ASP 120  16.433   3.455   3.306
  915   2HB   ASP 120          2HB       ASP 120  14.734   3.438   3.777
  916    H    GLN 121           H        GLN 121  13.963   1.656   5.995
  917    HA   GLN 121           HA       GLN 121  11.863   0.506   4.232
  918   1HB   GLN 121          1HB       GLN 121  13.043  -1.380   5.293
  919   2HB   GLN 121          2HB       GLN 121  12.788  -0.656   6.880
  920   1HG   GLN 121          1HG       GLN 121  10.427  -0.957   6.750
  921   2HG   GLN 121          2HG       GLN 121  10.499  -1.331   5.028
  922   1HE2  GLN 121          2HE2      GLN 121  11.748  -3.402   4.460
  923   2HE2  GLN 121          1HE2      GLN 121  11.682  -4.691   5.562
  924    H    VAL 122           H        VAL 122   9.701   0.658   5.277
  925    HA   VAL 122           HA       VAL 122   9.385   2.264   7.701
  926    HB   VAL 122           HB       VAL 122   9.735   4.194   6.480
  927   1HG1  VAL 122          1HG1      VAL 122   9.213   2.411   4.178
  928   2HG1  VAL 122          2HG1      VAL 122   8.819   4.109   3.928
  929   3HG1  VAL 122          3HG1      VAL 122  10.455   3.641   4.392
  930   1HG2  VAL 122          1HG2      VAL 122   7.317   4.197   7.122
  931   2HG2  VAL 122          2HG2      VAL 122   7.643   5.160   5.680
  932   3HG2  VAL 122          3HG2      VAL 122   6.925   3.556   5.526
  933    H    ASN 123           H        ASN 123   7.019   2.540   8.176
  934    HA   ASN 123           HA       ASN 123   5.464   0.294   6.957
  935   1HB   ASN 123          1HB       ASN 123   5.040   1.812   9.545
  936   2HB   ASN 123          2HB       ASN 123   4.250   0.313   9.068
  937   1HD2  ASN 123          2HD2      ASN 123   6.180  -1.372   8.251
  938   2HD2  ASN 123          1HD2      ASN 123   7.400  -1.571   9.415
  939    H    LEU 124           H        LEU 124   3.499   0.701   6.003
  940    HA   LEU 124           HA       LEU 124   2.583   3.555   5.878
  941   1HB   LEU 124          1HB       LEU 124   3.419   2.783   3.753
  942   2HB   LEU 124          2HB       LEU 124   2.553   1.257   3.899
  943    HG   LEU 124           HG       LEU 124   0.605   3.320   4.135
  944   1HD1  LEU 124          1HD1      LEU 124   2.712   4.455   2.848
  945   2HD1  LEU 124          2HD1      LEU 124   1.879   3.707   1.485
  946   3HD1  LEU 124          3HD1      LEU 124   1.032   4.866   2.507
  947   1HD2  LEU 124          1HD2      LEU 124   1.342   1.138   2.227
  948   2HD2  LEU 124          2HD2      LEU 124  -0.153   1.378   3.131
  949   3HD2  LEU 124          3HD2      LEU 124   0.165   2.333   1.683
  950    H    THR 125           H        THR 125   0.834   3.705   7.254
  951    HA   THR 125           HA       THR 125  -0.930   1.394   7.731
  952    HB   THR 125           HB       THR 125  -0.200   2.916   9.535
  953    HG1  THR 125           HG1      THR 125  -2.956   3.131   8.901
  954   1HG2  THR 125          1HG2      THR 125  -0.895   4.912   7.582
  955   2HG2  THR 125          2HG2      THR 125  -1.820   5.191   9.056
  956   3HG2  THR 125          3HG2      THR 125  -0.060   5.119   9.121
  957    H    VAL 126           H        VAL 126  -3.183   1.377   7.189
  958    HA   VAL 126           HA       VAL 126  -4.024   3.457   5.208
  959    HB   VAL 126           HB       VAL 126  -3.371   1.437   4.034
  960   1HG1  VAL 126          1HG1      VAL 126  -4.763   0.162   6.319
  961   2HG1  VAL 126          2HG1      VAL 126  -4.999  -0.618   4.755
  962   3HG1  VAL 126          3HG1      VAL 126  -3.370  -0.398   5.393
  963   1HG2  VAL 126          1HG2      VAL 126  -5.658   2.643   3.567
  964   2HG2  VAL 126          2HG2      VAL 126  -5.323   1.098   2.785
  965   3HG2  VAL 126          3HG2      VAL 126  -6.361   1.159   4.209
  966    H    LYS 127           H        LYS 127  -6.395   3.712   5.063
  967    HA   LYS 127           HA       LYS 127  -8.054   2.458   7.159
  968   1HB   LYS 127          1HB       LYS 127  -6.826   4.320   8.266
  969   2HB   LYS 127          2HB       LYS 127  -7.489   5.441   7.077
  970   1HG   LYS 127          1HG       LYS 127  -9.096   5.710   8.692
  971   2HG   LYS 127          2HG       LYS 127  -9.782   4.292   7.899
  972   1HD   LYS 127          1HD       LYS 127  -8.019   3.121   9.631
  973   2HD   LYS 127          2HD       LYS 127  -8.518   4.536  10.559
  974   1HE   LYS 127          1HE       LYS 127 -10.573   2.793   9.192
  975   2HE   LYS 127          2HE       LYS 127  -9.961   2.395  10.809
  976   1HZ   LYS 127          1HZ       LYS 127 -10.946   5.093  10.067
  977   2HZ   LYS 127          2HZ       LYS 127 -11.940   3.916  10.775
  978   3HZ   LYS 127          3HZ       LYS 127 -10.593   4.510  11.623
  979    H    VAL 128           H        VAL 128  -9.975   2.069   6.143
  980    HA   VAL 128           HA       VAL 128 -10.789   3.834   3.862
  981    HB   VAL 128           HB       VAL 128 -11.559   1.016   4.713
  982   1HG1  VAL 128          1HG1      VAL 128 -13.032   2.837   3.153
  983   2HG1  VAL 128          2HG1      VAL 128 -12.258   1.753   1.998
  984   3HG1  VAL 128          3HG1      VAL 128 -13.286   1.096   3.270
  985   1HG2  VAL 128          1HG2      VAL 128  -9.309   1.963   3.316
  986   2HG2  VAL 128          2HG2      VAL 128  -9.873   0.294   3.396
  987   3HG2  VAL 128          3HG2      VAL 128 -10.388   1.336   2.070
  988    H    ILE 129           H        ILE 129 -12.363   5.287   4.356
  989    HA   ILE 129           HA       ILE 129 -14.260   4.637   6.584
  990    HB   ILE 129           HB       ILE 129 -14.462   7.114   6.769
  991   1HG1  ILE 129          1HG1      ILE 129 -12.160   7.896   5.265
  992   2HG1  ILE 129          2HG1      ILE 129 -13.219   6.996   4.184
  993   1HG2  ILE 129          1HG2      ILE 129 -11.799   5.740   6.954
  994   2HG2  ILE 129          2HG2      ILE 129 -11.912   7.462   7.315
  995   3HG2  ILE 129          3HG2      ILE 129 -12.856   6.303   8.248
  996   1HD1  ILE 129          1HD1      ILE 129 -15.074   8.511   5.399
  997   2HD1  ILE 129          2HD1      ILE 129 -13.689   9.590   5.569
  998   3HD1  ILE 129          3HD1      ILE 129 -14.204   9.061   3.967
  999    H    ASP 130           H        ASP 130 -16.481   5.622   6.232
 1000    HA   ASP 130           HA       ASP 130 -17.346   5.115   3.434
 1001   1HB   ASP 130          1HB       ASP 130 -19.573   4.979   4.520
 1002   2HB   ASP 130          2HB       ASP 130 -18.406   3.925   5.317

  No H/Q in entry =        1002
  Start of MODEL    9
    1    H1   ARG   1          1H        ARG   1  30.171   7.075  -7.080
    2    H2   ARG   1          2H        ARG   1  30.138   6.375  -5.535
    3    H3   ARG   1          3H        ARG   1  30.854   5.540  -6.830
    4    HA   ARG   1           HA       ARG   1  28.772   5.162  -7.880
    5   1HB   ARG   1          1HB       ARG   1  28.924   4.737  -4.890
    6   2HB   ARG   1          2HB       ARG   1  27.617   4.050  -5.855
    7   1HG   ARG   1          1HG       ARG   1  30.567   3.605  -6.396
    8   2HG   ARG   1          2HG       ARG   1  29.521   2.463  -5.553
    9   1HD   ARG   1          1HD       ARG   1  29.141   1.600  -7.637
   10   2HD   ARG   1          2HD       ARG   1  28.074   3.002  -7.852
   11    HE   ARG   1           HE       ARG   1  30.583   4.016  -8.417
   12   1HH1  ARG   1          1HH1      ARG   1  30.002   4.491 -10.787
   13   2HH1  ARG   1          2HH1      ARG   1  30.122   3.099 -11.811
   14   1HH2  ARG   1          1HH2      ARG   1  30.189   0.841  -9.180
   15   2HH2  ARG   1          2HH2      ARG   1  30.228   1.033 -10.902
   16    H    GLN   2           H        GLN   2  26.266   5.227  -7.240
   17    HA   GLN   2           HA       GLN   2  25.419   7.962  -7.371
   18   1HB   GLN   2          1HB       GLN   2  23.177   6.937  -7.249
   19   2HB   GLN   2          2HB       GLN   2  24.230   6.009  -8.316
   20   1HG   GLN   2          1HG       GLN   2  24.435   4.258  -6.833
   21   2HG   GLN   2          2HG       GLN   2  24.136   5.272  -5.425
   22   1HE2  GLN   2          2HE2      GLN   2  21.898   5.805  -4.898
   23   2HE2  GLN   2          1HE2      GLN   2  20.604   4.944  -5.575
   24    H    GLU   3           H        GLU   3  23.117   7.519  -5.433
   25    HA   GLU   3           HA       GLU   3  24.610   8.214  -2.932
   26   1HB   GLU   3          1HB       GLU   3  22.181   9.225  -4.335
   27   2HB   GLU   3          2HB       GLU   3  22.160   9.265  -2.572
   28   1HG   GLU   3          1HG       GLU   3  23.144  11.318  -3.021
   29   2HG   GLU   3          2HG       GLU   3  24.578  10.298  -2.890
   30    HA   PRO   4           HA       PRO   4  22.819   4.679  -1.002
   31   1HB   PRO   4          1HB       PRO   4  22.641   5.595   1.578
   32   2HB   PRO   4          2HB       PRO   4  24.166   5.083   0.825
   33   1HG   PRO   4          1HG       PRO   4  23.053   7.839   1.146
   34   2HG   PRO   4          2HG       PRO   4  24.704   7.254   1.428
   35   1HD   PRO   4          1HD       PRO   4  24.073   8.558  -0.819
   36   2HD   PRO   4          2HD       PRO   4  25.214   7.193  -0.836
   37    HA   PRO   5           HA       PRO   5  18.497   5.714  -1.184
   38   1HB   PRO   5          1HB       PRO   5  17.550   3.223  -0.547
   39   2HB   PRO   5          2HB       PRO   5  18.194   3.624  -2.151
   40   1HG   PRO   5          1HG       PRO   5  19.526   2.269   0.146
   41   2HG   PRO   5          2HG       PRO   5  19.561   1.842  -1.572
   42   1HD   PRO   5          1HD       PRO   5  21.595   3.139  -0.391
   43   2HD   PRO   5          2HD       PRO   5  21.125   3.468  -2.076
   44    H    LYS   6           H        LYS   6  17.254   6.596   0.446
   45    HA   LYS   6           HA       LYS   6  17.032   5.300   3.068
   46   1HB   LYS   6          1HB       LYS   6  18.792   7.646   2.488
   47   2HB   LYS   6          2HB       LYS   6  17.900   7.658   4.009
   48   1HG   LYS   6          1HG       LYS   6  18.889   5.069   3.886
   49   2HG   LYS   6          2HG       LYS   6  20.205   6.031   3.214
   50   1HD   LYS   6          1HD       LYS   6  19.762   7.600   5.260
   51   2HD   LYS   6          2HD       LYS   6  18.957   6.188   5.946
   52   1HE   LYS   6          1HE       LYS   6  21.163   5.887   6.699
   53   2HE   LYS   6          2HE       LYS   6  21.179   4.946   5.194
   54   1HZ   LYS   6          1HZ       LYS   6  21.934   6.915   4.009
   55   2HZ   LYS   6          2HZ       LYS   6  21.940   7.809   5.451
   56   3HZ   LYS   6          3HZ       LYS   6  23.024   6.515   5.250
   57    H    ILE   7           H        ILE   7  15.223   6.080   4.197
   58    HA   ILE   7           HA       ILE   7  13.208   7.516   2.713
   59    HB   ILE   7           HB       ILE   7  13.407   6.970   5.694
   60   1HG1  ILE   7          1HG1      ILE   7  13.809   4.847   4.699
   61   2HG1  ILE   7          2HG1      ILE   7  12.082   4.858   5.039
   62   1HG2  ILE   7          1HG2      ILE   7  11.519   8.400   4.435
   63   2HG2  ILE   7          2HG2      ILE   7  10.867   6.786   4.157
   64   3HG2  ILE   7          3HG2      ILE   7  11.149   7.350   5.802
   65   1HD1  ILE   7          1HD1      ILE   7  11.641   5.525   2.685
   66   2HD1  ILE   7          2HD1      ILE   7  13.372   5.455   2.355
   67   3HD1  ILE   7          3HD1      ILE   7  12.496   3.986   2.781
   68    H    HIS   8           H        HIS   8  15.002   9.343   2.369
   69    HA   HIS   8           HA       HIS   8  14.734  11.384   4.549
   70   1HB   HIS   8          1HB       HIS   8  17.003  10.578   4.275
   71   2HB   HIS   8          2HB       HIS   8  16.908  10.764   2.527
   72    HD1  HIS   8           HD1      HIS   8  18.289  12.416   5.336
   73    HD2  HIS   8           HD2      HIS   8  16.248  13.744   1.955
   74    HE1  HIS   8           HE1      HIS   8  18.857  14.870   5.076
   75    H    LEU   9           H        LEU   9  14.326  13.577   3.827
   76    HA   LEU   9           HA       LEU   9  13.656  13.882   0.937
   77   1HB   LEU   9          1HB       LEU   9  11.600  15.233   1.987
   78   2HB   LEU   9          2HB       LEU   9  11.524  13.504   1.710
   79    HG   LEU   9           HG       LEU   9  12.199  13.101   4.060
   80   1HD1  LEU   9          1HD1      LEU   9  12.081  16.124   4.194
   81   2HD1  LEU   9          2HD1      LEU   9  12.059  15.088   5.616
   82   3HD1  LEU   9          3HD1      LEU   9  13.463  15.092   4.552
   83   1HD2  LEU   9          1HD2      LEU   9   9.793  13.298   3.357
   84   2HD2  LEU   9          2HD2      LEU   9  10.073  13.714   5.048
   85   3HD2  LEU   9          3HD2      LEU   9   9.839  14.990   3.853
   86    H    ASP  10           H        ASP  10  12.452  16.540   2.505
   87    HA   ASP  10           HA       ASP  10  14.289  18.390   1.486
   88   1HB   ASP  10          1HB       ASP  10  11.905  18.608   2.501
   89   2HB   ASP  10          2HB       ASP  10  12.743  18.811   4.040
   90    H    CYS  11           H        CYS  11  14.386  16.650   4.583
   91    HA   CYS  11           HA       CYS  11  17.199  17.189   4.898
   92   1HB   CYS  11          1HB       CYS  11  15.308  19.186   5.776
   93   2HB   CYS  11          2HB       CYS  11  16.204  18.570   7.162
   94    HG   CYS  11           HG       CYS  11  18.429  19.107   5.676
   95    HA   PRO  12           HA       PRO  12  15.709  15.213   8.988
   96   1HB   PRO  12          1HB       PRO  12  13.013  14.800   9.316
   97   2HB   PRO  12          2HB       PRO  12  13.862  16.250   9.886
   98   1HG   PRO  12          1HG       PRO  12  12.235  15.863   7.418
   99   2HG   PRO  12          2HG       PRO  12  12.297  17.244   8.523
  100   1HD   PRO  12          1HD       PRO  12  13.576  17.241   6.147
  101   2HD   PRO  12          2HD       PRO  12  14.209  18.100   7.567
  102    H    GLY  13           H        GLY  13  12.914  14.192   6.996
  103   1HA   GLY  13          2HA       GLY  13  14.283  11.552   6.676
  104   2HA   GLY  13          1HA       GLY  13  13.282  12.263   5.411
  105    H    ARG  14           H        ARG  14  11.073  13.112   6.750
  106    HA   ARG  14           HA       ARG  14  10.047  10.672   8.158
  107   1HB   ARG  14          1HB       ARG  14   9.223  13.595   8.245
  108   2HB   ARG  14          2HB       ARG  14   8.419  12.304   9.138
  109   1HG   ARG  14          1HG       ARG  14  11.027  11.878   9.841
  110   2HG   ARG  14          2HG       ARG  14  11.004  13.633   9.668
  111   1HD   ARG  14          1HD       ARG  14   9.901  13.846  11.633
  112   2HD   ARG  14          2HD       ARG  14   8.624  12.749  11.073
  113    HE   ARG  14           HE       ARG  14   9.848  10.896  12.002
  114   1HH1  ARG  14          1HH1      ARG  14  12.626  11.601  11.358
  115   2HH1  ARG  14          2HH1      ARG  14  13.286  12.055  12.894
  116   1HH2  ARG  14          1HH2      ARG  14  10.191  12.483  14.397
  117   2HH2  ARG  14          2HH2      ARG  14  11.908  12.554  14.614
  118    H    ILE  15           H        ILE  15   9.485   9.640   6.109
  119    HA   ILE  15           HA       ILE  15   7.724  10.979   4.196
  120    HB   ILE  15           HB       ILE  15   8.860   8.211   4.628
  121   1HG1  ILE  15          1HG1      ILE  15   9.130  10.233   2.379
  122   2HG1  ILE  15          2HG1      ILE  15  10.289  10.022   3.691
  123   1HG2  ILE  15          1HG2      ILE  15   6.650   9.059   2.786
  124   2HG2  ILE  15          2HG2      ILE  15   7.829   7.880   2.210
  125   3HG2  ILE  15          3HG2      ILE  15   6.866   7.534   3.645
  126   1HD1  ILE  15          1HD1      ILE  15   9.844   7.438   2.642
  127   2HD1  ILE  15          2HD1      ILE  15  10.024   8.500   1.247
  128   3HD1  ILE  15          3HD1      ILE  15  11.295   8.422   2.464
  129    HA   PRO  16           HA       PRO  16   4.231   9.802   6.817
  130   1HB   PRO  16          1HB       PRO  16   2.415  11.464   5.632
  131   2HB   PRO  16          2HB       PRO  16   3.583  12.028   6.843
  132   1HG   PRO  16          1HG       PRO  16   3.614  12.340   3.896
  133   2HG   PRO  16          2HG       PRO  16   4.197  13.435   5.157
  134   1HD   PRO  16          1HD       PRO  16   5.797  11.787   3.615
  135   2HD   PRO  16          2HD       PRO  16   6.258  12.493   5.176
  136    H    ASP  17           H        ASP  17   4.837   7.873   5.067
  137    HA   ASP  17           HA       ASP  17   3.124   7.622   2.769
  138   1HB   ASP  17          1HB       ASP  17   3.967   5.319   2.782
  139   2HB   ASP  17          2HB       ASP  17   5.277   6.420   3.185
  140    H    THR  18           H        THR  18   1.058   8.295   3.806
  141    HA   THR  18           HA       THR  18  -0.275   6.033   5.274
  142    HB   THR  18           HB       THR  18  -0.883   9.009   5.373
  143    HG1  THR  18           HG1      THR  18   1.130   8.633   6.272
  144   1HG2  THR  18          1HG2      THR  18  -1.745   6.674   7.104
  145   2HG2  THR  18          2HG2      THR  18  -2.144   8.365   7.409
  146   3HG2  THR  18          3HG2      THR  18  -2.767   7.557   5.971
  147    H    ILE  19           H        ILE  19  -1.375   5.016   3.619
  148    HA   ILE  19           HA       ILE  19  -2.646   6.605   1.484
  149    HB   ILE  19           HB       ILE  19  -1.341   4.503   1.117
  150   1HG1  ILE  19          1HG1      ILE  19  -3.043   3.434  -0.369
  151   2HG1  ILE  19          2HG1      ILE  19  -4.277   4.442   0.385
  152   1HG2  ILE  19          1HG2      ILE  19  -2.678   3.553   3.305
  153   2HG2  ILE  19          2HG2      ILE  19  -3.590   2.803   1.996
  154   3HG2  ILE  19          3HG2      ILE  19  -1.854   2.531   2.129
  155   1HD1  ILE  19          1HD1      ILE  19  -1.817   5.504  -1.035
  156   2HD1  ILE  19          2HD1      ILE  19  -3.428   5.425  -1.744
  157   3HD1  ILE  19          3HD1      ILE  19  -3.128   6.470  -0.359
  158    H    VAL  20           H        VAL  20  -4.707   7.360   1.751
  159    HA   VAL  20           HA       VAL  20  -6.604   5.725   3.393
  160    HB   VAL  20           HB       VAL  20  -6.371   8.744   3.160
  161   1HG1  VAL  20          1HG1      VAL  20  -8.563   7.137   3.863
  162   2HG1  VAL  20          2HG1      VAL  20  -7.890   7.682   5.399
  163   3HG1  VAL  20          3HG1      VAL  20  -8.378   8.861   4.181
  164   1HG2  VAL  20          1HG2      VAL  20  -4.519   7.632   4.436
  165   2HG2  VAL  20          2HG2      VAL  20  -5.529   8.666   5.447
  166   3HG2  VAL  20          3HG2      VAL  20  -5.732   6.916   5.498
  167    H    VAL  21           H        VAL  21  -8.748   5.650   2.584
  168    HA   VAL  21           HA       VAL  21  -9.387   7.088   0.066
  169    HB   VAL  21           HB       VAL  21  -8.195   5.079  -0.632
  170   1HG1  VAL  21          1HG1      VAL  21  -9.304   3.979   1.693
  171   2HG1  VAL  21          2HG1      VAL  21 -10.077   3.100   0.377
  172   3HG1  VAL  21          3HG1      VAL  21  -8.319   3.133   0.504
  173   1HG2  VAL  21          1HG2      VAL  21 -10.439   5.821  -1.732
  174   2HG2  VAL  21          2HG2      VAL  21  -9.793   4.230  -2.138
  175   3HG2  VAL  21          3HG2      VAL  21 -11.106   4.378  -0.970
  176    H    VAL  22           H        VAL  22 -11.713   6.892  -0.456
  177    HA   VAL  22           HA       VAL  22 -13.348   6.480   1.995
  178    HB   VAL  22           HB       VAL  22 -13.948   7.710  -0.719
  179   1HG1  VAL  22          1HG1      VAL  22 -15.732   6.828   1.241
  180   2HG1  VAL  22          2HG1      VAL  22 -15.577   8.556   1.551
  181   3HG1  VAL  22          3HG1      VAL  22 -16.084   7.988  -0.039
  182   1HG2  VAL  22          1HG2      VAL  22 -12.958   8.804   1.908
  183   2HG2  VAL  22          2HG2      VAL  22 -12.375   9.143   0.279
  184   3HG2  VAL  22          3HG2      VAL  22 -13.907   9.823   0.827
  185    H    ALA  23           H        ALA  23 -12.575   4.045   1.096
  186    HA   ALA  23           HA       ALA  23 -13.312   1.973   0.222
  187   1HB   ALA  23          1HB       ALA  23 -15.841   3.397   1.086
  188   2HB   ALA  23          3HB       ALA  23 -14.832   2.331   2.065
  189   3HB   ALA  23          2HB       ALA  23 -15.766   1.674   0.723
  190    H    GLY  24           H        GLY  24 -12.832   2.074  -2.016
  191   1HA   GLY  24          2HA       GLY  24 -15.125   2.132  -3.790
  192   2HA   GLY  24          1HA       GLY  24 -13.449   1.890  -4.280
  193    H    ASN  25           H        ASN  25 -12.211   4.195  -3.516
  194    HA   ASN  25           HA       ASN  25 -13.602   6.239  -5.197
  195   1HB   ASN  25          1HB       ASN  25 -13.916   6.498  -2.664
  196   2HB   ASN  25          2HB       ASN  25 -12.192   6.859  -2.593
  197   1HD2  ASN  25          2HD2      ASN  25 -15.128   8.387  -2.738
  198   2HD2  ASN  25          1HD2      ASN  25 -14.671   9.814  -3.535
  199    H    LYS  26           H        LYS  26 -12.086   7.848  -6.069
  200    HA   LYS  26           HA       LYS  26  -9.601   6.742  -6.992
  201   1HB   LYS  26          1HB       LYS  26 -10.800   9.521  -6.882
  202   2HB   LYS  26          2HB       LYS  26  -9.262   9.190  -7.680
  203   1HG   LYS  26          1HG       LYS  26 -10.425   7.454  -9.071
  204   2HG   LYS  26          2HG       LYS  26 -11.953   7.968  -8.355
  205   1HD   LYS  26          1HD       LYS  26 -10.150  10.016  -9.612
  206   2HD   LYS  26          2HD       LYS  26 -11.177   9.015 -10.639
  207   1HE   LYS  26          1HE       LYS  26 -13.055   9.712  -8.892
  208   2HE   LYS  26          2HE       LYS  26 -11.970  11.092  -8.629
  209   1HZ   LYS  26          1HZ       LYS  26 -12.800  10.139 -11.315
  210   2HZ   LYS  26          2HZ       LYS  26 -13.576  11.404 -10.493
  211   3HZ   LYS  26          3HZ       LYS  26 -11.947  11.562 -10.947
  212    H    LEU  27           H        LEU  27  -8.019   6.262  -5.463
  213    HA   LEU  27           HA       LEU  27  -7.459   8.321  -3.370
  214   1HB   LEU  27          1HB       LEU  27  -7.887   6.350  -2.252
  215   2HB   LEU  27          2HB       LEU  27  -7.373   5.351  -3.608
  216    HG   LEU  27           HG       LEU  27  -5.019   5.836  -3.097
  217   1HD1  LEU  27          1HD1      LEU  27  -6.203   7.961  -1.550
  218   2HD1  LEU  27          2HD1      LEU  27  -5.205   6.960  -0.497
  219   3HD1  LEU  27          3HD1      LEU  27  -4.503   7.696  -1.935
  220   1HD2  LEU  27          1HD2      LEU  27  -6.736   4.213  -1.664
  221   2HD2  LEU  27          2HD2      LEU  27  -4.978   4.177  -1.555
  222   3HD2  LEU  27          3HD2      LEU  27  -5.914   5.116  -0.393
  223    H    ARG  28           H        ARG  28  -5.404   9.207  -3.218
  224    HA   ARG  28           HA       ARG  28  -3.291   8.229  -5.103
  225   1HB   ARG  28          1HB       ARG  28  -4.245  11.069  -4.599
  226   2HB   ARG  28          2HB       ARG  28  -2.834  10.650  -5.572
  227   1HG   ARG  28          1HG       ARG  28  -4.808   9.024  -6.631
  228   2HG   ARG  28          2HG       ARG  28  -5.685  10.508  -6.260
  229   1HD   ARG  28          1HD       ARG  28  -3.812  11.774  -7.450
  230   2HD   ARG  28          2HD       ARG  28  -3.248  10.196  -8.035
  231    HE   ARG  28           HE       ARG  28  -5.760  11.523  -8.819
  232   1HH1  ARG  28          1HH1      ARG  28  -6.742   8.881  -8.256
  233   2HH1  ARG  28          2HH1      ARG  28  -6.350   7.964  -9.673
  234   1HH2  ARG  28          1HH2      ARG  28  -4.008  10.248 -10.825
  235   2HH2  ARG  28          2HH2      ARG  28  -4.802   8.738 -11.128
  236    H    LEU  29           H        LEU  29  -1.131   8.556  -4.290
  237    HA   LEU  29           HA       LEU  29  -0.855   9.802  -1.595
  238   1HB   LEU  29          1HB       LEU  29  -1.433   7.473  -1.204
  239   2HB   LEU  29          2HB       LEU  29  -0.223   6.942  -2.365
  240    HG   LEU  29           HG       LEU  29   1.563   7.838  -0.947
  241   1HD1  LEU  29          1HD1      LEU  29  -0.788   8.854   0.608
  242   2HD1  LEU  29          2HD1      LEU  29   0.691   8.443   1.477
  243   3HD1  LEU  29          3HD1      LEU  29   0.724   9.671   0.213
  244   1HD2  LEU  29          1HD2      LEU  29  -0.436   5.948   0.271
  245   2HD2  LEU  29          2HD2      LEU  29   1.134   5.581  -0.443
  246   3HD2  LEU  29          3HD2      LEU  29   1.043   6.363   1.135
  247    H    ASP  30           H        ASP  30   1.122  10.843  -1.419
  248    HA   ASP  30           HA       ASP  30   3.258  10.134  -3.402
  249   1HB   ASP  30          1HB       ASP  30   1.914  12.733  -2.737
  250   2HB   ASP  30          2HB       ASP  30   3.600  12.756  -3.254
  251    H    VAL  31           H        VAL  31   5.301  10.020  -2.514
  252    HA   VAL  31           HA       VAL  31   5.857  11.308   0.104
  253    HB   VAL  31           HB       VAL  31   6.827   8.984   0.780
  254   1HG1  VAL  31          1HG1      VAL  31   4.805  10.112   1.759
  255   2HG1  VAL  31          2HG1      VAL  31   3.820   9.276   0.558
  256   3HG1  VAL  31          3HG1      VAL  31   4.708   8.352   1.769
  257   1HG2  VAL  31          1HG2      VAL  31   6.375   8.155  -1.644
  258   2HG2  VAL  31          2HG2      VAL  31   5.988   7.072  -0.306
  259   3HG2  VAL  31          3HG2      VAL  31   4.704   7.979  -1.106
  260    HA   PRO  32           HA       PRO  32   9.625  11.739  -2.243
  261   1HB   PRO  32          1HB       PRO  32  10.927  13.367  -0.483
  262   2HB   PRO  32          2HB       PRO  32   9.627  13.938  -1.547
  263   1HG   PRO  32          1HG       PRO  32   9.585  13.386   1.350
  264   2HG   PRO  32          2HG       PRO  32   8.616  14.517   0.397
  265   1HD   PRO  32          1HD       PRO  32   7.797  12.007   1.363
  266   2HD   PRO  32          2HD       PRO  32   6.945  13.019   0.178
  267    H    ILE  33           H        ILE  33  11.614  10.682  -2.232
  268    HA   ILE  33           HA       ILE  33  12.671   9.590   0.332
  269    HB   ILE  33           HB       ILE  33  12.754   7.691  -1.924
  270   1HG1  ILE  33          1HG1      ILE  33  10.073   8.386  -0.673
  271   2HG1  ILE  33          2HG1      ILE  33  10.521   8.676  -2.352
  272   1HG2  ILE  33          1HG2      ILE  33  13.075   7.591   0.789
  273   2HG2  ILE  33          2HG2      ILE  33  11.427   6.985   0.621
  274   3HG2  ILE  33          3HG2      ILE  33  12.753   6.184  -0.222
  275   1HD1  ILE  33          1HD1      ILE  33  11.113   5.953  -1.817
  276   2HD1  ILE  33          2HD1      ILE  33   9.505   6.262  -1.161
  277   3HD1  ILE  33          3HD1      ILE  33   9.843   6.593  -2.860
  278    H    SER  34           H        SER  34  14.956   8.766   0.002
  279    HA   SER  34           HA       SER  34  16.452  10.592  -1.735
  280   1HB   SER  34          1HB       SER  34  16.875   9.391   0.667
  281   2HB   SER  34          2HB       SER  34  17.773   8.301  -0.383
  282    HG   SER  34           HG       SER  34  18.297  10.889   0.360
  283    H    GLY  35           H        GLY  35  18.566   8.467  -2.209
  284   1HA   GLY  35          2HA       GLY  35  17.251   6.642  -4.117
  285   2HA   GLY  35          1HA       GLY  35  18.959   6.624  -3.678
  286    H    ASP  36           H        ASP  36  19.790   6.722  -5.777
  287    HA   ASP  36           HA       ASP  36  18.888   8.873  -7.603
  288   1HB   ASP  36          1HB       ASP  36  20.754   9.487  -5.779
  289   2HB   ASP  36          2HB       ASP  36  21.807   8.746  -6.984
  290    HA   PRO  37           HA       PRO  37  18.777   9.285  -9.479
  291   1HB   PRO  37          1HB       PRO  37  17.336   8.297 -11.583
  292   2HB   PRO  37          2HB       PRO  37  18.957   8.993 -11.759
  293   1HG   PRO  37          1HG       PRO  37  18.116   6.151 -11.721
  294   2HG   PRO  37          2HG       PRO  37  19.406   6.937 -12.640
  295   1HD   PRO  37          1HD       PRO  37  19.800   5.432 -10.368
  296   2HD   PRO  37          2HD       PRO  37  20.927   6.665 -10.973
  297    H    ALA  38           H        ALA  38  17.212   6.101 -10.048
  298    HA   ALA  38           HA       ALA  38  15.026   6.960  -8.186
  299   1HB   ALA  38          2HB       ALA  38  14.020   4.914  -9.713
  300   2HB   ALA  38          3HB       ALA  38  13.865   6.623 -10.118
  301   3HB   ALA  38          1HB       ALA  38  15.161   5.660 -10.831
  302    HA   PRO  39           HA       PRO  39  16.451   3.437  -5.851
  303   1HB   PRO  39          1HB       PRO  39  14.771   3.768  -3.725
  304   2HB   PRO  39          2HB       PRO  39  16.206   4.779  -3.980
  305   1HG   PRO  39          1HG       PRO  39  13.359   5.419  -4.373
  306   2HG   PRO  39          2HG       PRO  39  14.718   6.485  -4.004
  307   1HD   PRO  39          1HD       PRO  39  13.496   6.111  -6.515
  308   2HD   PRO  39          2HD       PRO  39  15.001   6.991  -6.185
  309    H    THR  40           H        THR  40  14.919   1.785  -4.356
  310    HA   THR  40           HA       THR  40  12.737   0.866  -6.203
  311    HB   THR  40           HB       THR  40  14.337  -0.930  -4.388
  312    HG1  THR  40           HG1      THR  40  16.003  -0.166  -5.463
  313   1HG2  THR  40          1HG2      THR  40  12.581  -1.170  -6.779
  314   2HG2  THR  40          2HG2      THR  40  13.933  -2.297  -6.666
  315   3HG2  THR  40          3HG2      THR  40  12.728  -2.231  -5.379
  316    H    VAL  41           H        VAL  41  11.203   2.077  -4.874
  317    HA   VAL  41           HA       VAL  41  10.940   1.385  -2.022
  318    HB   VAL  41           HB       VAL  41  10.592   3.672  -2.860
  319   1HG1  VAL  41          1HG1      VAL  41   9.354   2.404  -5.010
  320   2HG1  VAL  41          2HG1      VAL  41   8.010   3.148  -4.148
  321   3HG1  VAL  41          3HG1      VAL  41   9.356   4.141  -4.703
  322   1HG2  VAL  41          1HG2      VAL  41   9.266   2.770  -0.907
  323   2HG2  VAL  41          2HG2      VAL  41   8.512   4.129  -1.740
  324   3HG2  VAL  41          3HG2      VAL  41   7.933   2.488  -2.027
  325    H    ILE  42           H        ILE  42  10.292  -0.768  -1.879
  326    HA   ILE  42           HA       ILE  42   8.143  -1.845  -3.573
  327    HB   ILE  42           HB       ILE  42   9.798  -2.902  -1.260
  328   1HG1  ILE  42          1HG1      ILE  42   9.980  -3.344  -4.259
  329   2HG1  ILE  42          2HG1      ILE  42  11.072  -2.340  -3.305
  330   1HG2  ILE  42          1HG2      ILE  42   7.431  -3.962  -2.510
  331   2HG2  ILE  42          2HG2      ILE  42   8.807  -4.999  -2.886
  332   3HG2  ILE  42          3HG2      ILE  42   8.397  -4.653  -1.206
  333   1HD1  ILE  42          1HD1      ILE  42  10.638  -5.233  -2.584
  334   2HD1  ILE  42          2HD1      ILE  42  11.795  -4.783  -3.836
  335   3HD1  ILE  42          3HD1      ILE  42  12.003  -4.188  -2.189
  336    H    TRP  43           H        TRP  43   6.078  -1.131  -2.992
  337    HA   TRP  43           HA       TRP  43   5.300  -0.495  -0.261
  338   1HB   TRP  43          1HB       TRP  43   3.870  -0.969  -2.891
  339   2HB   TRP  43          2HB       TRP  43   2.986  -0.591  -1.414
  340    HD1  TRP  43           HD1      TRP  43   4.613   1.022  -4.262
  341    HE1  TRP  43           HE1      TRP  43   4.951   3.541  -3.834
  342    HE3  TRP  43           HE3      TRP  43   3.709   1.197   0.765
  343    HZ2  TRP  43           HZ2      TRP  43   4.853   5.385  -1.658
  344    HZ3  TRP  43           HZ3      TRP  43   3.853   3.335   1.998
  345    HH2  TRP  43           HH2      TRP  43   4.418   5.436   0.792
  346    H    GLN  44           H        GLN  44   5.464  -2.294   1.151
  347    HA   GLN  44           HA       GLN  44   4.394  -4.920   0.261
  348   1HB   GLN  44          1HB       GLN  44   6.598  -4.309   1.604
  349   2HB   GLN  44          2HB       GLN  44   5.503  -4.341   2.987
  350   1HG   GLN  44          1HG       GLN  44   6.003  -6.573   2.975
  351   2HG   GLN  44          2HG       GLN  44   4.743  -6.624   1.742
  352   1HE2  GLN  44          2HE2      GLN  44   7.902  -7.581   2.317
  353   2HE2  GLN  44          1HE2      GLN  44   8.441  -7.704   0.712
  354    H    LYS  45           H        LYS  45   2.783  -6.037   1.585
  355    HA   LYS  45           HA       LYS  45   0.995  -4.150   3.082
  356   1HB   LYS  45          1HB       LYS  45  -0.840  -5.531   2.239
  357   2HB   LYS  45          2HB       LYS  45   0.180  -5.037   0.888
  358   1HG   LYS  45          1HG       LYS  45   1.402  -7.367   1.617
  359   2HG   LYS  45          2HG       LYS  45  -0.274  -7.734   2.022
  360   1HD   LYS  45          1HD       LYS  45  -0.196  -8.367  -0.219
  361   2HD   LYS  45          2HD       LYS  45  -0.772  -6.704  -0.347
  362   1HE   LYS  45          1HE       LYS  45   0.980  -6.452  -1.801
  363   2HE   LYS  45          2HE       LYS  45   1.968  -6.359  -0.330
  364   1HZ   LYS  45          1HZ       LYS  45   1.228  -8.884  -1.710
  365   2HZ   LYS  45          2HZ       LYS  45   2.730  -8.113  -1.865
  366   3HZ   LYS  45          3HZ       LYS  45   2.247  -8.732  -0.358
  367    H    ALA  46           H        ALA  46  -0.288  -5.215   4.830
  368    HA   ALA  46           HA       ALA  46   1.030  -7.638   5.985
  369   1HB   ALA  46          3HB       ALA  46   1.717  -6.459   7.800
  370   2HB   ALA  46          2HB       ALA  46   0.181  -5.601   7.920
  371   3HB   ALA  46          1HB       ALA  46   1.431  -5.024   6.816
  372    H    ILE  47           H        ILE  47  -0.842  -8.867   5.405
  373    HA   ILE  47           HA       ILE  47  -3.233  -8.331   7.121
  374    HB   ILE  47           HB       ILE  47  -3.209  -9.066   4.171
  375   1HG1  ILE  47          1HG1      ILE  47  -4.096  -6.510   5.550
  376   2HG1  ILE  47          2HG1      ILE  47  -2.587  -6.696   4.659
  377   1HG2  ILE  47          1HG2      ILE  47  -5.308  -8.998   6.277
  378   2HG2  ILE  47          2HG2      ILE  47  -5.749  -8.315   4.713
  379   3HG2  ILE  47          3HG2      ILE  47  -5.206  -9.989   4.821
  380   1HD1  ILE  47          1HD1      ILE  47  -4.258  -7.586   2.768
  381   2HD1  ILE  47          2HD1      ILE  47  -5.383  -6.539   3.633
  382   3HD1  ILE  47          3HD1      ILE  47  -3.899  -5.870   2.955
  383    H    THR  48           H        THR  48  -0.882 -10.241   7.151
  384    HA   THR  48           HA       THR  48  -2.437 -12.807   7.065
  385    HB   THR  48           HB       THR  48  -0.831 -12.754   5.263
  386    HG1  THR  48           HG1      THR  48   0.404 -14.109   7.422
  387   1HG2  THR  48          1HG2      THR  48   0.887 -11.486   7.353
  388   2HG2  THR  48          2HG2      THR  48   1.684 -12.463   6.119
  389   3HG2  THR  48          3HG2      THR  48   0.704 -11.073   5.648
  390    H    GLN  49           H        GLN  49  -2.208 -11.073   9.378
  391    HA   GLN  49           HA       GLN  49  -0.092 -11.789  11.158
  392   1HB   GLN  49          1HB       GLN  49  -1.737  -9.902  11.363
  393   2HB   GLN  49          2HB       GLN  49  -2.976 -11.083  11.783
  394   1HG   GLN  49          1HG       GLN  49  -2.256 -11.177  13.915
  395   2HG   GLN  49          2HG       GLN  49  -0.603 -11.501  13.393
  396   1HE2  GLN  49          2HE2      GLN  49  -1.746  -9.575  15.517
  397   2HE2  GLN  49          1HE2      GLN  49  -1.046  -8.079  15.129
  398    H    GLY  50           H        GLY  50   0.035 -13.445  12.733
  399   1HA   GLY  50          2HA       GLY  50  -0.634 -16.015  12.305
  400   2HA   GLY  50          1HA       GLY  50  -2.166 -15.406  12.932
  401    H    ASN  51           H        ASN  51   1.289 -15.729  13.717
  402    HA   ASN  51           HA       ASN  51   0.656 -15.347  16.607
  403   1HB   ASN  51          1HB       ASN  51   1.869 -17.782  15.269
  404   2HB   ASN  51          2HB       ASN  51   1.916 -17.512  17.012
  405   1HD2  ASN  51          2HD2      ASN  51  -0.031 -18.711  14.430
  406   2HD2  ASN  51          1HD2      ASN  51  -1.462 -18.928  15.316
  407    H    LYS  52           H        LYS  52   1.958 -13.348  16.074
  408    HA   LYS  52           HA       LYS  52   4.698 -13.478  15.219
  409   1HB   LYS  52          1HB       LYS  52   4.730 -11.167  15.946
  410   2HB   LYS  52          2HB       LYS  52   3.139 -11.490  15.257
  411   1HG   LYS  52          1HG       LYS  52   2.825 -12.188  17.927
  412   2HG   LYS  52          2HG       LYS  52   3.865 -10.765  18.000
  413   1HD   LYS  52          1HD       LYS  52   1.524 -10.662  16.152
  414   2HD   LYS  52          2HD       LYS  52   1.200 -10.549  17.882
  415   1HE   LYS  52          1HE       LYS  52   3.463  -8.871  17.207
  416   2HE   LYS  52          2HE       LYS  52   2.067  -8.455  16.192
  417   1HZ   LYS  52          1HZ       LYS  52   2.004  -8.808  19.143
  418   2HZ   LYS  52          2HZ       LYS  52   1.969  -7.317  18.337
  419   3HZ   LYS  52          3HZ       LYS  52   0.677  -8.407  18.162
  420    H    ALA  53           H        ALA  53   5.983 -12.002  17.269
  421    HA   ALA  53           HA       ALA  53   7.162 -14.016  18.867
  422   1HB   ALA  53          2HB       ALA  53   7.057 -11.304  20.026
  423   2HB   ALA  53          1HB       ALA  53   7.525 -11.342  18.325
  424   3HB   ALA  53          3HB       ALA  53   8.455 -12.252  19.516
  425    HA   PRO  54           HA       PRO  54   4.515 -14.579  22.328
  426   1HB   PRO  54          1HB       PRO  54   6.147 -14.315  24.510
  427   2HB   PRO  54          2HB       PRO  54   6.209 -15.714  23.419
  428   1HG   PRO  54          1HG       PRO  54   7.984 -13.328  23.538
  429   2HG   PRO  54          2HG       PRO  54   8.391 -15.024  23.238
  430   1HD   PRO  54          1HD       PRO  54   8.204 -13.157  21.265
  431   2HD   PRO  54          2HD       PRO  54   7.892 -14.887  21.008
  432    H    ALA  55           H        ALA  55   3.592 -13.496  24.331
  433    HA   ALA  55           HA       ALA  55   2.719 -11.586  25.412
  434   1HB   ALA  55          1HB       ALA  55   5.439 -11.448  25.467
  435   2HB   ALA  55          3HB       ALA  55   4.393 -10.249  26.227
  436   3HB   ALA  55          2HB       ALA  55   5.063  -9.946  24.623
  437    H    ARG  56           H        ARG  56   1.001 -10.833  24.198
  438    HA   ARG  56           HA       ARG  56   1.634  -9.071  21.852
  439   1HB   ARG  56          1HB       ARG  56  -0.634  -9.830  21.053
  440   2HB   ARG  56          2HB       ARG  56   0.543 -11.135  21.200
  441   1HG   ARG  56          1HG       ARG  56  -0.918 -10.684  23.694
  442   2HG   ARG  56          2HG       ARG  56  -1.992 -11.089  22.354
  443   1HD   ARG  56          1HD       ARG  56  -0.095 -12.938  21.902
  444   2HD   ARG  56          2HD       ARG  56   0.117 -12.754  23.654
  445    HE   ARG  56           HE       ARG  56  -2.679 -12.885  23.093
  446   1HH1  ARG  56          1HH1      ARG  56  -1.260 -14.543  25.161
  447   2HH1  ARG  56          2HH1      ARG  56  -1.455 -16.145  24.531
  448   1HH2  ARG  56          1HH2      ARG  56  -2.320 -15.072  21.348
  449   2HH2  ARG  56          2HH2      ARG  56  -2.055 -16.445  22.371
  450    HA   PRO  57           HA       PRO  57  -0.445  -6.422  24.953
  451   1HB   PRO  57          1HB       PRO  57   1.075  -4.202  24.464
  452   2HB   PRO  57          2HB       PRO  57   1.575  -5.487  25.580
  453   1HG   PRO  57          1HG       PRO  57   2.481  -4.926  22.816
  454   2HG   PRO  57          2HG       PRO  57   3.379  -5.586  24.190
  455   1HD   PRO  57          1HD       PRO  57   2.374  -7.070  22.080
  456   2HD   PRO  57          2HD       PRO  57   2.819  -7.725  23.669
  457    H    ALA  58           H        ALA  58  -1.648  -4.337  24.547
  458    HA   ALA  58           HA       ALA  58  -2.211  -3.912  21.629
  459   1HB   ALA  58          3HB       ALA  58  -4.152  -4.964  22.253
  460   2HB   ALA  58          1HB       ALA  58  -3.921  -4.585  23.959
  461   3HB   ALA  58          2HB       ALA  58  -4.573  -3.365  22.866
  462    HA   PRO  59           HA       PRO  59  -1.105   0.116  23.555
  463   1HB   PRO  59          1HB       PRO  59   0.206   1.088  21.358
  464   2HB   PRO  59          2HB       PRO  59   0.991   0.063  22.576
  465   1HG   PRO  59          1HG       PRO  59  -0.067  -0.660  19.891
  466   2HG   PRO  59          2HG       PRO  59   1.389  -1.229  20.723
  467   1HD   PRO  59          1HD       PRO  59  -0.923  -2.673  20.563
  468   2HD   PRO  59          2HD       PRO  59   0.253  -2.837  21.886
  469    H    ASP  60           H        ASP  60  -2.285   2.030  23.269
  470    HA   ASP  60           HA       ASP  60  -4.028   3.408  22.458
  471   1HB   ASP  60          1HB       ASP  60  -2.860   2.355  19.856
  472   2HB   ASP  60          2HB       ASP  60  -3.877   3.788  20.009
  473    H    ALA  61           H        ALA  61  -5.331   1.357  23.379
  474    HA   ALA  61           HA       ALA  61  -6.543  -0.644  21.912
  475   1HB   ALA  61          1HB       ALA  61  -7.278   1.148  24.147
  476   2HB   ALA  61          2HB       ALA  61  -8.641   0.342  23.369
  477   3HB   ALA  61          3HB       ALA  61  -7.328  -0.612  24.057
  478    HA   PRO  62           HA       PRO  62  -8.537   2.113  18.916
  479   1HB   PRO  62          1HB       PRO  62  -7.968   0.599  16.716
  480   2HB   PRO  62          2HB       PRO  62  -6.806   1.723  17.434
  481   1HG   PRO  62          1HG       PRO  62  -6.802  -1.193  17.437
  482   2HG   PRO  62          2HG       PRO  62  -5.486  -0.064  17.781
  483   1HD   PRO  62          1HD       PRO  62  -7.139  -1.525  19.643
  484   2HD   PRO  62          2HD       PRO  62  -5.735  -0.491  19.980
  485    H    GLU  63           H        GLU  63 -10.751   1.900  18.949
  486    HA   GLU  63           HA       GLU  63 -12.064  -0.705  19.092
  487   1HB   GLU  63          1HB       GLU  63 -12.640   2.104  19.493
  488   2HB   GLU  63          2HB       GLU  63 -13.911   1.363  18.522
  489   1HG   GLU  63          1HG       GLU  63 -12.945  -0.147  20.909
  490   2HG   GLU  63          2HG       GLU  63 -13.959   1.268  21.194
  491    H    ASP  64           H        ASP  64 -11.808  -1.858  17.156
  492    HA   ASP  64           HA       ASP  64 -12.468  -0.487  14.590
  493   1HB   ASP  64          1HB       ASP  64 -11.432  -2.525  13.619
  494   2HB   ASP  64          2HB       ASP  64 -10.361  -1.756  14.790
  495    H    THR  65           H        THR  65 -13.912  -1.699  13.072
  496    HA   THR  65           HA       THR  65 -16.221  -2.857  14.532
  497    HB   THR  65           HB       THR  65 -17.237  -2.585  12.202
  498    HG1  THR  65           HG1      THR  65 -15.350  -2.635  11.005
  499   1HG2  THR  65          1HG2      THR  65 -16.015  -0.269  13.708
  500   2HG2  THR  65          2HG2      THR  65 -17.110  -0.033  12.346
  501   3HG2  THR  65          3HG2      THR  65 -17.672  -0.869  13.795
  502    H    GLY  66           H        GLY  66 -13.505  -4.257  13.693
  503   1HA   GLY  66          2HA       GLY  66 -14.579  -6.874  13.347
  504   2HA   GLY  66          1HA       GLY  66 -12.897  -6.429  13.054
  505    H    ASP  67           H        ASP  67 -13.747  -8.242  11.332
  506    HA   ASP  67           HA       ASP  67 -15.144  -7.192   9.006
  507   1HB   ASP  67          1HB       ASP  67 -12.439  -6.464   9.395
  508   2HB   ASP  67          2HB       ASP  67 -12.424  -7.698   8.136
  509    H    SER  68           H        SER  68 -13.932  -8.779   7.038
  510    HA   SER  68           HA       SER  68 -14.061 -10.991   6.216
  511   1HB   SER  68          1HB       SER  68 -12.493 -12.379   7.296
  512   2HB   SER  68          2HB       SER  68 -11.979 -10.762   7.771
  513    HG   SER  68           HG       SER  68 -12.717 -11.098   9.759
  514    H    ASP  69           H        ASP  69 -16.395 -10.004   7.803
  515    HA   ASP  69           HA       ASP  69 -17.410 -11.977   9.593
  516   1HB   ASP  69          1HB       ASP  69 -18.707 -10.013   7.681
  517   2HB   ASP  69          2HB       ASP  69 -19.618 -10.932   8.880
  518    H    GLU  70           H        GLU  70 -18.589 -11.483   6.247
  519    HA   GLU  70           HA       GLU  70 -19.588 -14.222   6.088
  520   1HB   GLU  70          1HB       GLU  70 -19.296 -11.912   4.143
  521   2HB   GLU  70          2HB       GLU  70 -20.080 -13.435   3.720
  522   1HG   GLU  70          1HG       GLU  70 -21.909 -13.026   5.053
  523   2HG   GLU  70          2HG       GLU  70 -20.975 -12.107   6.234
  524    H    TRP  71           H        TRP  71 -18.946 -15.184   3.657
  525    HA   TRP  71           HA       TRP  71 -16.018 -15.702   3.868
  526   1HB   TRP  71          1HB       TRP  71 -17.738 -17.534   3.913
  527   2HB   TRP  71          2HB       TRP  71 -18.184 -17.090   2.264
  528    HD1  TRP  71           HD1      TRP  71 -16.802 -18.082   0.377
  529    HE1  TRP  71           HE1      TRP  71 -14.625 -19.459   0.231
  530    HE3  TRP  71           HE3      TRP  71 -15.297 -17.842   5.240
  531    HZ2  TRP  71           HZ2      TRP  71 -12.527 -20.334   1.960
  532    HZ3  TRP  71           HZ3      TRP  71 -13.205 -18.950   5.967
  533    HH2  TRP  71           HH2      TRP  71 -11.815 -20.197   4.334
  534    H    VAL  72           H        VAL  72 -15.124 -13.914   2.738
  535    HA   VAL  72           HA       VAL  72 -16.114 -12.823   0.288
  536    HB   VAL  72           HB       VAL  72 -14.521 -11.694   1.753
  537   1HG1  VAL  72          1HG1      VAL  72 -12.956 -14.189   1.272
  538   2HG1  VAL  72          2HG1      VAL  72 -12.052 -12.687   1.467
  539   3HG1  VAL  72          3HG1      VAL  72 -13.131 -13.241   2.749
  540   1HG2  VAL  72          1HG2      VAL  72 -14.472 -11.330  -0.781
  541   2HG2  VAL  72          2HG2      VAL  72 -13.029 -10.833   0.102
  542   3HG2  VAL  72          3HG2      VAL  72 -13.035 -12.351  -0.796
  543    H    PHE  73           H        PHE  73 -14.872 -12.985  -1.826
  544    HA   PHE  73           HA       PHE  73 -14.165 -15.848  -2.374
  545   1HB   PHE  73          1HB       PHE  73 -16.129 -14.246  -3.428
  546   2HB   PHE  73          2HB       PHE  73 -14.830 -14.018  -4.600
  547    HD1  PHE  73           HD1      PHE  73 -14.625 -15.561  -6.334
  548    HD2  PHE  73           HD2      PHE  73 -16.493 -16.772  -2.660
  549    HE1  PHE  73           HE1      PHE  73 -15.123 -17.780  -7.320
  550    HE2  PHE  73           HE2      PHE  73 -16.992 -18.992  -3.647
  551    HZ   PHE  73           HZ       PHE  73 -16.307 -19.497  -5.976
  552    H    ASP  74           H        ASP  74 -12.934 -15.518  -4.833
  553    HA   ASP  74           HA       ASP  74 -10.810 -13.478  -4.605
  554   1HB   ASP  74          1HB       ASP  74  -9.041 -15.223  -4.495
  555   2HB   ASP  74          2HB       ASP  74 -10.098 -15.280  -3.086
  556    H    LYS  75           H        LYS  75  -9.017 -14.376  -6.419
  557    HA   LYS  75           HA       LYS  75  -8.670 -14.549  -8.750
  558   1HB   LYS  75          1HB       LYS  75 -10.432 -16.675  -7.799
  559   2HB   LYS  75          2HB       LYS  75 -10.704 -16.320  -9.506
  560   1HG   LYS  75          1HG       LYS  75  -8.464 -16.795 -10.084
  561   2HG   LYS  75          2HG       LYS  75  -7.912 -16.657  -8.414
  562   1HD   LYS  75          1HD       LYS  75  -8.526 -18.792  -7.897
  563   2HD   LYS  75          2HD       LYS  75  -9.985 -18.717  -8.886
  564   1HE   LYS  75          1HE       LYS  75  -7.349 -18.713 -10.309
  565   2HE   LYS  75          2HE       LYS  75  -7.929 -20.245  -9.627
  566   1HZ   LYS  75          1HZ       LYS  75  -9.613 -18.435 -11.272
  567   2HZ   LYS  75          2HZ       LYS  75  -8.767 -19.762 -11.914
  568   3HZ   LYS  75          3HZ       LYS  75  -9.987 -20.013 -10.763
  569    H    LYS  76           H        LYS  76 -10.404 -14.841 -10.881
  570    HA   LYS  76           HA       LYS  76 -11.826 -13.558 -12.265
  571   1HB   LYS  76          1HB       LYS  76 -13.182 -14.480 -10.083
  572   2HB   LYS  76          2HB       LYS  76 -13.469 -12.746  -9.935
  573   1HG   LYS  76          1HG       LYS  76 -15.062 -12.926 -11.516
  574   2HG   LYS  76          2HG       LYS  76 -13.807 -13.356 -12.675
  575   1HD   LYS  76          1HD       LYS  76 -14.128 -15.728 -11.357
  576   2HD   LYS  76          2HD       LYS  76 -15.768 -15.083 -11.295
  577   1HE   LYS  76          1HE       LYS  76 -15.968 -15.954 -13.400
  578   2HE   LYS  76          2HE       LYS  76 -15.015 -14.546 -13.908
  579   1HZ   LYS  76          1HZ       LYS  76 -12.993 -15.833 -13.371
  580   2HZ   LYS  76          2HZ       LYS  76 -13.961 -17.196 -13.070
  581   3HZ   LYS  76          3HZ       LYS  76 -13.894 -16.527 -14.631
  582    H    LEU  77           H        LEU  77  -9.556 -12.189 -10.800
  583    HA   LEU  77           HA       LEU  77 -10.633  -9.455 -10.363
  584   1HB   LEU  77          1HB       LEU  77  -8.650 -11.019  -9.212
  585   2HB   LEU  77          2HB       LEU  77  -7.732  -9.904 -10.223
  586    HG   LEU  77           HG       LEU  77  -8.051  -8.947  -7.986
  587   1HD1  LEU  77          1HD1      LEU  77  -8.387  -7.638 -10.308
  588   2HD1  LEU  77          2HD1      LEU  77  -9.979  -7.352  -9.605
  589   3HD1  LEU  77          3HD1      LEU  77  -8.529  -6.832  -8.747
  590   1HD2  LEU  77          1HD2      LEU  77 -10.779  -9.929  -8.440
  591   2HD2  LEU  77          2HD2      LEU  77  -9.958  -9.559  -6.924
  592   3HD2  LEU  77          3HD2      LEU  77 -10.739  -8.271  -7.840
  593    H    LEU  78           H        LEU  78 -10.150  -7.731 -11.749
  594    HA   LEU  78           HA       LEU  78  -9.427  -8.346 -14.493
  595   1HB   LEU  78          1HB       LEU  78  -9.798  -5.766 -12.937
  596   2HB   LEU  78          2HB       LEU  78  -9.630  -5.847 -14.692
  597    HG   LEU  78           HG       LEU  78 -11.592  -7.719 -14.226
  598   1HD1  LEU  78          1HD1      LEU  78 -11.676  -5.602 -12.102
  599   2HD1  LEU  78          2HD1      LEU  78 -13.195  -6.189 -12.780
  600   3HD1  LEU  78          3HD1      LEU  78 -12.089  -7.313 -11.991
  601   1HD2  LEU  78          1HD2      LEU  78 -11.527  -5.892 -15.938
  602   2HD2  LEU  78          2HD2      LEU  78 -13.107  -6.060 -15.173
  603   3HD2  LEU  78          3HD2      LEU  78 -12.027  -4.751 -14.689
  604    H    CYS  79           H        CYS  79  -7.835  -6.359 -11.964
  605    HA   CYS  79           HA       CYS  79  -5.367  -6.138 -13.528
  606   1HB   CYS  79          1HB       CYS  79  -6.451  -5.238 -10.883
  607   2HB   CYS  79          2HB       CYS  79  -4.707  -5.173 -11.139
  608    HG   CYS  79           HG       CYS  79  -6.005  -2.936 -11.978
  609    H    GLU  80           H        GLU  80  -6.683  -8.526 -11.476
  610    HA   GLU  80           HA       GLU  80  -5.748 -10.448 -10.471
  611   1HB   GLU  80          1HB       GLU  80  -4.584  -9.973 -12.958
  612   2HB   GLU  80          2HB       GLU  80  -3.198 -10.236 -11.900
  613   1HG   GLU  80          1HG       GLU  80  -5.495 -12.108 -11.592
  614   2HG   GLU  80          2HG       GLU  80  -4.525 -12.271 -13.057
  615    H    THR  81           H        THR  81  -5.421  -8.141  -8.929
  616    HA   THR  81           HA       THR  81  -2.684  -8.556  -7.773
  617    HB   THR  81           HB       THR  81  -2.981  -6.031  -7.193
  618    HG1  THR  81           HG1      THR  81  -4.323  -5.012  -8.797
  619   1HG2  THR  81          1HG2      THR  81  -2.358  -7.267  -9.844
  620   2HG2  THR  81          2HG2      THR  81  -2.410  -5.509  -9.729
  621   3HG2  THR  81          3HG2      THR  81  -1.289  -6.425  -8.723
  622    H    GLU  82           H        GLU  82  -5.402  -6.511  -6.724
  623    HA   GLU  82           HA       GLU  82  -6.362  -8.314  -4.673
  624   1HB   GLU  82          1HB       GLU  82  -5.344  -7.092  -2.753
  625   2HB   GLU  82          2HB       GLU  82  -4.119  -7.837  -3.780
  626   1HG   GLU  82          1HG       GLU  82  -4.016  -5.576  -5.006
  627   2HG   GLU  82          2HG       GLU  82  -4.911  -4.926  -3.632
  628    H    GLY  83           H        GLY  83  -7.483  -6.523  -6.663
  629   1HA   GLY  83          2HA       GLY  83  -8.889  -4.577  -4.876
  630   2HA   GLY  83          1HA       GLY  83  -9.708  -5.461  -6.164
  631    H    ARG  84           H        ARG  84  -7.591  -5.183  -8.115
  632    HA   ARG  84           HA       ARG  84  -6.831  -3.656  -9.753
  633   1HB   ARG  84          1HB       ARG  84  -9.514  -2.812  -8.788
  634   2HB   ARG  84          2HB       ARG  84  -8.630  -1.626  -9.748
  635   1HG   ARG  84          1HG       ARG  84  -8.217  -3.947 -11.176
  636   2HG   ARG  84          2HG       ARG  84  -9.864  -4.163 -10.581
  637   1HD   ARG  84          1HD       ARG  84  -9.219  -1.465 -11.665
  638   2HD   ARG  84          2HD       ARG  84  -9.330  -2.786 -12.845
  639    HE   ARG  84           HE       ARG  84 -11.502  -2.906 -10.933
  640   1HH1  ARG  84          1HH1      ARG  84 -12.796  -0.731 -11.308
  641   2HH1  ARG  84          2HH1      ARG  84 -13.284  -0.565 -12.962
  642   1HH2  ARG  84          1HH2      ARG  84 -11.060  -2.952 -14.134
  643   2HH2  ARG  84          2HH2      ARG  84 -12.300  -1.822 -14.562
  644    H    VAL  85           H        VAL  85  -4.905  -3.070  -8.474
  645    HA   VAL  85           HA       VAL  85  -5.109  -0.311  -7.315
  646    HB   VAL  85           HB       VAL  85  -4.869  -2.071  -5.596
  647   1HG1  VAL  85          1HG1      VAL  85  -3.232  -3.289  -7.528
  648   2HG1  VAL  85          2HG1      VAL  85  -2.134  -2.835  -6.226
  649   3HG1  VAL  85          3HG1      VAL  85  -3.527  -3.861  -5.887
  650   1HG2  VAL  85          1HG2      VAL  85  -2.890   0.040  -6.106
  651   2HG2  VAL  85          2HG2      VAL  85  -3.755  -0.354  -4.621
  652   3HG2  VAL  85          3HG2      VAL  85  -2.287  -1.234  -5.046
  653    H    ARG  86           H        ARG  86  -3.719   1.136  -8.239
  654    HA   ARG  86           HA       ARG  86  -1.523   0.057  -9.976
  655   1HB   ARG  86          1HB       ARG  86  -3.707   1.666 -10.561
  656   2HB   ARG  86          2HB       ARG  86  -2.399   2.834 -10.370
  657   1HG   ARG  86          1HG       ARG  86  -1.137   1.902 -12.110
  658   2HG   ARG  86          2HG       ARG  86  -1.972   0.351 -12.014
  659   1HD   ARG  86          1HD       ARG  86  -4.093   1.761 -12.692
  660   2HD   ARG  86          2HD       ARG  86  -2.886   2.909 -13.305
  661    HE   ARG  86           HE       ARG  86  -2.103   0.316 -14.154
  662   1HH1  ARG  86          1HH1      ARG  86  -5.166   0.299 -14.490
  663   2HH1  ARG  86          2HH1      ARG  86  -5.305   0.799 -16.143
  664   1HH2  ARG  86          1HH2      ARG  86  -2.042   1.956 -16.344
  665   2HH2  ARG  86          2HH2      ARG  86  -3.537   1.738 -17.193
  666    H    VAL  87           H        VAL  87   0.380   0.256  -8.838
  667    HA   VAL  87           HA       VAL  87   0.852   2.823  -7.354
  668    HB   VAL  87           HB       VAL  87   1.834   0.004  -6.795
  669   1HG1  VAL  87          1HG1      VAL  87   2.425   2.688  -5.598
  670   2HG1  VAL  87          2HG1      VAL  87   2.381   1.278  -4.541
  671   3HG1  VAL  87          3HG1      VAL  87   3.514   1.332  -5.892
  672   1HG2  VAL  87          1HG2      VAL  87  -0.347   1.734  -5.624
  673   2HG2  VAL  87          2HG2      VAL  87  -0.450   0.062  -6.177
  674   3HG2  VAL  87          3HG2      VAL  87   0.399   0.445  -4.678
  675    H    GLU  88           H        GLU  88   2.522   3.995  -8.201
  676    HA   GLU  88           HA       GLU  88   4.752   2.548  -9.574
  677   1HB   GLU  88          1HB       GLU  88   2.766   4.478 -10.627
  678   2HB   GLU  88          2HB       GLU  88   4.438   4.798 -11.091
  679   1HG   GLU  88          1HG       GLU  88   4.626   2.843 -12.301
  680   2HG   GLU  88          2HG       GLU  88   3.462   1.983 -11.292
  681    H    THR  89           H        THR  89   6.767   3.688  -9.476
  682    HA   THR  89           HA       THR  89   6.815   5.931  -7.488
  683    HB   THR  89           HB       THR  89   7.894   3.720  -6.926
  684    HG1  THR  89           HG1      THR  89   9.986   4.777  -6.453
  685   1HG2  THR  89          1HG2      THR  89   8.738   3.732  -9.513
  686   2HG2  THR  89          2HG2      THR  89  10.185   4.326  -8.696
  687   3HG2  THR  89          3HG2      THR  89   9.492   2.768  -8.242
  688    H    THR  90           H        THR  90   8.352   7.659  -7.904
  689    HA   THR  90           HA       THR  90   8.916   8.039 -10.821
  690    HB   THR  90           HB       THR  90   8.955  10.469 -10.110
  691    HG1  THR  90           HG1      THR  90   7.822   9.514  -7.711
  692   1HG2  THR  90          1HG2      THR  90   6.920   9.287 -11.005
  693   2HG2  THR  90          2HG2      THR  90   6.421   9.001  -9.339
  694   3HG2  THR  90          3HG2      THR  90   6.552  10.651  -9.949
  695    H    LYS  91           H        LYS  91  10.812  10.002 -10.716
  696    HA   LYS  91           HA       LYS  91  13.273   8.704 -10.406
  697   1HB   LYS  91          1HB       LYS  91  12.228  11.384 -10.811
  698   2HB   LYS  91          2HB       LYS  91  13.701  11.431  -9.842
  699   1HG   LYS  91          1HG       LYS  91  15.009  10.778 -11.580
  700   2HG   LYS  91          2HG       LYS  91  13.836   9.581 -12.131
  701   1HD   LYS  91          1HD       LYS  91  12.796  11.050 -13.547
  702   2HD   LYS  91          2HD       LYS  91  13.061  12.428 -12.477
  703   1HE   LYS  91          1HE       LYS  91  14.425  12.666 -14.524
  704   2HE   LYS  91          2HE       LYS  91  15.485  12.409 -13.124
  705   1HZ   LYS  91          1HZ       LYS  91  14.447  10.206 -14.820
  706   2HZ   LYS  91          2HZ       LYS  91  15.963  10.928 -15.061
  707   3HZ   LYS  91          3HZ       LYS  91  15.636  10.104 -13.611
  708    H    ASP  92           H        ASP  92  11.478  10.595  -7.971
  709    HA   ASP  92           HA       ASP  92  13.041   9.271  -5.835
  710   1HB   ASP  92          1HB       ASP  92  13.737  11.796  -6.911
  711   2HB   ASP  92          2HB       ASP  92  12.994  12.124  -5.346
  712    H    ARG  93           H        ARG  93  10.308   8.959  -6.388
  713    HA   ARG  93           HA       ARG  93   9.123   9.849  -3.871
  714   1HB   ARG  93          1HB       ARG  93   9.134  11.752  -5.743
  715   2HB   ARG  93          2HB       ARG  93   7.704  10.880  -6.295
  716   1HG   ARG  93          1HG       ARG  93   6.714  11.069  -4.045
  717   2HG   ARG  93          2HG       ARG  93   8.140  11.945  -3.490
  718   1HD   ARG  93          1HD       ARG  93   6.437  13.588  -4.049
  719   2HD   ARG  93          2HD       ARG  93   7.673  13.653  -5.323
  720    HE   ARG  93           HE       ARG  93   5.531  11.726  -5.854
  721   1HH1  ARG  93          1HH1      ARG  93   5.996  12.295  -8.317
  722   2HH1  ARG  93          2HH1      ARG  93   5.309  13.827  -8.743
  723   1HH2  ARG  93          1HH2      ARG  93   4.921  14.866  -5.457
  724   2HH2  ARG  93          2HH2      ARG  93   4.700  15.282  -7.124
  725    H    SER  94           H        SER  94   8.354   7.777  -3.457
  726    HA   SER  94           HA       SER  94   7.132   6.087  -5.491
  727   1HB   SER  94          1HB       SER  94   6.819   4.591  -3.608
  728   2HB   SER  94          2HB       SER  94   8.389   5.366  -3.423
  729    HG   SER  94           HG       SER  94   7.607   5.881  -1.535
  730    H    ILE  95           H        ILE  95   5.037   6.302  -6.202
  731    HA   ILE  95           HA       ILE  95   3.137   7.820  -4.462
  732    HB   ILE  95           HB       ILE  95   3.953   8.119  -7.126
  733   1HG1  ILE  95          1HG1      ILE  95   1.296   9.196  -6.285
  734   2HG1  ILE  95          2HG1      ILE  95   2.704   9.629  -5.311
  735   1HG2  ILE  95          1HG2      ILE  95   2.492   6.208  -7.754
  736   2HG2  ILE  95          2HG2      ILE  95   1.114   7.048  -7.042
  737   3HG2  ILE  95          3HG2      ILE  95   1.926   7.725  -8.453
  738   1HD1  ILE  95          1HD1      ILE  95   2.844   9.862  -8.302
  739   2HD1  ILE  95          2HD1      ILE  95   2.054  11.129  -7.365
  740   3HD1  ILE  95          3HD1      ILE  95   3.751  10.747  -7.075
  741    H    PHE  96           H        PHE  96   1.259   6.838  -3.802
  742    HA   PHE  96           HA       PHE  96   0.695   4.084  -4.849
  743   1HB   PHE  96          1HB       PHE  96   1.535   4.256  -2.482
  744   2HB   PHE  96          2HB       PHE  96   0.129   5.246  -2.099
  745    HD1  PHE  96           HD1      PHE  96  -2.204   4.235  -2.732
  746    HD2  PHE  96           HD2      PHE  96   1.387   1.927  -2.286
  747    HE1  PHE  96           HE1      PHE  96  -3.563   2.193  -2.401
  748    HE2  PHE  96           HE2      PHE  96   0.024  -0.123  -1.957
  749    HZ   PHE  96           HZ       PHE  96  -2.459   0.016  -2.018
  750    H    THR  97           H        THR  97  -0.884   4.658  -6.376
  751    HA   THR  97           HA       THR  97  -3.289   6.086  -5.293
  752    HB   THR  97           HB       THR  97  -2.301   7.597  -6.805
  753    HG1  THR  97           HG1      THR  97  -4.034   7.736  -7.944
  754   1HG2  THR  97          1HG2      THR  97  -1.699   5.217  -8.585
  755   2HG2  THR  97          2HG2      THR  97  -1.363   6.898  -9.002
  756   3HG2  THR  97          3HG2      THR  97  -0.529   6.144  -7.645
  757    H    VAL  98           H        VAL  98  -4.774   4.484  -5.011
  758    HA   VAL  98           HA       VAL  98  -5.149   2.489  -7.220
  759    HB   VAL  98           HB       VAL  98  -4.246   1.474  -5.206
  760   1HG1  VAL  98          1HG1      VAL  98  -6.502   2.930  -3.802
  761   2HG1  VAL  98          2HG1      VAL  98  -5.518   1.678  -3.043
  762   3HG1  VAL  98          3HG1      VAL  98  -4.771   3.183  -3.578
  763   1HG2  VAL  98          1HG2      VAL  98  -6.574   0.659  -6.410
  764   2HG2  VAL  98          2HG2      VAL  98  -5.708  -0.273  -5.188
  765   3HG2  VAL  98          3HG2      VAL  98  -7.066   0.749  -4.720
  766    H    GLU  99           H        GLU  99  -7.256   2.234  -7.971
  767    HA   GLU  99           HA       GLU  99  -9.309   4.077  -6.822
  768   1HB   GLU  99          1HB       GLU  99 -10.349   3.808  -9.075
  769   2HB   GLU  99          2HB       GLU  99  -8.692   4.400  -9.178
  770   1HG   GLU  99          1HG       GLU  99  -7.894   2.431 -10.067
  771   2HG   GLU  99          2HG       GLU  99  -9.091   1.443  -9.229
  772    H    GLY 100           H        GLY 100  -8.810   1.659  -5.464
  773   1HA   GLY 100          2HA       GLY 100 -10.270  -0.615  -6.118
  774   2HA   GLY 100          1HA       GLY 100 -11.465   0.497  -5.444
  775    H    ALA 101           H        ALA 101  -9.283   1.694  -3.700
  776    HA   ALA 101           HA       ALA 101  -8.285  -0.366  -1.946
  777   1HB   ALA 101          1HB       ALA 101  -7.334   1.903  -2.195
  778   2HB   ALA 101          2HB       ALA 101  -8.808   2.594  -1.518
  779   3HB   ALA 101          3HB       ALA 101  -7.766   1.582  -0.516
  780    H    GLU 102           H        GLU 102 -10.206  -1.635  -1.521
  781    HA   GLU 102           HA       GLU 102 -12.420  -0.354  -0.015
  782   1HB   GLU 102          1HB       GLU 102 -12.295  -2.276  -1.950
  783   2HB   GLU 102          2HB       GLU 102 -12.360  -3.276  -0.499
  784   1HG   GLU 102          1HG       GLU 102 -14.626  -2.967  -0.869
  785   2HG   GLU 102          2HG       GLU 102 -14.295  -1.579   0.168
  786    H    LYS 103           H        LYS 103 -13.242  -2.096   1.787
  787    HA   LYS 103           HA       LYS 103 -11.549  -1.908   4.025
  788   1HB   LYS 103          1HB       LYS 103 -13.973  -3.348   3.186
  789   2HB   LYS 103          2HB       LYS 103 -13.075  -4.178   4.458
  790   1HG   LYS 103          1HG       LYS 103 -13.215  -2.312   5.923
  791   2HG   LYS 103          2HG       LYS 103 -13.715  -1.229   4.623
  792   1HD   LYS 103          1HD       LYS 103 -15.885  -2.082   4.564
  793   2HD   LYS 103          2HD       LYS 103 -15.408  -3.618   5.288
  794   1HE   LYS 103          1HE       LYS 103 -14.849  -2.253   7.408
  795   2HE   LYS 103          2HE       LYS 103 -15.788  -0.947   6.657
  796   1HZ   LYS 103          1HZ       LYS 103 -16.739  -3.737   7.047
  797   2HZ   LYS 103          2HZ       LYS 103 -17.199  -2.409   8.001
  798   3HZ   LYS 103          3HZ       LYS 103 -17.632  -2.464   6.362
  799    H    GLU 104           H        GLU 104 -11.690  -4.413   1.530
  800    HA   GLU 104           HA       GLU 104 -10.056  -6.377   2.840
  801   1HB   GLU 104          1HB       GLU 104  -9.780  -7.206   0.495
  802   2HB   GLU 104          2HB       GLU 104 -11.459  -6.835   0.887
  803   1HG   GLU 104          1HG       GLU 104 -11.564  -5.172  -0.647
  804   2HG   GLU 104          2HG       GLU 104  -9.993  -4.525  -0.175
  805    H    ASP 105           H        ASP 105  -9.293  -3.344   1.315
  806    HA   ASP 105           HA       ASP 105  -6.439  -4.019   0.933
  807   1HB   ASP 105          1HB       ASP 105  -8.363  -2.179  -0.099
  808   2HB   ASP 105          2HB       ASP 105  -7.077  -1.228   0.646
  809    H    GLU 106           H        GLU 106  -8.514  -2.203   3.148
  810    HA   GLU 106           HA       GLU 106  -6.664  -0.628   4.552
  811   1HB   GLU 106          1HB       GLU 106  -9.259  -1.066   4.741
  812   2HB   GLU 106          2HB       GLU 106  -8.772  -2.223   5.978
  813   1HG   GLU 106          1HG       GLU 106  -7.602  -0.476   7.213
  814   2HG   GLU 106          2HG       GLU 106  -7.952   0.694   5.941
  815    H    GLY 107           H        GLY 107  -5.808  -1.125   6.820
  816   1HA   GLY 107          2HA       GLY 107  -4.626  -3.867   6.854
  817   2HA   GLY 107          1HA       GLY 107  -5.272  -3.144   8.329
  818    H    VAL 108           H        VAL 108  -2.439  -3.763   6.867
  819    HA   VAL 108           HA       VAL 108  -1.152  -1.166   7.588
  820    HB   VAL 108           HB       VAL 108  -0.554  -3.930   8.680
  821   1HG1  VAL 108          1HG1      VAL 108   1.137  -1.482   8.467
  822   2HG1  VAL 108          2HG1      VAL 108   1.179  -2.354  10.000
  823   3HG1  VAL 108          3HG1      VAL 108   1.618  -3.178   8.505
  824   1HG2  VAL 108          1HG2      VAL 108  -1.537  -1.315   9.814
  825   2HG2  VAL 108          2HG2      VAL 108  -2.246  -2.922   9.981
  826   3HG2  VAL 108          3HG2      VAL 108  -0.764  -2.517  10.848
  827    H    TYR 109           H        TYR 109   0.896  -0.861   6.553
  828    HA   TYR 109           HA       TYR 109   1.689  -2.924   4.531
  829   1HB   TYR 109          1HB       TYR 109   1.048   0.008   4.151
  830   2HB   TYR 109          2HB       TYR 109   2.005  -0.895   2.981
  831    HD1  TYR 109           HD1      TYR 109   0.984  -2.335   1.404
  832    HD2  TYR 109           HD2      TYR 109  -1.297  -0.828   4.718
  833    HE1  TYR 109           HE1      TYR 109  -1.091  -3.230   0.383
  834    HE2  TYR 109           HE2      TYR 109  -3.372  -1.726   3.698
  835    HH   TYR 109           HH       TYR 109  -3.512  -2.811   0.474
  836    H    THR 110           H        THR 110   3.933  -2.694   3.850
  837    HA   THR 110           HA       THR 110   5.600  -0.866   5.537
  838    HB   THR 110           HB       THR 110   6.379  -3.709   4.876
  839    HG1  THR 110           HG1      THR 110   5.328  -4.408   6.626
  840   1HG2  THR 110          1HG2      THR 110   7.994  -1.923   5.762
  841   2HG2  THR 110          2HG2      THR 110   7.086  -2.013   7.272
  842   3HG2  THR 110          3HG2      THR 110   7.924  -3.439   6.661
  843    H    VAL 111           H        VAL 111   6.218   0.501   3.851
  844    HA   VAL 111           HA       VAL 111   6.951  -0.594   1.230
  845    HB   VAL 111           HB       VAL 111   5.681   1.550   1.742
  846   1HG1  VAL 111          1HG1      VAL 111   7.214   2.310   3.559
  847   2HG1  VAL 111          2HG1      VAL 111   8.457   2.596   2.339
  848   3HG1  VAL 111          3HG1      VAL 111   6.959   3.528   2.310
  849   1HG2  VAL 111          1HG2      VAL 111   8.129   1.486  -0.013
  850   2HG2  VAL 111          2HG2      VAL 111   6.444   1.264  -0.480
  851   3HG2  VAL 111          3HG2      VAL 111   7.026   2.862  -0.011
  852    H    THR 112           H        THR 112   9.009  -1.134   0.628
  853    HA   THR 112           HA       THR 112  11.254  -0.309   2.442
  854    HB   THR 112           HB       THR 112  10.684  -2.764   0.764
  855    HG1  THR 112           HG1      THR 112   9.817  -3.046   2.699
  856   1HG2  THR 112          1HG2      THR 112  13.250  -1.925   2.132
  857   2HG2  THR 112          2HG2      THR 112  12.902  -3.592   1.670
  858   3HG2  THR 112          3HG2      THR 112  13.024  -2.342   0.433
  859    H    VAL 113           H        VAL 113  12.723   1.055   1.517
  860    HA   VAL 113           HA       VAL 113  12.772   1.354  -1.448
  861    HB   VAL 113           HB       VAL 113  13.864   3.474  -0.954
  862   1HG1  VAL 113          1HG1      VAL 113  11.619   2.890   1.000
  863   2HG1  VAL 113          2HG1      VAL 113  12.177   4.505   0.566
  864   3HG1  VAL 113          3HG1      VAL 113  11.442   3.468  -0.657
  865   1HG2  VAL 113          1HG2      VAL 113  13.969   2.479   1.913
  866   2HG2  VAL 113          2HG2      VAL 113  15.353   2.687   0.840
  867   3HG2  VAL 113          3HG2      VAL 113  14.434   4.093   1.378
  868    H    LYS 114           H        LYS 114  14.576   0.676  -2.629
  869    HA   LYS 114           HA       LYS 114  17.026  -0.099  -1.093
  870   1HB   LYS 114          1HB       LYS 114  15.271  -1.950  -1.640
  871   2HB   LYS 114          2HB       LYS 114  15.880  -1.811  -3.290
  872   1HG   LYS 114          1HG       LYS 114  17.807  -2.882  -2.781
  873   2HG   LYS 114          2HG       LYS 114  18.028  -1.951  -1.301
  874   1HD   LYS 114          1HD       LYS 114  17.637  -4.012  -0.353
  875   2HD   LYS 114          2HD       LYS 114  15.964  -3.474  -0.511
  876   1HE   LYS 114          1HE       LYS 114  15.840  -5.573  -1.535
  877   2HE   LYS 114          2HE       LYS 114  16.219  -4.559  -2.940
  878   1HZ   LYS 114          1HZ       LYS 114  18.616  -4.915  -2.360
  879   2HZ   LYS 114          2HZ       LYS 114  18.115  -6.106  -1.261
  880   3HZ   LYS 114          3HZ       LYS 114  17.806  -6.300  -2.921
  881    H    ASN 115           H        ASN 115  18.899  -0.486  -2.574
  882    HA   ASN 115           HA       ASN 115  18.858   0.410  -5.330
  883   1HB   ASN 115          1HB       ASN 115  18.954   2.358  -3.226
  884   2HB   ASN 115          2HB       ASN 115  20.510   2.365  -4.051
  885   1HD2  ASN 115          2HD2      ASN 115  18.641   4.553  -4.258
  886   2HD2  ASN 115          1HD2      ASN 115  18.098   4.628  -5.865
  887    HA   PRO 116           HA       PRO 116  22.835  -1.451  -5.274
  888   1HB   PRO 116          1HB       PRO 116  24.492   0.222  -6.664
  889   2HB   PRO 116          2HB       PRO 116  23.223  -0.750  -7.434
  890   1HG   PRO 116          1HG       PRO 116  23.226   2.136  -6.722
  891   2HG   PRO 116          2HG       PRO 116  22.540   1.321  -8.136
  892   1HD   PRO 116          1HD       PRO 116  21.064   2.162  -5.998
  893   2HD   PRO 116          2HD       PRO 116  20.589   0.818  -7.058
  894    H    VAL 117           H        VAL 117  22.412   1.363  -3.487
  895    HA   VAL 117           HA       VAL 117  25.224   1.294  -2.463
  896    HB   VAL 117           HB       VAL 117  23.076   3.419  -2.220
  897   1HG1  VAL 117          1HG1      VAL 117  26.040   3.450  -1.577
  898   2HG1  VAL 117          2HG1      VAL 117  24.952   4.834  -1.461
  899   3HG1  VAL 117          3HG1      VAL 117  24.733   3.449  -0.392
  900   1HG2  VAL 117          1HG2      VAL 117  25.220   2.855  -4.222
  901   2HG2  VAL 117          2HG2      VAL 117  23.633   3.587  -4.456
  902   3HG2  VAL 117          3HG2      VAL 117  24.951   4.537  -3.770
  903    H    GLY 118           H        GLY 118  21.798   1.087  -1.494
  904   1HA   GLY 118          2HA       GLY 118  22.116   1.182   1.314
  905   2HA   GLY 118          1HA       GLY 118  22.442  -0.481   0.829
  906    H    GLU 119           H        GLU 119  20.155   0.680   2.385
  907    HA   GLU 119           HA       GLU 119  17.796   0.585   0.686
  908   1HB   GLU 119          1HB       GLU 119  17.033  -1.643   1.437
  909   2HB   GLU 119          2HB       GLU 119  18.581  -1.764   0.601
  910   1HG   GLU 119          1HG       GLU 119  19.555  -1.445   3.046
  911   2HG   GLU 119          2HG       GLU 119  17.975  -2.071   3.518
  912    H    ASP 120           H        ASP 120  15.898   1.081   1.892
  913    HA   ASP 120           HA       ASP 120  16.221   1.409   4.850
  914   1HB   ASP 120          1HB       ASP 120  16.309   3.448   2.969
  915   2HB   ASP 120          2HB       ASP 120  14.631   3.477   3.513
  916    H    GLN 121           H        GLN 121  13.941   1.842   5.845
  917    HA   GLN 121           HA       GLN 121  11.753   0.591   4.257
  918   1HB   GLN 121          1HB       GLN 121  13.391  -0.758   6.142
  919   2HB   GLN 121          2HB       GLN 121  11.822  -0.531   6.915
  920   1HG   GLN 121          1HG       GLN 121  10.971  -1.313   4.489
  921   2HG   GLN 121          2HG       GLN 121  12.534  -2.131   4.505
  922   1HE2  GLN 121          2HE2      GLN 121  11.845  -4.286   4.918
  923   2HE2  GLN 121          1HE2      GLN 121  10.990  -4.743   6.312
  924    H    VAL 122           H        VAL 122   9.647   0.757   5.422
  925    HA   VAL 122           HA       VAL 122   9.364   2.490   7.741
  926    HB   VAL 122           HB       VAL 122   9.762   4.360   6.423
  927   1HG1  VAL 122          1HG1      VAL 122   9.084   2.510   4.218
  928   2HG1  VAL 122          2HG1      VAL 122   8.701   4.204   3.922
  929   3HG1  VAL 122          3HG1      VAL 122  10.352   3.728   4.316
  930   1HG2  VAL 122          1HG2      VAL 122   7.361   4.419   7.182
  931   2HG2  VAL 122          2HG2      VAL 122   7.670   5.381   5.737
  932   3HG2  VAL 122          3HG2      VAL 122   6.897   3.803   5.597
  933    H    ASN 123           H        ASN 123   7.013   2.779   8.244
  934    HA   ASN 123           HA       ASN 123   5.427   0.520   7.106
  935   1HB   ASN 123          1HB       ASN 123   5.777   0.464   9.488
  936   2HB   ASN 123          2HB       ASN 123   5.282   2.146   9.657
  937   1HD2  ASN 123          2HD2      ASN 123   3.567   1.381  11.181
  938   2HD2  ASN 123          1HD2      ASN 123   2.148   0.681  10.566
  939    H    LEU 124           H        LEU 124   3.387   0.873   6.261
  940    HA   LEU 124           HA       LEU 124   2.588   3.729   5.820
  941   1HB   LEU 124          1HB       LEU 124   3.276   2.699   3.765
  942   2HB   LEU 124          2HB       LEU 124   2.398   1.220   4.133
  943    HG   LEU 124           HG       LEU 124   0.428   3.209   4.215
  944   1HD1  LEU 124          1HD1      LEU 124   2.485   4.425   2.936
  945   2HD1  LEU 124          2HD1      LEU 124   1.700   3.631   1.573
  946   3HD1  LEU 124          3HD1      LEU 124   0.793   4.758   2.580
  947   1HD2  LEU 124          1HD2      LEU 124   1.275   1.054   2.323
  948   2HD2  LEU 124          2HD2      LEU 124  -0.231   1.225   3.225
  949   3HD2  LEU 124          3HD2      LEU 124   0.042   2.189   1.775
  950    H    THR 125           H        THR 125   0.872   4.176   7.148
  951    HA   THR 125           HA       THR 125  -0.957   2.041   8.040
  952    HB   THR 125           HB       THR 125  -0.903   5.037   8.533
  953    HG1  THR 125           HG1      THR 125   0.200   4.450  10.413
  954   1HG2  THR 125          1HG2      THR 125  -2.529   2.765   9.579
  955   2HG2  THR 125          2HG2      THR 125  -2.043   4.017  10.724
  956   3HG2  THR 125          3HG2      THR 125  -2.993   4.444   9.300
  957    H    VAL 126           H        VAL 126  -2.780   1.549   6.892
  958    HA   VAL 126           HA       VAL 126  -3.833   3.590   4.977
  959    HB   VAL 126           HB       VAL 126  -3.020   1.492   3.999
  960   1HG1  VAL 126          1HG1      VAL 126  -4.595   0.353   6.243
  961   2HG1  VAL 126          2HG1      VAL 126  -4.682  -0.529   4.719
  962   3HG1  VAL 126          3HG1      VAL 126  -3.119  -0.244   5.485
  963   1HG2  VAL 126          1HG2      VAL 126  -5.251   2.654   3.271
  964   2HG2  VAL 126          2HG2      VAL 126  -4.884   1.048   2.642
  965   3HG2  VAL 126          3HG2      VAL 126  -6.021   1.234   3.977
  966    H    LYS 127           H        LYS 127  -6.231   3.696   4.780
  967    HA   LYS 127           HA       LYS 127  -7.886   2.440   6.853
  968   1HB   LYS 127          1HB       LYS 127  -6.655   4.281   8.021
  969   2HB   LYS 127          2HB       LYS 127  -7.372   5.432   6.892
  970   1HG   LYS 127          1HG       LYS 127  -8.941   5.579   8.569
  971   2HG   LYS 127          2HG       LYS 127  -9.619   4.205   7.693
  972   1HD   LYS 127          1HD       LYS 127  -8.960   2.681   9.289
  973   2HD   LYS 127          2HD       LYS 127  -7.543   3.623   9.754
  974   1HE   LYS 127          1HE       LYS 127  -9.444   5.347  10.563
  975   2HE   LYS 127          2HE       LYS 127 -10.351   3.830  10.737
  976   1HZ   LYS 127          1HZ       LYS 127  -7.598   4.271  11.765
  977   2HZ   LYS 127          2HZ       LYS 127  -9.001   4.368  12.718
  978   3HZ   LYS 127          3HZ       LYS 127  -8.558   2.892  12.001
  979    H    VAL 128           H        VAL 128  -9.448   1.856   5.331
  980    HA   VAL 128           HA       VAL 128 -10.320   3.723   3.238
  981    HB   VAL 128           HB       VAL 128 -11.343   1.012   4.163
  982   1HG1  VAL 128          1HG1      VAL 128 -12.887   2.545   2.768
  983   2HG1  VAL 128          2HG1      VAL 128 -11.742   2.277   1.452
  984   3HG1  VAL 128          3HG1      VAL 128 -12.604   0.913   2.164
  985   1HG2  VAL 128          1HG2      VAL 128  -8.894   1.435   3.160
  986   2HG2  VAL 128          2HG2      VAL 128  -9.842   0.016   2.716
  987   3HG2  VAL 128          3HG2      VAL 128  -9.790   1.413   1.641
  988    H    ILE 129           H        ILE 129 -11.792   5.297   3.657
  989    HA   ILE 129           HA       ILE 129 -13.577   5.081   6.016
  990    HB   ILE 129           HB       ILE 129 -12.883   7.281   4.041
  991   1HG1  ILE 129          1HG1      ILE 129 -11.036   6.649   5.536
  992   2HG1  ILE 129          2HG1      ILE 129 -11.667   8.234   5.984
  993   1HG2  ILE 129          1HG2      ILE 129 -14.587   7.333   6.543
  994   2HG2  ILE 129          2HG2      ILE 129 -14.022   8.771   5.694
  995   3HG2  ILE 129          3HG2      ILE 129 -15.124   7.651   4.893
  996   1HD1  ILE 129          1HD1      ILE 129 -13.211   6.847   7.604
  997   2HD1  ILE 129          2HD1      ILE 129 -11.975   5.605   7.404
  998   3HD1  ILE 129          3HD1      ILE 129 -11.541   7.181   8.063
  999    H    ASP 130           H        ASP 130 -15.901   5.757   5.642
 1000    HA   ASP 130           HA       ASP 130 -16.886   4.740   2.996
 1001   1HB   ASP 130          1HB       ASP 130 -17.297   3.449   5.176
 1002   2HB   ASP 130          2HB       ASP 130 -18.361   4.780   5.638

  No H/Q in entry =        1002
  Start of MODEL   10
    1    H1   ARG   1          1H        ARG   1  29.388   4.607  -9.116
    2    H2   ARG   1          2H        ARG   1  29.621   2.929  -9.026
    3    H3   ARG   1          3H        ARG   1  28.351   3.559  -9.960
    4    HA   ARG   1           HA       ARG   1  27.379   2.748  -7.958
    5   1HB   ARG   1          1HB       ARG   1  28.351   3.511  -5.790
    6   2HB   ARG   1          2HB       ARG   1  29.520   2.616  -6.762
    7   1HG   ARG   1          1HG       ARG   1  30.621   4.624  -7.454
    8   2HG   ARG   1          2HG       ARG   1  29.317   5.635  -6.829
    9   1HD   ARG   1          1HD       ARG   1  30.051   5.467  -4.649
   10   2HD   ARG   1          2HD       ARG   1  30.666   3.817  -4.878
   11    HE   ARG   1           HE       ARG   1  32.102   5.837  -6.438
   12   1HH1  ARG   1          1HH1      ARG   1  32.935   3.159  -4.994
   13   2HH1  ARG   1          2HH1      ARG   1  34.100   3.795  -3.881
   14   1HH2  ARG   1          1HH2      ARG   1  33.134   7.093  -4.338
   15   2HH2  ARG   1          2HH2      ARG   1  34.214   6.021  -3.510
   16    H    GLN   2           H        GLN   2  26.291   4.291  -6.139
   17    HA   GLN   2           HA       GLN   2  25.917   7.041  -7.203
   18   1HB   GLN   2          1HB       GLN   2  23.357   6.492  -6.916
   19   2HB   GLN   2          2HB       GLN   2  24.194   6.001  -8.383
   20   1HG   GLN   2          1HG       GLN   2  24.016   3.797  -7.899
   21   2HG   GLN   2          2HG       GLN   2  24.343   4.043  -6.189
   22   1HE2  GLN   2          2HE2      GLN   2  22.363   5.498  -5.163
   23   2HE2  GLN   2          1HE2      GLN   2  20.826   4.869  -5.512
   24    H    GLU   3           H        GLU   3  23.786   7.805  -5.601
   25    HA   GLU   3           HA       GLU   3  25.062   8.005  -2.980
   26   1HB   GLU   3          1HB       GLU   3  22.742   9.140  -4.464
   27   2HB   GLU   3          2HB       GLU   3  22.658   9.197  -2.704
   28   1HG   GLU   3          1HG       GLU   3  25.222  10.023  -3.100
   29   2HG   GLU   3          2HG       GLU   3  24.451  10.656  -4.555
   30    HA   PRO   4           HA       PRO   4  23.012   4.683  -0.956
   31   1HB   PRO   4          1HB       PRO   4  22.783   5.722   1.571
   32   2HB   PRO   4          2HB       PRO   4  24.314   5.120   0.899
   33   1HG   PRO   4          1HG       PRO   4  23.305   7.926   1.081
   34   2HG   PRO   4          2HG       PRO   4  24.924   7.288   1.422
   35   1HD   PRO   4          1HD       PRO   4  24.364   8.540  -0.887
   36   2HD   PRO   4          2HD       PRO   4  25.496   7.170  -0.818
   37    HA   PRO   5           HA       PRO   5  18.748   5.886  -1.311
   38   1HB   PRO   5          1HB       PRO   5  17.666   3.493  -0.535
   39   2HB   PRO   5          2HB       PRO   5  18.374   3.752  -2.139
   40   1HG   PRO   5          1HG       PRO   5  19.564   2.481   0.279
   41   2HG   PRO   5          2HG       PRO   5  19.642   1.960  -1.412
   42   1HD   PRO   5          1HD       PRO   5  21.682   3.239  -0.206
   43   2HD   PRO   5          2HD       PRO   5  21.312   3.457  -1.932
   44    H    LYS   6           H        LYS   6  17.030   6.423   0.163
   45    HA   LYS   6           HA       LYS   6  17.030   5.555   2.935
   46   1HB   LYS   6          1HB       LYS   6  18.565   7.915   2.057
   47   2HB   LYS   6          2HB       LYS   6  17.478   8.227   3.409
   48   1HG   LYS   6          1HG       LYS   6  18.617   5.801   4.099
   49   2HG   LYS   6          2HG       LYS   6  19.957   6.657   3.334
   50   1HD   LYS   6          1HD       LYS   6  18.268   8.168   5.284
   51   2HD   LYS   6          2HD       LYS   6  19.408   6.982   5.923
   52   1HE   LYS   6          1HE       LYS   6  20.342   8.960   3.852
   53   2HE   LYS   6          2HE       LYS   6  20.241   9.444   5.557
   54   1HZ   LYS   6          1HZ       LYS   6  21.454   7.354   6.095
   55   2HZ   LYS   6          2HZ       LYS   6  21.721   7.129   4.432
   56   3HZ   LYS   6          3HZ       LYS   6  22.379   8.480   5.219
   57    H    ILE   7           H        ILE   7  15.299   6.666   4.161
   58    HA   ILE   7           HA       ILE   7  13.044   7.411   2.434
   59    HB   ILE   7           HB       ILE   7  13.223   7.240   5.454
   60   1HG1  ILE   7          1HG1      ILE   7  14.091   5.150   4.543
   61   2HG1  ILE   7          2HG1      ILE   7  12.460   4.871   5.150
   62   1HG2  ILE   7          1HG2      ILE   7  11.174   8.142   3.961
   63   2HG2  ILE   7          2HG2      ILE   7  10.831   6.413   3.890
   64   3HG2  ILE   7          3HG2      ILE   7  10.929   7.229   5.450
   65   1HD1  ILE   7          1HD1      ILE   7  13.171   5.414   2.251
   66   2HD1  ILE   7          2HD1      ILE   7  12.796   3.828   2.925
   67   3HD1  ILE   7          3HD1      ILE   7  11.555   5.079   2.876
   68    H    HIS   8           H        HIS   8  15.278   9.361   2.600
   69    HA   HIS   8           HA       HIS   8  13.856  11.600   3.992
   70   1HB   HIS   8          1HB       HIS   8  16.012  12.511   4.509
   71   2HB   HIS   8          2HB       HIS   8  16.113  10.793   4.876
   72    HD1  HIS   8           HD1      HIS   8  18.252   9.827   4.070
   73    HD2  HIS   8           HD2      HIS   8  16.914  12.856   1.539
   74    HE1  HIS   8           HE1      HIS   8  19.961  10.013   2.210
   75    H    LEU   9           H        LEU   9  14.575  13.804   2.922
   76    HA   LEU   9           HA       LEU   9  14.551  13.439  -0.052
   77   1HB   LEU   9          1HB       LEU   9  13.266  15.835   0.361
   78   2HB   LEU   9          2HB       LEU   9  12.459  14.294   0.149
   79    HG   LEU   9           HG       LEU   9  12.536  13.985   2.651
   80   1HD1  LEU   9          1HD1      LEU   9  14.432  15.667   2.918
   81   2HD1  LEU   9          2HD1      LEU   9  13.227  16.931   2.681
   82   3HD1  LEU   9          3HD1      LEU   9  13.101  15.839   4.056
   83   1HD2  LEU   9          1HD2      LEU   9  10.628  15.059   1.227
   84   2HD2  LEU   9          2HD2      LEU   9  10.573  15.231   2.982
   85   3HD2  LEU   9          3HD2      LEU   9  11.141  16.569   1.982
   86    H    ASP  10           H        ASP  10  14.561  16.692   1.175
   87    HA   ASP  10           HA       ASP  10  17.366  16.971   0.222
   88   1HB   ASP  10          1HB       ASP  10  14.900  18.631   0.373
   89   2HB   ASP  10          2HB       ASP  10  16.437  19.486   0.513
   90    H    CYS  11           H        CYS  11  15.398  17.277   3.123
   91    HA   CYS  11           HA       CYS  11  17.877  17.851   4.653
   92   1HB   CYS  11          1HB       CYS  11  15.619  19.706   4.154
   93   2HB   CYS  11          2HB       CYS  11  16.217  19.656   5.812
   94    HG   CYS  11           HG       CYS  11  18.071  21.083   5.010
   95    HA   PRO  12           HA       PRO  12  14.671  16.617   7.907
   96   1HB   PRO  12          1HB       PRO  12  12.017  16.441   7.243
   97   2HB   PRO  12          2HB       PRO  12  12.777  17.932   7.831
   98   1HG   PRO  12          1HG       PRO  12  12.103  17.128   5.045
   99   2HG   PRO  12          2HG       PRO  12  11.965  18.709   5.828
  100   1HD   PRO  12          1HD       PRO  12  13.994  18.063   4.138
  101   2HD   PRO  12          2HD       PRO  12  14.162  19.235   5.464
  102    H    GLY  13           H        GLY  13  12.258  15.272   5.736
  103   1HA   GLY  13          2HA       GLY  13  13.723  12.666   5.831
  104   2HA   GLY  13          1HA       GLY  13  12.732  13.155   4.456
  105    H    ARG  14           H        ARG  14  10.455  14.099   5.619
  106    HA   ARG  14           HA       ARG  14   9.499  11.896   7.411
  107   1HB   ARG  14          1HB       ARG  14   9.092  14.800   7.172
  108   2HB   ARG  14          2HB       ARG  14   7.588  13.901   7.373
  109   1HG   ARG  14          1HG       ARG  14   8.158  13.141   9.477
  110   2HG   ARG  14          2HG       ARG  14   9.888  13.167   9.132
  111   1HD   ARG  14          1HD       ARG  14   9.862  15.650   9.210
  112   2HD   ARG  14          2HD       ARG  14   8.134  15.602   9.613
  113    HE   ARG  14           HE       ARG  14   9.928  13.993  11.329
  114   1HH1  ARG  14          1HH1      ARG  14   7.050  15.256  11.698
  115   2HH1  ARG  14          2HH1      ARG  14   7.404  16.371  12.975
  116   1HH2  ARG  14          1HH2      ARG  14  10.842  16.126  12.599
  117   2HH2  ARG  14          2HH2      ARG  14   9.550  16.864  13.486
  118    H    ILE  15           H        ILE  15   9.021  10.383   5.696
  119    HA   ILE  15           HA       ILE  15   7.325  11.162   3.443
  120    HB   ILE  15           HB       ILE  15   8.726   8.751   4.500
  121   1HG1  ILE  15          1HG1      ILE  15   8.331   9.905   1.720
  122   2HG1  ILE  15          2HG1      ILE  15   9.695  10.254   2.780
  123   1HG2  ILE  15          1HG2      ILE  15   6.205   8.641   2.854
  124   2HG2  ILE  15          2HG2      ILE  15   7.464   7.429   2.624
  125   3HG2  ILE  15          3HG2      ILE  15   6.693   7.611   4.199
  126   1HD1  ILE  15          1HD1      ILE  15   9.583   7.464   2.725
  127   2HD1  ILE  15          2HD1      ILE  15   9.233   7.938   1.064
  128   3HD1  ILE  15          3HD1      ILE  15  10.723   8.475   1.838
  129    HA   PRO  16           HA       PRO  16   3.709  10.670   6.085
  130   1HB   PRO  16          1HB       PRO  16   1.895  11.574   4.242
  131   2HB   PRO  16          2HB       PRO  16   2.904  12.660   5.219
  132   1HG   PRO  16          1HG       PRO  16   3.246  11.792   2.394
  133   2HG   PRO  16          2HG       PRO  16   3.538  13.374   3.133
  134   1HD   PRO  16          1HD       PRO  16   5.525  11.604   2.535
  135   2HD   PRO  16          2HD       PRO  16   5.637  12.802   3.844
  136    H    ASP  17           H        ASP  17   4.569   8.292   5.296
  137    HA   ASP  17           HA       ASP  17   3.147   6.946   3.197
  138   1HB   ASP  17          1HB       ASP  17   3.893   4.911   4.593
  139   2HB   ASP  17          2HB       ASP  17   5.164   6.002   4.049
  140    H    THR  18           H        THR  18   0.928   7.818   3.677
  141    HA   THR  18           HA       THR  18  -0.523   5.981   5.531
  142    HB   THR  18           HB       THR  18  -0.203   7.971   6.831
  143    HG1  THR  18           HG1      THR  18  -2.299   8.641   7.062
  144   1HG2  THR  18          1HG2      THR  18  -0.435   9.244   4.187
  145   2HG2  THR  18          2HG2      THR  18  -1.231  10.126   5.489
  146   3HG2  THR  18          3HG2      THR  18   0.487   9.746   5.605
  147    H    ILE  19           H        ILE  19  -1.392   4.912   3.650
  148    HA   ILE  19           HA       ILE  19  -2.764   6.543   1.612
  149    HB   ILE  19           HB       ILE  19  -1.371   4.537   1.101
  150   1HG1  ILE  19          1HG1      ILE  19  -3.068   3.470  -0.411
  151   2HG1  ILE  19          2HG1      ILE  19  -4.317   4.396   0.418
  152   1HG2  ILE  19          1HG2      ILE  19  -2.589   3.390   3.254
  153   2HG2  ILE  19          2HG2      ILE  19  -3.527   2.688   1.936
  154   3HG2  ILE  19          3HG2      ILE  19  -1.779   2.472   1.984
  155   1HD1  ILE  19          1HD1      ILE  19  -1.904   5.677  -0.885
  156   2HD1  ILE  19          2HD1      ILE  19  -3.446   5.464  -1.713
  157   3HD1  ILE  19          3HD1      ILE  19  -3.349   6.484  -0.279
  158    H    VAL  20           H        VAL  20  -4.824   7.231   2.015
  159    HA   VAL  20           HA       VAL  20  -6.663   5.375   3.485
  160    HB   VAL  20           HB       VAL  20  -6.426   8.399   3.643
  161   1HG1  VAL  20          1HG1      VAL  20  -8.749   7.470   3.879
  162   2HG1  VAL  20          2HG1      VAL  20  -8.173   6.505   5.238
  163   3HG1  VAL  20          3HG1      VAL  20  -8.156   8.265   5.337
  164   1HG2  VAL  20          1HG2      VAL  20  -5.521   6.122   5.394
  165   2HG2  VAL  20          2HG2      VAL  20  -4.636   7.570   4.915
  166   3HG2  VAL  20          3HG2      VAL  20  -5.924   7.681   6.114
  167    H    VAL  21           H        VAL  21  -8.831   5.376   2.712
  168    HA   VAL  21           HA       VAL  21  -9.528   7.120   0.415
  169    HB   VAL  21           HB       VAL  21  -8.333   5.264  -0.584
  170   1HG1  VAL  21          1HG1      VAL  21  -9.717   3.780   1.527
  171   2HG1  VAL  21          2HG1      VAL  21  -9.786   2.971  -0.037
  172   3HG1  VAL  21          3HG1      VAL  21  -8.226   3.386   0.672
  173   1HG2  VAL  21          1HG2      VAL  21 -10.557   6.039  -1.583
  174   2HG2  VAL  21          2HG2      VAL  21 -10.003   4.439  -2.078
  175   3HG2  VAL  21          3HG2      VAL  21 -11.269   4.596  -0.860
  176    H    VAL  22           H        VAL  22 -11.852   6.958  -0.112
  177    HA   VAL  22           HA       VAL  22 -13.473   6.259   2.275
  178    HB   VAL  22           HB       VAL  22 -14.114   7.702  -0.320
  179   1HG1  VAL  22          1HG1      VAL  22 -15.809   6.682   1.745
  180   2HG1  VAL  22          2HG1      VAL  22 -15.800   8.441   1.871
  181   3HG1  VAL  22          3HG1      VAL  22 -16.260   7.668   0.354
  182   1HG2  VAL  22          1HG2      VAL  22 -12.421   8.577   1.615
  183   2HG2  VAL  22          2HG2      VAL  22 -13.449   9.658   0.674
  184   3HG2  VAL  22          3HG2      VAL  22 -13.957   9.133   2.279
  185    H    ALA  23           H        ALA  23 -12.631   3.933   1.141
  186    HA   ALA  23           HA       ALA  23 -13.313   1.938   0.067
  187   1HB   ALA  23          1HB       ALA  23 -15.789   3.201   1.245
  188   2HB   ALA  23          3HB       ALA  23 -14.783   1.926   1.932
  189   3HB   ALA  23          2HB       ALA  23 -15.815   1.583   0.545
  190    H    GLY  24           H        GLY  24 -12.909   2.293  -2.166
  191   1HA   GLY  24          2HA       GLY  24 -15.292   2.503  -3.834
  192   2HA   GLY  24          1HA       GLY  24 -13.646   2.253  -4.410
  193    H    ASN  25           H        ASN  25 -12.329   4.471  -3.451
  194    HA   ASN  25           HA       ASN  25 -13.687   6.669  -4.958
  195   1HB   ASN  25          1HB       ASN  25 -14.068   6.841  -2.484
  196   2HB   ASN  25          2HB       ASN  25 -12.320   6.931  -2.261
  197   1HD2  ASN  25          2HD2      ASN  25 -11.898   9.102  -1.768
  198   2HD2  ASN  25          1HD2      ASN  25 -12.474  10.423  -2.665
  199    H    LYS  26           H        LYS  26 -12.154   8.274  -5.769
  200    HA   LYS  26           HA       LYS  26  -9.694   7.207  -6.770
  201   1HB   LYS  26          1HB       LYS  26 -10.931   9.942  -6.481
  202   2HB   LYS  26          2HB       LYS  26  -9.314   9.762  -7.160
  203   1HG   LYS  26          1HG       LYS  26 -10.542   9.579  -9.104
  204   2HG   LYS  26          2HG       LYS  26 -10.543   7.885  -8.613
  205   1HD   LYS  26          1HD       LYS  26 -12.759   7.907  -8.053
  206   2HD   LYS  26          2HD       LYS  26 -12.693   9.563  -7.446
  207   1HE   LYS  26          1HE       LYS  26 -14.049   9.565  -9.468
  208   2HE   LYS  26          2HE       LYS  26 -12.497  10.332  -9.866
  209   1HZ   LYS  26          1HZ       LYS  26 -11.669   8.181 -10.610
  210   2HZ   LYS  26          2HZ       LYS  26 -13.167   7.460 -10.258
  211   3HZ   LYS  26          3HZ       LYS  26 -13.050   8.623 -11.492
  212    H    LEU  27           H        LEU  27  -8.106   6.578  -5.303
  213    HA   LEU  27           HA       LEU  27  -7.458   8.477  -3.084
  214   1HB   LEU  27          1HB       LEU  27  -8.013   6.435  -2.123
  215   2HB   LEU  27          2HB       LEU  27  -7.411   5.510  -3.493
  216    HG   LEU  27           HG       LEU  27  -5.093   6.004  -2.828
  217   1HD1  LEU  27          1HD1      LEU  27  -6.474   7.919  -1.089
  218   2HD1  LEU  27          2HD1      LEU  27  -5.273   6.958  -0.228
  219   3HD1  LEU  27          3HD1      LEU  27  -4.798   7.907  -1.636
  220   1HD2  LEU  27          1HD2      LEU  27  -6.898   4.307  -1.536
  221   2HD2  LEU  27          2HD2      LEU  27  -5.140   4.217  -1.448
  222   3HD2  LEU  27          3HD2      LEU  27  -6.040   5.105  -0.218
  223    H    ARG  28           H        ARG  28  -5.455   9.415  -3.062
  224    HA   ARG  28           HA       ARG  28  -3.335   8.333  -4.879
  225   1HB   ARG  28          1HB       ARG  28  -2.857  10.701  -5.497
  226   2HB   ARG  28          2HB       ARG  28  -4.491  10.220  -5.952
  227   1HG   ARG  28          1HG       ARG  28  -5.333  11.235  -3.825
  228   2HG   ARG  28          2HG       ARG  28  -3.699  11.816  -3.498
  229   1HD   ARG  28          1HD       ARG  28  -4.105  12.686  -6.088
  230   2HD   ARG  28          2HD       ARG  28  -5.711  12.884  -5.361
  231    HE   ARG  28           HE       ARG  28  -4.082  13.867  -3.397
  232   1HH1  ARG  28          1HH1      ARG  28  -1.992  15.105  -4.212
  233   2HH1  ARG  28          2HH1      ARG  28  -2.408  16.414  -5.268
  234   1HH2  ARG  28          1HH2      ARG  28  -5.615  15.248  -5.883
  235   2HH2  ARG  28          2HH2      ARG  28  -4.460  16.495  -6.214
  236    H    LEU  29           H        LEU  29  -1.252   8.437  -3.978
  237    HA   LEU  29           HA       LEU  29  -0.913   9.916  -1.402
  238   1HB   LEU  29          1HB       LEU  29  -1.613   7.648  -0.864
  239   2HB   LEU  29          2HB       LEU  29  -0.399   6.979  -1.949
  240    HG   LEU  29           HG       LEU  29   1.372   8.025  -0.542
  241   1HD1  LEU  29          1HD1      LEU  29  -1.070   8.925   0.947
  242   2HD1  LEU  29          2HD1      LEU  29   0.410   8.599   1.850
  243   3HD1  LEU  29          3HD1      LEU  29   0.404   9.821   0.578
  244   1HD2  LEU  29          1HD2      LEU  29  -0.064   5.702  -0.096
  245   2HD2  LEU  29          2HD2      LEU  29   1.450   6.129   0.702
  246   3HD2  LEU  29          3HD2      LEU  29  -0.091   6.481   1.485
  247    H    ASP  30           H        ASP  30   1.002  11.010  -1.441
  248    HA   ASP  30           HA       ASP  30   3.148  10.057  -3.315
  249   1HB   ASP  30          1HB       ASP  30   2.187  12.842  -2.595
  250   2HB   ASP  30          2HB       ASP  30   3.622  12.522  -3.568
  251    H    VAL  31           H        VAL  31   5.201   9.926  -2.443
  252    HA   VAL  31           HA       VAL  31   5.807  11.286   0.123
  253    HB   VAL  31           HB       VAL  31   6.670   9.026   0.957
  254   1HG1  VAL  31          1HG1      VAL  31   4.542  10.097   1.706
  255   2HG1  VAL  31          2HG1      VAL  31   3.693   9.232   0.424
  256   3HG1  VAL  31          3HG1      VAL  31   4.468   8.335   1.731
  257   1HG2  VAL  31          1HG2      VAL  31   6.420   8.110  -1.509
  258   2HG2  VAL  31          2HG2      VAL  31   6.092   7.049  -0.141
  259   3HG2  VAL  31          3HG2      VAL  31   4.758   7.806  -1.012
  260    HA   PRO  32           HA       PRO  32   9.433  11.672  -2.510
  261   1HB   PRO  32          1HB       PRO  32  10.764  13.450  -0.911
  262   2HB   PRO  32          2HB       PRO  32   9.451  13.926  -2.006
  263   1HG   PRO  32          1HG       PRO  32   9.384  13.454   0.933
  264   2HG   PRO  32          2HG       PRO  32   8.568  14.696  -0.030
  265   1HD   PRO  32          1HD       PRO  32   7.314  12.468   0.902
  266   2HD   PRO  32          2HD       PRO  32   6.831  13.310  -0.587
  267    H    ILE  33           H        ILE  33  11.536  10.787  -2.412
  268    HA   ILE  33           HA       ILE  33  12.524   9.759   0.205
  269    HB   ILE  33           HB       ILE  33  12.704   7.873  -2.083
  270   1HG1  ILE  33          1HG1      ILE  33  10.048   8.275  -0.664
  271   2HG1  ILE  33          2HG1      ILE  33  10.369   8.809  -2.314
  272   1HG2  ILE  33          1HG2      ILE  33  12.300   7.832   0.877
  273   2HG2  ILE  33          2HG2      ILE  33  11.780   6.429  -0.051
  274   3HG2  ILE  33          3HG2      ILE  33  13.465   6.947  -0.104
  275   1HD1  ILE  33          1HD1      ILE  33  10.833   5.951  -1.472
  276   2HD1  ILE  33          2HD1      ILE  33   9.253   6.505  -2.028
  277   3HD1  ILE  33          3HD1      ILE  33  10.649   6.597  -3.102
  278    H    SER  34           H        SER  34  14.749   8.477  -0.493
  279    HA   SER  34           HA       SER  34  16.331  10.523  -1.975
  280   1HB   SER  34          1HB       SER  34  16.704   9.373   0.424
  281   2HB   SER  34          2HB       SER  34  17.532   8.176  -0.567
  282    HG   SER  34           HG       SER  34  19.086   9.553  -0.869
  283    H    GLY  35           H        GLY  35  18.447   8.387  -2.407
  284   1HA   GLY  35          2HA       GLY  35  17.147   6.692  -4.468
  285   2HA   GLY  35          1HA       GLY  35  18.779   6.470  -3.838
  286    H    ASP  36           H        ASP  36  19.675   6.444  -5.963
  287    HA   ASP  36           HA       ASP  36  19.347   8.845  -7.670
  288   1HB   ASP  36          1HB       ASP  36  21.130   9.086  -5.765
  289   2HB   ASP  36          2HB       ASP  36  22.101   8.019  -6.779
  290    HA   PRO  37           HA       PRO  37  18.796   9.054  -9.484
  291   1HB   PRO  37          1HB       PRO  37  16.976   7.945 -11.207
  292   2HB   PRO  37          2HB       PRO  37  18.536   8.609 -11.731
  293   1HG   PRO  37          1HG       PRO  37  17.741   5.776 -11.284
  294   2HG   PRO  37          2HG       PRO  37  18.775   6.476 -12.537
  295   1HD   PRO  37          1HD       PRO  37  19.743   5.169 -10.352
  296   2HD   PRO  37          2HD       PRO  37  20.635   6.449 -11.205
  297    H    ALA  38           H        ALA  38  16.623   6.266  -9.898
  298    HA   ALA  38           HA       ALA  38  15.172   7.142  -7.443
  299   1HB   ALA  38          2HB       ALA  38  13.536   5.391  -8.739
  300   2HB   ALA  38          3HB       ALA  38  13.587   7.117  -9.096
  301   3HB   ALA  38          1HB       ALA  38  14.505   5.984 -10.088
  302    HA   PRO  39           HA       PRO  39  16.548   3.366  -5.555
  303   1HB   PRO  39          1HB       PRO  39  14.974   3.478  -3.323
  304   2HB   PRO  39          2HB       PRO  39  16.409   4.499  -3.542
  305   1HG   PRO  39          1HG       PRO  39  13.542   5.182  -3.799
  306   2HG   PRO  39          2HG       PRO  39  14.900   6.181  -3.266
  307   1HD   PRO  39          1HD       PRO  39  13.711   6.282  -5.774
  308   2HD   PRO  39          2HD       PRO  39  15.318   6.919  -5.369
  309    H    THR  40           H        THR  40  15.074   1.595  -4.131
  310    HA   THR  40           HA       THR  40  12.885   0.773  -6.007
  311    HB   THR  40           HB       THR  40  14.259  -1.133  -4.153
  312    HG1  THR  40           HG1      THR  40  15.977  -1.306  -5.647
  313   1HG2  THR  40          1HG2      THR  40  12.396  -1.550  -5.963
  314   2HG2  THR  40          2HG2      THR  40  13.755  -1.511  -7.086
  315   3HG2  THR  40          3HG2      THR  40  13.719  -2.702  -5.785
  316    H    VAL  41           H        VAL  41  11.343   2.011  -4.738
  317    HA   VAL  41           HA       VAL  41  10.971   1.368  -1.891
  318    HB   VAL  41           HB       VAL  41  10.707   3.639  -2.811
  319   1HG1  VAL  41          1HG1      VAL  41   9.412   2.293  -4.915
  320   2HG1  VAL  41          2HG1      VAL  41   8.145   3.231  -4.124
  321   3HG1  VAL  41          3HG1      VAL  41   9.592   4.037  -4.729
  322   1HG2  VAL  41          1HG2      VAL  41   9.310   2.811  -0.861
  323   2HG2  VAL  41          2HG2      VAL  41   8.636   4.187  -1.732
  324   3HG2  VAL  41          3HG2      VAL  41   7.993   2.569  -2.007
  325    H    ILE  42           H        ILE  42  10.217  -0.727  -1.648
  326    HA   ILE  42           HA       ILE  42   8.092  -1.789  -3.409
  327    HB   ILE  42           HB       ILE  42   9.754  -2.880  -1.119
  328   1HG1  ILE  42          1HG1      ILE  42   9.885  -3.419  -4.100
  329   2HG1  ILE  42          2HG1      ILE  42  10.946  -2.297  -3.247
  330   1HG2  ILE  42          1HG2      ILE  42   7.504  -4.025  -2.689
  331   2HG2  ILE  42          2HG2      ILE  42   8.892  -5.076  -2.403
  332   3HG2  ILE  42          3HG2      ILE  42   8.022  -4.375  -1.040
  333   1HD1  ILE  42          1HD1      ILE  42  11.395  -4.362  -1.681
  334   2HD1  ILE  42          2HD1      ILE  42  10.821  -5.291  -3.065
  335   3HD1  ILE  42          3HD1      ILE  42  12.230  -4.243  -3.229
  336    H    TRP  43           H        TRP  43   6.041  -1.013  -2.803
  337    HA   TRP  43           HA       TRP  43   5.279  -0.412  -0.064
  338   1HB   TRP  43          1HB       TRP  43   3.786  -0.887  -2.662
  339   2HB   TRP  43          2HB       TRP  43   2.964  -0.436  -1.171
  340    HD1  TRP  43           HD1      TRP  43   4.583   1.020  -4.112
  341    HE1  TRP  43           HE1      TRP  43   5.010   3.539  -3.782
  342    HE3  TRP  43           HE3      TRP  43   3.755   1.420   0.927
  343    HZ2  TRP  43           HZ2      TRP  43   5.009   5.461  -1.678
  344    HZ3  TRP  43           HZ3      TRP  43   4.009   3.586   2.062
  345    HH2  TRP  43           HH2      TRP  43   4.623   5.620   0.773
  346    H    GLN  44           H        GLN  44   5.430  -2.227   1.338
  347    HA   GLN  44           HA       GLN  44   4.362  -4.843   0.443
  348   1HB   GLN  44          1HB       GLN  44   5.525  -3.964   3.108
  349   2HB   GLN  44          2HB       GLN  44   5.306  -5.623   2.557
  350   1HG   GLN  44          1HG       GLN  44   6.928  -5.322   0.787
  351   2HG   GLN  44          2HG       GLN  44   7.049  -3.597   1.129
  352   1HE2  GLN  44          2HE2      GLN  44   7.656  -6.810   2.622
  353   2HE2  GLN  44          1HE2      GLN  44   8.892  -6.268   3.651
  354    H    LYS  45           H        LYS  45   2.637  -5.917   1.654
  355    HA   LYS  45           HA       LYS  45   0.849  -4.008   3.127
  356   1HB   LYS  45          1HB       LYS  45  -1.014  -5.235   2.036
  357   2HB   LYS  45          2HB       LYS  45   0.077  -4.530   0.844
  358   1HG   LYS  45          1HG       LYS  45   1.194  -6.679   0.536
  359   2HG   LYS  45          2HG       LYS  45   0.207  -7.403   1.807
  360   1HD   LYS  45          1HD       LYS  45  -1.757  -6.424   0.243
  361   2HD   LYS  45          2HD       LYS  45  -0.524  -6.696  -0.988
  362   1HE   LYS  45          1HE       LYS  45  -0.292  -9.043  -0.265
  363   2HE   LYS  45          2HE       LYS  45  -1.513  -8.777   0.997
  364   1HZ   LYS  45          1HZ       LYS  45  -3.054  -8.037  -0.747
  365   2HZ   LYS  45          2HZ       LYS  45  -1.899  -8.423  -1.930
  366   3HZ   LYS  45          3HZ       LYS  45  -2.574  -9.651  -0.970
  367    H    ALA  46           H        ALA  46  -0.552  -5.048   4.735
  368    HA   ALA  46           HA       ALA  46   0.420  -7.719   5.676
  369   1HB   ALA  46          1HB       ALA  46   1.289  -5.564   6.849
  370   2HB   ALA  46          2HB       ALA  46  -0.344  -5.441   7.502
  371   3HB   ALA  46          3HB       ALA  46   0.648  -6.853   7.866
  372    H    ILE  47           H        ILE  47  -1.497  -8.688   4.811
  373    HA   ILE  47           HA       ILE  47  -3.998  -8.047   6.336
  374    HB   ILE  47           HB       ILE  47  -3.719  -8.725   3.386
  375   1HG1  ILE  47          1HG1      ILE  47  -4.568  -6.101   4.646
  376   2HG1  ILE  47          2HG1      ILE  47  -2.921  -6.418   4.101
  377   1HG2  ILE  47          1HG2      ILE  47  -6.051  -8.259   5.226
  378   2HG2  ILE  47          2HG2      ILE  47  -6.185  -7.830   3.520
  379   3HG2  ILE  47          3HG2      ILE  47  -5.843  -9.497   3.987
  380   1HD1  ILE  47          1HD1      ILE  47  -5.114  -7.010   2.177
  381   2HD1  ILE  47          2HD1      ILE  47  -4.764  -5.311   2.493
  382   3HD1  ILE  47          3HD1      ILE  47  -3.497  -6.373   1.878
  383    H    THR  48           H        THR  48  -1.838 -10.136   6.575
  384    HA   THR  48           HA       THR  48  -3.495 -12.586   6.077
  385    HB   THR  48           HB       THR  48  -1.490 -12.600   4.750
  386    HG1  THR  48           HG1      THR  48  -1.386 -14.572   5.441
  387   1HG2  THR  48          1HG2      THR  48  -0.196 -11.604   7.284
  388   2HG2  THR  48          2HG2      THR  48   0.763 -12.371   6.018
  389   3HG2  THR  48          3HG2      THR  48  -0.143 -10.898   5.669
  390    H    GLN  49           H        GLN  49  -3.541 -10.777   8.468
  391    HA   GLN  49           HA       GLN  49  -2.320 -12.513  10.565
  392   1HB   GLN  49          1HB       GLN  49  -3.573  -9.746  10.583
  393   2HB   GLN  49          2HB       GLN  49  -2.871 -10.530  11.999
  394   1HG   GLN  49          1HG       GLN  49  -1.338 -10.056   9.430
  395   2HG   GLN  49          2HG       GLN  49  -1.311  -8.940  10.796
  396   1HE2  GLN  49          2HE2      GLN  49   1.096 -10.185  10.011
  397   2HE2  GLN  49          1HE2      GLN  49   1.554 -11.317  11.190
  398    H    GLY  50           H        GLY  50  -5.424 -11.264   9.401
  399   1HA   GLY  50          2HA       GLY  50  -7.196 -11.879  11.419
  400   2HA   GLY  50          1HA       GLY  50  -6.851 -13.453  10.698
  401    H    ASN  51           H        ASN  51  -8.925 -13.721   9.776
  402    HA   ASN  51           HA       ASN  51  -9.793 -11.665   7.783
  403   1HB   ASN  51          1HB       ASN  51  -8.747 -14.374   7.372
  404   2HB   ASN  51          2HB       ASN  51 -10.317 -14.132   6.606
  405   1HD2  ASN  51          2HD2      ASN  51  -9.326 -14.110   4.447
  406   2HD2  ASN  51          1HD2      ASN  51  -8.422 -12.775   3.916
  407    H    LYS  52           H        LYS  52 -10.803 -14.934   8.863
  408    HA   LYS  52           HA       LYS  52 -13.548 -13.819   9.337
  409   1HB   LYS  52          1HB       LYS  52 -12.565 -15.950   7.760
  410   2HB   LYS  52          2HB       LYS  52 -13.382 -16.701   9.129
  411   1HG   LYS  52          1HG       LYS  52 -15.440 -15.949   8.487
  412   2HG   LYS  52          2HG       LYS  52 -14.805 -14.410   7.903
  413   1HD   LYS  52          1HD       LYS  52 -13.984 -16.815   6.368
  414   2HD   LYS  52          2HD       LYS  52 -15.686 -16.366   6.248
  415   1HE   LYS  52          1HE       LYS  52 -15.188 -14.240   5.335
  416   2HE   LYS  52          2HE       LYS  52 -13.503 -14.304   5.888
  417   1HZ   LYS  52          1HZ       LYS  52 -14.728 -16.142   3.900
  418   2HZ   LYS  52          2HZ       LYS  52 -13.684 -14.856   3.526
  419   3HZ   LYS  52          3HZ       LYS  52 -13.116 -16.180   4.426
  420    H    ALA  53           H        ALA  53 -14.518 -16.038  10.744
  421    HA   ALA  53           HA       ALA  53 -13.346 -15.551  13.405
  422   1HB   ALA  53          2HB       ALA  53 -15.500 -17.548  13.004
  423   2HB   ALA  53          3HB       ALA  53 -15.433 -16.177  14.112
  424   3HB   ALA  53          1HB       ALA  53 -15.863 -15.924  12.421
  425    HA   PRO  54           HA       PRO  54 -11.127 -19.327  13.769
  426   1HB   PRO  54          1HB       PRO  54 -11.850 -20.293  16.227
  427   2HB   PRO  54          2HB       PRO  54 -10.803 -18.875  16.016
  428   1HG   PRO  54          1HG       PRO  54 -13.705 -19.006  16.659
  429   2HG   PRO  54          2HG       PRO  54 -12.461 -17.904  17.271
  430   1HD   PRO  54          1HD       PRO  54 -14.265 -17.218  15.343
  431   2HD   PRO  54          2HD       PRO  54 -12.650 -16.488  15.484
  432    H    ALA  55           H        ALA  55 -11.379 -21.756  14.003
  433    HA   ALA  55           HA       ALA  55 -14.087 -22.881  13.982
  434   1HB   ALA  55          2HB       ALA  55 -13.636 -23.739  11.567
  435   2HB   ALA  55          3HB       ALA  55 -14.137 -22.059  11.764
  436   3HB   ALA  55          1HB       ALA  55 -12.438 -22.446  11.493
  437    H    ARG  56           H        ARG  56 -12.700 -23.946  15.755
  438    HA   ARG  56           HA       ARG  56 -11.075 -26.190  14.607
  439   1HB   ARG  56          1HB       ARG  56  -9.740 -24.619  15.875
  440   2HB   ARG  56          2HB       ARG  56 -10.903 -24.632  17.200
  441   1HG   ARG  56          1HG       ARG  56 -10.027 -26.518  18.083
  442   2HG   ARG  56          2HG       ARG  56  -9.964 -27.315  16.512
  443   1HD   ARG  56          1HD       ARG  56  -7.894 -26.008  15.971
  444   2HD   ARG  56          2HD       ARG  56  -7.925 -25.355  17.622
  445    HE   ARG  56           HE       ARG  56  -8.069 -27.961  18.202
  446   1HH1  ARG  56          1HH1      ARG  56  -5.583 -26.064  17.161
  447   2HH1  ARG  56          2HH1      ARG  56  -4.588 -27.344  16.552
  448   1HH2  ARG  56          1HH2      ARG  56  -7.065 -29.756  16.819
  449   2HH2  ARG  56          2HH2      ARG  56  -5.427 -29.433  16.358
  450    HA   PRO  57           HA       PRO  57 -14.819 -27.885  16.781
  451   1HB   PRO  57          1HB       PRO  57 -15.571 -29.573  14.763
  452   2HB   PRO  57          2HB       PRO  57 -16.102 -27.882  14.855
  453   1HG   PRO  57          1HG       PRO  57 -13.966 -29.105  13.186
  454   2HG   PRO  57          2HG       PRO  57 -15.112 -27.817  12.788
  455   1HD   PRO  57          1HD       PRO  57 -12.495 -27.374  13.454
  456   2HD   PRO  57          2HD       PRO  57 -13.793 -26.187  13.699
  457    H    ALA  58           H        ALA  58 -15.305 -30.575  16.503
  458    HA   ALA  58           HA       ALA  58 -13.147 -31.833  17.884
  459   1HB   ALA  58          1HB       ALA  58 -15.771 -32.337  17.388
  460   2HB   ALA  58          2HB       ALA  58 -15.024 -33.493  16.286
  461   3HB   ALA  58          3HB       ALA  58 -14.660 -33.557  18.011
  462    HA   PRO  59           HA       PRO  59 -10.512 -33.295  14.687
  463   1HB   PRO  59          1HB       PRO  59 -10.019 -35.899  15.369
  464   2HB   PRO  59          2HB       PRO  59  -9.350 -34.521  16.267
  465   1HG   PRO  59          1HG       PRO  59 -11.671 -36.260  16.923
  466   2HG   PRO  59          2HG       PRO  59 -10.450 -35.554  17.992
  467   1HD   PRO  59          1HD       PRO  59 -12.978 -34.554  17.700
  468   2HD   PRO  59          2HD       PRO  59 -11.577 -33.575  18.184
  469    H    ASP  60           H        ASP  60 -11.466 -33.473  12.673
  470    HA   ASP  60           HA       ASP  60 -12.982 -35.992  12.080
  471   1HB   ASP  60          1HB       ASP  60 -13.599 -33.145  11.219
  472   2HB   ASP  60          2HB       ASP  60 -14.498 -34.575  10.708
  473    H    ALA  61           H        ALA  61 -10.504 -36.294  11.372
  474    HA   ALA  61           HA       ALA  61  -9.207 -35.069   9.266
  475   1HB   ALA  61          1HB       ALA  61  -9.374 -37.702  10.471
  476   2HB   ALA  61          2HB       ALA  61  -9.053 -37.837   8.742
  477   3HB   ALA  61          3HB       ALA  61  -7.972 -36.895   9.769
  478    HA   PRO  62           HA       PRO  62 -12.485 -35.763   6.218
  479   1HB   PRO  62          1HB       PRO  62 -12.359 -33.279   5.095
  480   2HB   PRO  62          2HB       PRO  62 -13.253 -33.614   6.585
  481   1HG   PRO  62          1HG       PRO  62 -10.765 -32.137   6.211
  482   2HG   PRO  62          2HG       PRO  62 -11.876 -32.144   7.586
  483   1HD   PRO  62          1HD       PRO  62  -9.374 -33.550   7.288
  484   2HD   PRO  62          2HD       PRO  62 -10.432 -33.458   8.711
  485    H    GLU  63           H        GLU  63 -12.308 -36.134   3.925
  486    HA   GLU  63           HA       GLU  63  -9.568 -36.509   2.948
  487   1HB   GLU  63          1HB       GLU  63 -12.285 -37.400   2.393
  488   2HB   GLU  63          2HB       GLU  63 -11.434 -36.997   0.903
  489   1HG   GLU  63          1HG       GLU  63  -9.470 -38.370   1.984
  490   2HG   GLU  63          2HG       GLU  63 -10.756 -39.072   2.965
  491    H    ASP  64           H        ASP  64  -9.100 -35.747   0.617
  492    HA   ASP  64           HA       ASP  64  -9.720 -32.847   0.442
  493   1HB   ASP  64          1HB       ASP  64  -7.731 -34.719  -0.872
  494   2HB   ASP  64          2HB       ASP  64  -7.859 -33.009  -1.287
  495    H    THR  65           H        THR  65 -11.949 -33.148  -0.358
  496    HA   THR  65           HA       THR  65 -12.006 -33.600  -3.298
  497    HB   THR  65           HB       THR  65 -13.910 -34.949  -1.360
  498    HG1  THR  65           HG1      THR  65 -11.592 -35.906  -2.676
  499   1HG2  THR  65          1HG2      THR  65 -13.488 -34.973  -4.334
  500   2HG2  THR  65          2HG2      THR  65 -14.170 -36.387  -3.532
  501   3HG2  THR  65          3HG2      THR  65 -14.994 -34.832  -3.426
  502    H    GLY  66           H        GLY  66 -12.232 -31.171  -1.748
  503   1HA   GLY  66          2HA       GLY  66 -13.744 -29.407  -1.258
  504   2HA   GLY  66          1HA       GLY  66 -15.086 -30.517  -1.546
  505    H    ASP  67           H        ASP  67 -12.977 -28.149  -2.967
  506    HA   ASP  67           HA       ASP  67 -14.732 -28.014  -5.345
  507   1HB   ASP  67          1HB       ASP  67 -13.806 -26.105  -3.806
  508   2HB   ASP  67          2HB       ASP  67 -12.336 -26.283  -4.765
  509    H    SER  68           H        SER  68 -13.808 -28.006  -7.523
  510    HA   SER  68           HA       SER  68 -11.837 -30.077  -7.967
  511   1HB   SER  68          1HB       SER  68 -13.708 -29.569  -9.487
  512   2HB   SER  68          2HB       SER  68 -13.050 -27.961  -9.778
  513    HG   SER  68           HG       SER  68 -12.468 -30.226 -11.018
  514    H    ASP  69           H        ASP  69 -10.071 -29.045  -6.617
  515    HA   ASP  69           HA       ASP  69  -8.810 -26.575  -7.363
  516   1HB   ASP  69          1HB       ASP  69  -8.279 -28.967  -5.695
  517   2HB   ASP  69          2HB       ASP  69  -6.844 -28.078  -6.209
  518    H    GLU  70           H        GLU  70  -6.424 -26.614  -8.175
  519    HA   GLU  70           HA       GLU  70  -6.201 -28.517 -10.487
  520   1HB   GLU  70          1HB       GLU  70  -6.006 -25.574 -10.179
  521   2HB   GLU  70          2HB       GLU  70  -4.779 -26.303 -11.215
  522   1HG   GLU  70          1HG       GLU  70  -6.342 -26.245 -12.851
  523   2HG   GLU  70          2HG       GLU  70  -7.105 -27.592 -12.006
  524    H    TRP  71           H        TRP  71  -3.625 -27.903 -11.271
  525    HA   TRP  71           HA       TRP  71  -2.010 -29.284  -9.292
  526   1HB   TRP  71          1HB       TRP  71  -1.874 -29.394 -11.818
  527   2HB   TRP  71          2HB       TRP  71  -1.184 -27.772 -11.786
  528    HD1  TRP  71           HD1      TRP  71   1.302 -27.584 -11.410
  529    HE1  TRP  71           HE1      TRP  71   3.189 -29.210 -10.732
  530    HE3  TRP  71           HE3      TRP  71  -1.477 -31.689 -10.237
  531    HZ2  TRP  71           HZ2      TRP  71   3.466 -31.901  -9.810
  532    HZ3  TRP  71           HZ3      TRP  71  -0.384 -33.770  -9.458
  533    HH2  TRP  71           HH2      TRP  71   2.084 -33.884  -9.242
  534    H    VAL  72           H        VAL  72   0.246 -28.223  -8.758
  535    HA   VAL  72           HA       VAL  72  -0.297 -25.660  -7.409
  536    HB   VAL  72           HB       VAL  72   2.148 -27.458  -7.518
  537   1HG1  VAL  72          1HG1      VAL  72   1.392 -25.037  -5.902
  538   2HG1  VAL  72          2HG1      VAL  72   2.437 -26.271  -5.196
  539   3HG1  VAL  72          3HG1      VAL  72   2.934 -25.427  -6.663
  540   1HG2  VAL  72          1HG2      VAL  72  -0.337 -27.418  -5.820
  541   2HG2  VAL  72          2HG2      VAL  72   0.485 -28.797  -6.550
  542   3HG2  VAL  72          3HG2      VAL  72   1.180 -28.003  -5.138
  543    H    PHE  73           H        PHE  73   0.316 -26.128 -10.514
  544    HA   PHE  73           HA       PHE  73   2.740 -24.846 -11.191
  545   1HB   PHE  73          1HB       PHE  73   1.767 -24.685 -13.344
  546   2HB   PHE  73          2HB       PHE  73   0.933 -26.048 -12.608
  547    HD1  PHE  73           HD1      PHE  73  -1.190 -25.192 -11.061
  548    HD2  PHE  73           HD2      PHE  73   0.419 -23.214 -14.519
  549    HE1  PHE  73           HE1      PHE  73  -3.356 -24.041 -11.410
  550    HE2  PHE  73           HE2      PHE  73  -1.749 -22.062 -14.866
  551    HZ   PHE  73           HZ       PHE  73  -3.636 -22.475 -13.312
  552    H    ASP  74           H        ASP  74   2.389 -22.570 -12.557
  553    HA   ASP  74           HA       ASP  74   1.136 -20.628 -10.642
  554   1HB   ASP  74          1HB       ASP  74   3.692 -20.960 -10.576
  555   2HB   ASP  74          2HB       ASP  74   3.713 -20.190 -12.164
  556    H    LYS  75           H        LYS  75   0.018 -18.940 -11.630
  557    HA   LYS  75           HA       LYS  75   0.413 -18.188 -14.416
  558   1HB   LYS  75          1HB       LYS  75  -0.720 -20.388 -14.608
  559   2HB   LYS  75          2HB       LYS  75  -2.045 -19.781 -13.618
  560   1HG   LYS  75          1HG       LYS  75  -3.018 -19.036 -15.508
  561   2HG   LYS  75          2HG       LYS  75  -1.711 -17.858 -15.642
  562   1HD   LYS  75          1HD       LYS  75  -0.646 -19.032 -17.282
  563   2HD   LYS  75          2HD       LYS  75  -1.038 -20.592 -16.558
  564   1HE   LYS  75          1HE       LYS  75  -2.243 -20.373 -18.683
  565   2HE   LYS  75          2HE       LYS  75  -3.416 -20.285 -17.355
  566   1HZ   LYS  75          1HZ       LYS  75  -2.106 -17.925 -18.597
  567   2HZ   LYS  75          2HZ       LYS  75  -3.670 -18.461 -18.986
  568   3HZ   LYS  75          3HZ       LYS  75  -3.325 -17.903 -17.418
  569    H    LYS  76           H        LYS  76  -2.011 -18.298 -11.783
  570    HA   LYS  76           HA       LYS  76  -3.354 -15.861 -12.467
  571   1HB   LYS  76          1HB       LYS  76  -3.200 -17.810 -10.276
  572   2HB   LYS  76          2HB       LYS  76  -3.571 -16.179  -9.717
  573   1HG   LYS  76          1HG       LYS  76  -5.027 -17.402 -12.061
  574   2HG   LYS  76          2HG       LYS  76  -5.561 -17.678 -10.403
  575   1HD   LYS  76          1HD       LYS  76  -6.747 -15.757 -10.717
  576   2HD   LYS  76          2HD       LYS  76  -5.204 -14.971 -10.382
  577   1HE   LYS  76          1HE       LYS  76  -4.865 -14.397 -12.591
  578   2HE   LYS  76          2HE       LYS  76  -5.698 -15.840 -13.199
  579   1HZ   LYS  76          1HZ       LYS  76  -7.777 -14.869 -12.235
  580   2HZ   LYS  76          2HZ       LYS  76  -6.921 -13.423 -11.987
  581   3HZ   LYS  76          3HZ       LYS  76  -7.151 -14.018 -13.562
  582    H    LEU  77           H        LEU  77  -3.139 -13.757 -11.452
  583    HA   LEU  77           HA       LEU  77  -0.361 -12.974 -10.942
  584   1HB   LEU  77          1HB       LEU  77  -3.027 -11.721 -11.378
  585   2HB   LEU  77          2HB       LEU  77  -1.845 -10.760 -10.488
  586    HG   LEU  77           HG       LEU  77  -0.861 -12.133 -12.936
  587   1HD1  LEU  77          1HD1      LEU  77  -3.228 -11.054 -13.345
  588   2HD1  LEU  77          2HD1      LEU  77  -2.334  -9.536 -13.265
  589   3HD1  LEU  77          3HD1      LEU  77  -1.918 -10.740 -14.483
  590   1HD2  LEU  77          1HD2      LEU  77   0.275 -10.429 -11.232
  591   2HD2  LEU  77          2HD2      LEU  77   0.656 -10.379 -12.953
  592   3HD2  LEU  77          3HD2      LEU  77  -0.500  -9.235 -12.273
  593    H    LEU  78           H        LEU  78  -0.124 -11.324  -8.988
  594    HA   LEU  78           HA       LEU  78  -1.259 -12.660  -6.552
  595   1HB   LEU  78          1HB       LEU  78   0.855 -11.868  -5.488
  596   2HB   LEU  78          2HB       LEU  78   1.160 -12.922  -6.867
  597    HG   LEU  78           HG       LEU  78   0.925 -10.096  -7.623
  598   1HD1  LEU  78          1HD1      LEU  78   2.085 -10.266  -5.226
  599   2HD1  LEU  78          2HD1      LEU  78   3.474 -10.745  -6.202
  600   3HD1  LEU  78          3HD1      LEU  78   2.706  -9.180  -6.470
  601   1HD2  LEU  78          1HD2      LEU  78   2.673 -12.468  -8.145
  602   2HD2  LEU  78          2HD2      LEU  78   1.842 -11.415  -9.290
  603   3HD2  LEU  78          3HD2      LEU  78   3.324 -10.868  -8.506
  604    H    CYS  79           H        CYS  79  -2.740 -10.603  -7.864
  605    HA   CYS  79           HA       CYS  79  -2.638  -8.485  -5.762
  606   1HB   CYS  79          1HB       CYS  79  -2.868  -6.786  -7.574
  607   2HB   CYS  79          2HB       CYS  79  -1.361  -7.693  -7.705
  608    HG   CYS  79           HG       CYS  79  -2.718  -7.548 -10.049
  609    H    GLU  80           H        GLU  80  -4.501 -10.526  -5.725
  610    HA   GLU  80           HA       GLU  80  -6.923  -9.835  -7.207
  611   1HB   GLU  80          1HB       GLU  80  -6.193 -11.712  -4.946
  612   2HB   GLU  80          2HB       GLU  80  -7.844 -11.586  -5.558
  613   1HG   GLU  80          1HG       GLU  80  -6.862 -12.006  -7.883
  614   2HG   GLU  80          2HG       GLU  80  -5.370 -12.460  -7.060
  615    H    THR  81           H        THR  81  -6.616  -7.464  -6.269
  616    HA   THR  81           HA       THR  81  -7.887  -7.238  -3.570
  617    HB   THR  81           HB       THR  81  -7.081  -4.722  -4.299
  618    HG1  THR  81           HG1      THR  81  -5.000  -5.095  -5.270
  619   1HG2  THR  81          1HG2      THR  81  -5.598  -6.985  -2.965
  620   2HG2  THR  81          2HG2      THR  81  -4.921  -5.360  -3.060
  621   3HG2  THR  81          3HG2      THR  81  -6.441  -5.633  -2.208
  622    H    GLU  82           H        GLU  82  -9.273  -7.788  -6.240
  623    HA   GLU  82           HA       GLU  82 -11.203  -7.051  -7.390
  624   1HB   GLU  82          1HB       GLU  82 -11.716  -7.166  -4.809
  625   2HB   GLU  82          2HB       GLU  82 -11.788  -5.408  -4.941
  626   1HG   GLU  82          1HG       GLU  82 -13.555  -5.501  -6.544
  627   2HG   GLU  82          2HG       GLU  82 -13.335  -7.234  -6.789
  628    H    GLY  83           H        GLY  83  -9.847  -5.706  -8.861
  629   1HA   GLY  83          2HA       GLY  83 -10.183  -2.783  -8.311
  630   2HA   GLY  83          1HA       GLY  83 -10.387  -3.481  -9.918
  631    H    ARG  84           H        ARG  84  -7.862  -4.803  -7.950
  632    HA   ARG  84           HA       ARG  84  -5.515  -4.746  -8.196
  633   1HB   ARG  84          1HB       ARG  84  -6.705  -4.765 -10.699
  634   2HB   ARG  84          2HB       ARG  84  -5.605  -3.391 -10.805
  635   1HG   ARG  84          1HG       ARG  84  -3.734  -4.702 -10.642
  636   2HG   ARG  84          2HG       ARG  84  -4.507  -5.846  -9.543
  637   1HD   ARG  84          1HD       ARG  84  -4.521  -7.206 -11.396
  638   2HD   ARG  84          2HD       ARG  84  -5.955  -6.259 -11.839
  639    HE   ARG  84           HE       ARG  84  -3.912  -4.679 -12.757
  640   1HH1  ARG  84          1HH1      ARG  84  -1.992  -6.745 -13.159
  641   2HH1  ARG  84          2HH1      ARG  84  -2.427  -7.472 -14.669
  642   1HH2  ARG  84          1HH2      ARG  84  -5.639  -6.167 -14.680
  643   2HH2  ARG  84          2HH2      ARG  84  -4.491  -7.145 -15.530
  644    H    VAL  85           H        VAL  85  -4.679  -3.226  -6.784
  645    HA   VAL  85           HA       VAL  85  -5.223  -0.393  -6.941
  646    HB   VAL  85           HB       VAL  85  -3.700  -0.266  -5.091
  647   1HG1  VAL  85          1HG1      VAL  85  -5.797  -1.910  -5.005
  648   2HG1  VAL  85          2HG1      VAL  85  -4.532  -3.110  -4.738
  649   3HG1  VAL  85          3HG1      VAL  85  -4.698  -1.744  -3.635
  650   1HG2  VAL  85          1HG2      VAL  85  -2.533  -2.802  -6.259
  651   2HG2  VAL  85          2HG2      VAL  85  -1.716  -1.270  -5.953
  652   3HG2  VAL  85          3HG2      VAL  85  -2.197  -2.298  -4.603
  653    H    ARG  86           H        ARG  86  -3.923   1.280  -7.811
  654    HA   ARG  86           HA       ARG  86  -1.909   0.396  -9.821
  655   1HB   ARG  86          1HB       ARG  86  -3.824   1.872 -10.430
  656   2HB   ARG  86          2HB       ARG  86  -3.228   3.081  -9.295
  657   1HG   ARG  86          1HG       ARG  86  -2.321   3.800 -11.339
  658   2HG   ARG  86          2HG       ARG  86  -0.993   2.885 -10.622
  659   1HD   ARG  86          1HD       ARG  86  -2.118   0.852 -11.904
  660   2HD   ARG  86          2HD       ARG  86  -2.766   2.149 -12.927
  661    HE   ARG  86           HE       ARG  86  -0.300   2.960 -13.007
  662   1HH1  ARG  86          1HH1      ARG  86   0.197   0.291 -11.354
  663   2HH1  ARG  86          2HH1      ARG  86   0.976  -0.644 -12.587
  664   1HH2  ARG  86          1HH2      ARG  86   0.066   1.499 -15.158
  665   2HH2  ARG  86          2HH2      ARG  86   0.903   0.040 -14.740
  666    H    VAL  87           H        VAL  87  -0.064   0.039  -8.493
  667    HA   VAL  87           HA       VAL  87   0.928   2.405  -6.943
  668    HB   VAL  87           HB       VAL  87   1.198  -0.594  -6.706
  669   1HG1  VAL  87          1HG1      VAL  87   3.077   1.532  -5.736
  670   2HG1  VAL  87          2HG1      VAL  87   2.750   0.154  -4.684
  671   3HG1  VAL  87          3HG1      VAL  87   3.432  -0.103  -6.290
  672   1HG2  VAL  87          1HG2      VAL  87  -0.509   1.203  -5.556
  673   2HG2  VAL  87          2HG2      VAL  87  -0.045  -0.328  -4.815
  674   3HG2  VAL  87          3HG2      VAL  87   0.786   1.160  -4.360
  675    H    GLU  88           H        GLU  88   2.913   3.279  -7.520
  676    HA   GLU  88           HA       GLU  88   4.896   1.827  -9.088
  677   1HB   GLU  88          1HB       GLU  88   3.154   2.282 -10.775
  678   2HB   GLU  88          2HB       GLU  88   3.211   3.999 -10.379
  679   1HG   GLU  88          1HG       GLU  88   5.881   3.057 -10.929
  680   2HG   GLU  88          2HG       GLU  88   4.815   2.610 -12.261
  681    H    THR  89           H        THR  89   6.872   3.030  -9.224
  682    HA   THR  89           HA       THR  89   6.954   5.462  -7.488
  683    HB   THR  89           HB       THR  89   9.190   3.673  -8.488
  684    HG1  THR  89           HG1      THR  89   7.584   3.550  -6.159
  685   1HG2  THR  89          1HG2      THR  89   9.737   5.976  -7.589
  686   2HG2  THR  89          2HG2      THR  89   9.058   5.456  -6.047
  687   3HG2  THR  89          3HG2      THR  89  10.478   4.641  -6.705
  688    H    THR  90           H        THR  90   8.228   7.314  -8.227
  689    HA   THR  90           HA       THR  90   8.520   7.414 -11.208
  690    HB   THR  90           HB       THR  90   6.693   8.783 -10.374
  691    HG1  THR  90           HG1      THR  90   8.413  10.855 -10.695
  692   1HG2  THR  90          1HG2      THR  90   8.639   9.350  -8.261
  693   2HG2  THR  90          2HG2      THR  90   7.821  10.795  -8.855
  694   3HG2  THR  90          3HG2      THR  90   6.878   9.446  -8.226
  695    H    LYS  91           H        LYS  91   9.886   9.787 -11.419
  696    HA   LYS  91           HA       LYS  91  12.554   9.223 -11.393
  697   1HB   LYS  91          1HB       LYS  91  10.901  11.673 -11.144
  698   2HB   LYS  91          2HB       LYS  91  12.626  11.864 -10.830
  699   1HG   LYS  91          1HG       LYS  91  13.222  11.088 -12.989
  700   2HG   LYS  91          2HG       LYS  91  11.623  10.398 -13.272
  701   1HD   LYS  91          1HD       LYS  91  10.727  12.796 -13.076
  702   2HD   LYS  91          2HD       LYS  91  12.407  13.315 -13.217
  703   1HE   LYS  91          1HE       LYS  91  11.443  11.334 -15.234
  704   2HE   LYS  91          2HE       LYS  91  10.863  13.004 -15.390
  705   1HZ   LYS  91          1HZ       LYS  91  13.707  12.230 -15.012
  706   2HZ   LYS  91          2HZ       LYS  91  13.018  12.651 -16.504
  707   3HZ   LYS  91          3HZ       LYS  91  13.112  13.802 -15.258
  708    H    ASP  92           H        ASP  92  10.935  10.792  -8.553
  709    HA   ASP  92           HA       ASP  92  13.029   9.583  -6.833
  710   1HB   ASP  92          1HB       ASP  92  13.916  11.717  -7.808
  711   2HB   ASP  92          2HB       ASP  92  12.597  12.577  -7.013
  712    H    ARG  93           H        ARG  93  10.260   9.031  -6.759
  713    HA   ARG  93           HA       ARG  93   9.668   9.514  -3.996
  714   1HB   ARG  93          1HB       ARG  93   7.732  11.094  -4.356
  715   2HB   ARG  93          2HB       ARG  93   9.308  11.809  -4.678
  716   1HG   ARG  93          1HG       ARG  93   8.925  11.139  -7.130
  717   2HG   ARG  93          2HG       ARG  93   7.244  10.868  -6.667
  718   1HD   ARG  93          1HD       ARG  93   7.227  13.120  -7.384
  719   2HD   ARG  93          2HD       ARG  93   7.428  13.282  -5.628
  720    HE   ARG  93           HE       ARG  93   9.923  13.391  -6.086
  721   1HH1  ARG  93          1HH1      ARG  93   7.875  15.490  -7.461
  722   2HH1  ARG  93          2HH1      ARG  93   8.820  15.851  -8.868
  723   1HH2  ARG  93          1HH2      ARG  93  11.044  13.238  -8.371
  724   2HH2  ARG  93          2HH2      ARG  93  10.614  14.576  -9.382
  725    H    SER  94           H        SER  94   8.565   7.700  -3.528
  726    HA   SER  94           HA       SER  94   7.169   6.133  -5.535
  727   1HB   SER  94          1HB       SER  94   6.811   4.643  -3.647
  728   2HB   SER  94          2HB       SER  94   8.436   5.312  -3.521
  729    HG   SER  94           HG       SER  94   7.053   5.356  -1.572
  730    H    ILE  95           H        ILE  95   5.077   6.440  -6.175
  731    HA   ILE  95           HA       ILE  95   3.268   8.006  -4.372
  732    HB   ILE  95           HB       ILE  95   4.036   8.247  -7.106
  733   1HG1  ILE  95          1HG1      ILE  95   2.088  10.045  -6.916
  734   2HG1  ILE  95          2HG1      ILE  95   2.165   9.607  -5.210
  735   1HG2  ILE  95          1HG2      ILE  95   1.114   7.500  -6.777
  736   2HG2  ILE  95          2HG2      ILE  95   1.816   8.216  -8.226
  737   3HG2  ILE  95          3HG2      ILE  95   2.317   6.607  -7.708
  738   1HD1  ILE  95          1HD1      ILE  95   4.828   9.971  -6.342
  739   2HD1  ILE  95          2HD1      ILE  95   3.839  11.421  -6.521
  740   3HD1  ILE  95          3HD1      ILE  95   4.105  10.728  -4.922
  741    H    PHE  96           H        PHE  96   1.498   6.936  -3.573
  742    HA   PHE  96           HA       PHE  96   0.837   4.271  -4.775
  743   1HB   PHE  96          1HB       PHE  96   1.745   4.222  -2.484
  744   2HB   PHE  96          2HB       PHE  96   0.509   5.358  -1.958
  745    HD1  PHE  96           HD1      PHE  96   0.081   3.461  -0.242
  746    HD2  PHE  96           HD2      PHE  96  -0.730   3.082  -4.447
  747    HE1  PHE  96           HE1      PHE  96  -1.454   1.566   0.217
  748    HE2  PHE  96           HE2      PHE  96  -2.263   1.194  -3.983
  749    HZ   PHE  96           HZ       PHE  96  -2.627   0.434  -1.653
  750    H    THR  97           H        THR  97  -0.744   4.997  -6.245
  751    HA   THR  97           HA       THR  97  -3.144   6.324  -5.030
  752    HB   THR  97           HB       THR  97  -2.189   7.856  -6.565
  753    HG1  THR  97           HG1      THR  97  -3.610   7.685  -8.416
  754   1HG2  THR  97          1HG2      THR  97  -1.611   5.412  -8.236
  755   2HG2  THR  97          2HG2      THR  97  -1.578   7.032  -8.934
  756   3HG2  THR  97          3HG2      THR  97  -0.478   6.615  -7.620
  757    H    VAL  98           H        VAL  98  -4.861   4.963  -4.950
  758    HA   VAL  98           HA       VAL  98  -5.116   2.852  -7.063
  759    HB   VAL  98           HB       VAL  98  -4.248   1.839  -5.050
  760   1HG1  VAL  98          1HG1      VAL  98  -6.481   3.305  -3.613
  761   2HG1  VAL  98          2HG1      VAL  98  -5.397   2.132  -2.866
  762   3HG1  VAL  98          3HG1      VAL  98  -4.757   3.653  -3.486
  763   1HG2  VAL  98          1HG2      VAL  98  -6.468   0.945  -6.238
  764   2HG2  VAL  98          2HG2      VAL  98  -5.814   0.159  -4.802
  765   3HG2  VAL  98          3HG2      VAL  98  -7.159   1.288  -4.652
  766    H    GLU  99           H        GLU  99  -7.155   2.726  -7.946
  767    HA   GLU  99           HA       GLU  99  -9.263   4.509  -6.816
  768   1HB   GLU  99          1HB       GLU  99  -8.528   3.364  -9.485
  769   2HB   GLU  99          2HB       GLU  99 -10.222   3.767  -9.198
  770   1HG   GLU  99          1HG       GLU  99  -9.806   6.028  -9.048
  771   2HG   GLU  99          2HG       GLU  99  -8.179   5.793  -8.408
  772    H    GLY 100           H        GLY 100  -8.836   2.138  -5.385
  773   1HA   GLY 100          2HA       GLY 100 -10.358  -0.114  -6.183
  774   2HA   GLY 100          1HA       GLY 100 -11.447   0.984  -5.332
  775    H    ALA 101           H        ALA 101  -9.293   1.994  -3.570
  776    HA   ALA 101           HA       ALA 101  -8.101  -0.201  -2.116
  777   1HB   ALA 101          3HB       ALA 101  -7.092   1.920  -1.919
  778   2HB   ALA 101          1HB       ALA 101  -8.635   2.727  -1.644
  779   3HB   ALA 101          2HB       ALA 101  -7.923   1.730  -0.376
  780    H    GLU 102           H        GLU 102 -10.018  -1.593  -1.818
  781    HA   GLU 102           HA       GLU 102 -12.176  -0.601  -0.047
  782   1HB   GLU 102          1HB       GLU 102 -11.729  -2.702  -2.021
  783   2HB   GLU 102          2HB       GLU 102 -12.499  -3.337  -0.566
  784   1HG   GLU 102          1HG       GLU 102 -14.095  -1.319  -0.746
  785   2HG   GLU 102          2HG       GLU 102 -13.479  -1.139  -2.389
  786    H    LYS 103           H        LYS 103 -12.816  -2.761   1.470
  787    HA   LYS 103           HA       LYS 103 -11.137  -2.668   3.726
  788   1HB   LYS 103          1HB       LYS 103 -13.368  -4.260   2.682
  789   2HB   LYS 103          2HB       LYS 103 -12.335  -5.180   3.777
  790   1HG   LYS 103          1HG       LYS 103 -13.377  -2.419   4.450
  791   2HG   LYS 103          2HG       LYS 103 -14.238  -3.896   4.885
  792   1HD   LYS 103          1HD       LYS 103 -12.289  -4.687   6.150
  793   2HD   LYS 103          2HD       LYS 103 -11.384  -3.246   5.682
  794   1HE   LYS 103          1HE       LYS 103 -13.657  -2.120   6.735
  795   2HE   LYS 103          2HE       LYS 103 -13.458  -3.555   7.763
  796   1HZ   LYS 103          1HZ       LYS 103 -11.086  -2.963   7.978
  797   2HZ   LYS 103          2HZ       LYS 103 -11.383  -1.522   7.134
  798   3HZ   LYS 103          3HZ       LYS 103 -12.115  -1.786   8.645
  799    H    GLU 104           H        GLU 104 -10.990  -4.812   0.907
  800    HA   GLU 104           HA       GLU 104  -9.106  -6.718   1.884
  801   1HB   GLU 104          1HB       GLU 104  -9.677  -5.565  -0.863
  802   2HB   GLU 104          2HB       GLU 104  -8.640  -6.967  -0.599
  803   1HG   GLU 104          1HG       GLU 104 -11.316  -7.029   0.700
  804   2HG   GLU 104          2HG       GLU 104 -11.287  -7.194  -1.056
  805    H    ASP 105           H        ASP 105  -8.728  -3.404   0.823
  806    HA   ASP 105           HA       ASP 105  -5.783  -3.629   0.601
  807   1HB   ASP 105          1HB       ASP 105  -7.397  -2.268  -0.884
  808   2HB   ASP 105          2HB       ASP 105  -7.511  -1.150   0.475
  809    H    GLU 106           H        GLU 106  -8.258  -2.361   2.782
  810    HA   GLU 106           HA       GLU 106  -6.761  -0.688   4.474
  811   1HB   GLU 106          1HB       GLU 106  -9.280  -1.536   4.385
  812   2HB   GLU 106          2HB       GLU 106  -8.702  -2.668   5.606
  813   1HG   GLU 106          1HG       GLU 106  -7.934   0.183   5.963
  814   2HG   GLU 106          2HG       GLU 106  -9.628  -0.225   6.241
  815    H    GLY 107           H        GLY 107  -5.944  -1.248   6.708
  816   1HA   GLY 107          2HA       GLY 107  -4.531  -3.882   6.678
  817   2HA   GLY 107          1HA       GLY 107  -5.231  -3.222   8.157
  818    H    VAL 108           H        VAL 108  -2.365  -3.630   6.681
  819    HA   VAL 108           HA       VAL 108  -1.230  -0.978   7.447
  820    HB   VAL 108           HB       VAL 108  -0.453  -3.711   8.511
  821   1HG1  VAL 108          1HG1      VAL 108   0.982  -1.069   8.519
  822   2HG1  VAL 108          2HG1      VAL 108   1.168  -2.165   9.887
  823   3HG1  VAL 108          3HG1      VAL 108   1.636  -2.688   8.270
  824   1HG2  VAL 108          1HG2      VAL 108  -1.728  -1.232   9.644
  825   2HG2  VAL 108          2HG2      VAL 108  -2.219  -2.917   9.832
  826   3HG2  VAL 108          3HG2      VAL 108  -0.807  -2.307  10.695
  827    H    TYR 109           H        TYR 109   0.910  -0.628   6.517
  828    HA   TYR 109           HA       TYR 109   1.730  -2.596   4.416
  829   1HB   TYR 109          1HB       TYR 109   1.099   0.353   4.151
  830   2HB   TYR 109          2HB       TYR 109   2.102  -0.491   2.974
  831    HD1  TYR 109           HD1      TYR 109   1.151  -1.878   1.311
  832    HD2  TYR 109           HD2      TYR 109  -1.251  -0.529   4.605
  833    HE1  TYR 109           HE1      TYR 109  -0.876  -2.768   0.195
  834    HE2  TYR 109           HE2      TYR 109  -3.279  -1.419   3.489
  835    HH   TYR 109           HH       TYR 109  -4.076  -2.080   1.377
  836    H    THR 110           H        THR 110   3.971  -2.487   3.885
  837    HA   THR 110           HA       THR 110   5.655  -0.686   5.586
  838    HB   THR 110           HB       THR 110   6.290  -3.581   4.956
  839    HG1  THR 110           HG1      THR 110   4.530  -3.810   6.172
  840   1HG2  THR 110          1HG2      THR 110   7.302  -1.530   6.933
  841   2HG2  THR 110          2HG2      THR 110   7.670  -3.249   7.074
  842   3HG2  THR 110          3HG2      THR 110   8.210  -2.345   5.660
  843    H    VAL 111           H        VAL 111   6.327   0.651   3.893
  844    HA   VAL 111           HA       VAL 111   7.057  -0.508   1.302
  845    HB   VAL 111           HB       VAL 111   5.829   1.681   1.814
  846   1HG1  VAL 111          1HG1      VAL 111   7.389   2.511   3.529
  847   2HG1  VAL 111          2HG1      VAL 111   8.668   2.601   2.319
  848   3HG1  VAL 111          3HG1      VAL 111   7.254   3.646   2.186
  849   1HG2  VAL 111          1HG2      VAL 111   8.188   1.458  -0.044
  850   2HG2  VAL 111          2HG2      VAL 111   6.476   1.284  -0.423
  851   3HG2  VAL 111          3HG2      VAL 111   7.139   2.876  -0.050
  852    H    THR 112           H        THR 112   9.107  -1.038   0.675
  853    HA   THR 112           HA       THR 112  11.357  -0.273   2.509
  854    HB   THR 112           HB       THR 112  10.745  -2.698   0.804
  855    HG1  THR 112           HG1      THR 112  10.468  -3.628   2.690
  856   1HG2  THR 112          1HG2      THR 112  13.350  -1.661   1.767
  857   2HG2  THR 112          2HG2      THR 112  13.044  -3.370   2.074
  858   3HG2  THR 112          3HG2      THR 112  12.997  -2.748   0.425
  859    H    VAL 113           H        VAL 113  12.788   1.139   1.602
  860    HA   VAL 113           HA       VAL 113  12.867   1.468  -1.356
  861    HB   VAL 113           HB       VAL 113  13.975   3.565  -0.825
  862   1HG1  VAL 113          1HG1      VAL 113  11.503   3.393  -0.389
  863   2HG1  VAL 113          2HG1      VAL 113  11.879   3.107   1.309
  864   3HG1  VAL 113          3HG1      VAL 113  12.316   4.640   0.556
  865   1HG2  VAL 113          1HG2      VAL 113  14.222   2.393   1.960
  866   2HG2  VAL 113          2HG2      VAL 113  15.533   2.851   0.873
  867   3HG2  VAL 113          3HG2      VAL 113  14.510   4.093   1.593
  868    H    LYS 114           H        LYS 114  14.552   0.553  -2.517
  869    HA   LYS 114           HA       LYS 114  17.015  -0.233  -0.992
  870   1HB   LYS 114          1HB       LYS 114  15.124  -1.961  -1.767
  871   2HB   LYS 114          2HB       LYS 114  16.024  -1.872  -3.281
  872   1HG   LYS 114          1HG       LYS 114  17.565  -3.271  -2.431
  873   2HG   LYS 114          2HG       LYS 114  17.938  -2.081  -1.185
  874   1HD   LYS 114          1HD       LYS 114  16.688  -3.152   0.404
  875   2HD   LYS 114          2HD       LYS 114  15.464  -3.664  -0.759
  876   1HE   LYS 114          1HE       LYS 114  17.504  -5.169  -1.654
  877   2HE   LYS 114          2HE       LYS 114  17.990  -5.032   0.048
  878   1HZ   LYS 114          1HZ       LYS 114  15.233  -5.711  -0.814
  879   2HZ   LYS 114          2HZ       LYS 114  16.399  -6.885  -0.429
  880   3HZ   LYS 114          3HZ       LYS 114  15.874  -5.791   0.757
  881    H    ASN 115           H        ASN 115  18.903  -0.597  -2.442
  882    HA   ASN 115           HA       ASN 115  18.942   0.351  -5.175
  883   1HB   ASN 115          1HB       ASN 115  18.944   2.278  -3.070
  884   2HB   ASN 115          2HB       ASN 115  20.557   2.278  -3.777
  885   1HD2  ASN 115          2HD2      ASN 115  18.791   4.504  -4.121
  886   2HD2  ASN 115          1HD2      ASN 115  18.345   4.590  -5.756
  887    HA   PRO 116           HA       PRO 116  22.850  -1.628  -5.040
  888   1HB   PRO 116          1HB       PRO 116  24.518  -0.042  -6.524
  889   2HB   PRO 116          2HB       PRO 116  23.235  -1.043  -7.234
  890   1HG   PRO 116          1HG       PRO 116  23.252   1.876  -6.650
  891   2HG   PRO 116          2HG       PRO 116  22.577   1.006  -8.036
  892   1HD   PRO 116          1HD       PRO 116  21.066   1.931  -5.974
  893   2HD   PRO 116          2HD       PRO 116  20.627   0.506  -6.940
  894    H    VAL 117           H        VAL 117  22.531   1.394  -3.514
  895    HA   VAL 117           HA       VAL 117  25.323   1.293  -2.456
  896    HB   VAL 117           HB       VAL 117  23.208   3.455  -2.232
  897   1HG1  VAL 117          1HG1      VAL 117  26.198   3.431  -1.730
  898   2HG1  VAL 117          2HG1      VAL 117  25.179   4.870  -1.683
  899   3HG1  VAL 117          3HG1      VAL 117  24.938   3.582  -0.505
  900   1HG2  VAL 117          1HG2      VAL 117  23.921   2.942  -4.591
  901   2HG2  VAL 117          2HG2      VAL 117  24.362   4.563  -4.059
  902   3HG2  VAL 117          3HG2      VAL 117  25.582   3.292  -4.113
  903    H    GLY 118           H        GLY 118  21.894   1.251  -1.428
  904   1HA   GLY 118          2HA       GLY 118  22.199   1.446   1.348
  905   2HA   GLY 118          1HA       GLY 118  22.581  -0.232   0.965
  906    H    GLU 119           H        GLU 119  20.278   0.829   2.475
  907    HA   GLU 119           HA       GLU 119  17.908   0.662   0.797
  908   1HB   GLU 119          1HB       GLU 119  17.223  -1.589   1.556
  909   2HB   GLU 119          2HB       GLU 119  18.765  -1.663   0.703
  910   1HG   GLU 119          1HG       GLU 119  19.682  -1.260   3.203
  911   2HG   GLU 119          2HG       GLU 119  18.172  -2.089   3.588
  912    H    ASP 120           H        ASP 120  16.023   1.137   2.017
  913    HA   ASP 120           HA       ASP 120  16.376   1.462   4.975
  914   1HB   ASP 120          1HB       ASP 120  16.378   3.496   3.082
  915   2HB   ASP 120          2HB       ASP 120  14.709   3.483   3.653
  916    H    GLN 121           H        GLN 121  14.095   1.858   5.993
  917    HA   GLN 121           HA       GLN 121  11.921   0.524   4.452
  918   1HB   GLN 121          1HB       GLN 121  13.539  -0.593   6.616
  919   2HB   GLN 121          2HB       GLN 121  11.815  -0.641   6.984
  920   1HG   GLN 121          1HG       GLN 121  11.318  -1.965   5.110
  921   2HG   GLN 121          2HG       GLN 121  12.818  -1.532   4.289
  922   1HE2  GLN 121          2HE2      GLN 121  11.547  -4.214   5.412
  923   2HE2  GLN 121          1HE2      GLN 121  12.869  -4.940   6.190
  924    H    VAL 122           H        VAL 122   9.815   0.902   5.366
  925    HA   VAL 122           HA       VAL 122   9.501   2.582   7.750
  926    HB   VAL 122           HB       VAL 122   9.936   4.439   6.426
  927   1HG1  VAL 122          1HG1      VAL 122   9.256   2.586   4.219
  928   2HG1  VAL 122          2HG1      VAL 122   8.934   4.291   3.912
  929   3HG1  VAL 122          3HG1      VAL 122  10.562   3.764   4.340
  930   1HG2  VAL 122          1HG2      VAL 122   7.524   4.523   7.145
  931   2HG2  VAL 122          2HG2      VAL 122   7.864   5.470   5.696
  932   3HG2  VAL 122          3HG2      VAL 122   7.079   3.896   5.558
  933    H    ASN 123           H        ASN 123   7.156   2.866   8.230
  934    HA   ASN 123           HA       ASN 123   5.548   0.660   6.999
  935   1HB   ASN 123          1HB       ASN 123   5.177   2.123   9.627
  936   2HB   ASN 123          2HB       ASN 123   4.378   0.634   9.130
  937   1HD2  ASN 123          2HD2      ASN 123   6.441   1.327  11.380
  938   2HD2  ASN 123          1HD2      ASN 123   7.614   0.112  11.213
  939    H    LEU 124           H        LEU 124   3.562   1.123   6.097
  940    HA   LEU 124           HA       LEU 124   2.722   3.998   6.039
  941   1HB   LEU 124          1HB       LEU 124   3.504   3.197   3.892
  942   2HB   LEU 124          2HB       LEU 124   2.532   1.736   4.029
  943    HG   LEU 124           HG       LEU 124   0.773   3.985   4.332
  944   1HD1  LEU 124          1HD1      LEU 124   2.927   4.843   2.892
  945   2HD1  LEU 124          2HD1      LEU 124   1.921   4.169   1.611
  946   3HD1  LEU 124          3HD1      LEU 124   1.286   5.439   2.655
  947   1HD2  LEU 124          1HD2      LEU 124   1.218   1.668   2.492
  948   2HD2  LEU 124          2HD2      LEU 124  -0.217   2.098   3.423
  949   3HD2  LEU 124          3HD2      LEU 124   0.150   2.953   1.925
  950    H    THR 125           H        THR 125   0.867   4.307   7.213
  951    HA   THR 125           HA       THR 125  -0.839   2.045   7.981
  952    HB   THR 125           HB       THR 125  -1.362   4.990   8.403
  953    HG1  THR 125           HG1      THR 125   0.541   5.029   9.280
  954   1HG2  THR 125          1HG2      THR 125  -2.789   2.828   9.165
  955   2HG2  THR 125          2HG2      THR 125  -1.671   2.935  10.524
  956   3HG2  THR 125          3HG2      THR 125  -2.707   4.306  10.123
  957    H    VAL 126           H        VAL 126  -2.949   1.668   7.231
  958    HA   VAL 126           HA       VAL 126  -3.919   3.436   5.017
  959    HB   VAL 126           HB       VAL 126  -2.907   1.369   4.152
  960   1HG1  VAL 126          1HG1      VAL 126  -4.463   0.207   6.381
  961   2HG1  VAL 126          2HG1      VAL 126  -4.525  -0.715   4.880
  962   3HG1  VAL 126          3HG1      VAL 126  -2.971  -0.360   5.632
  963   1HG2  VAL 126          1HG2      VAL 126  -5.059   2.341   3.170
  964   2HG2  VAL 126          2HG2      VAL 126  -4.739   0.650   2.789
  965   3HG2  VAL 126          3HG2      VAL 126  -5.917   1.066   4.034
  966    H    LYS 127           H        LYS 127  -6.311   3.359   4.739
  967    HA   LYS 127           HA       LYS 127  -7.962   2.012   6.732
  968   1HB   LYS 127          1HB       LYS 127  -6.792   3.908   7.955
  969   2HB   LYS 127          2HB       LYS 127  -7.677   5.023   6.913
  970   1HG   LYS 127          1HG       LYS 127  -9.754   4.432   7.823
  971   2HG   LYS 127          2HG       LYS 127  -9.154   2.892   8.438
  972   1HD   LYS 127          1HD       LYS 127  -9.308   4.231  10.374
  973   2HD   LYS 127          2HD       LYS 127  -7.603   4.336   9.935
  974   1HE   LYS 127          1HE       LYS 127  -9.312   6.364   8.626
  975   2HE   LYS 127          2HE       LYS 127  -9.183   6.527  10.389
  976   1HZ   LYS 127          1HZ       LYS 127  -6.897   6.165   8.524
  977   2HZ   LYS 127          2HZ       LYS 127  -7.335   7.631   9.259
  978   3HZ   LYS 127          3HZ       LYS 127  -6.788   6.338  10.210
  979    H    VAL 128           H        VAL 128  -9.619   1.493   5.346
  980    HA   VAL 128           HA       VAL 128 -10.455   3.409   3.246
  981    HB   VAL 128           HB       VAL 128 -11.332   0.584   3.951
  982   1HG1  VAL 128          1HG1      VAL 128 -12.973   2.015   2.653
  983   2HG1  VAL 128          2HG1      VAL 128 -11.759   2.123   1.379
  984   3HG1  VAL 128          3HG1      VAL 128 -12.441   0.556   1.817
  985   1HG2  VAL 128          1HG2      VAL 128  -9.263   1.711   2.065
  986   2HG2  VAL 128          2HG2      VAL 128  -9.084   0.410   3.243
  987   3HG2  VAL 128          3HG2      VAL 128 -10.005   0.140   1.763
  988    H    ILE 129           H        ILE 129 -12.036   4.864   3.744
  989    HA   ILE 129           HA       ILE 129 -13.845   4.371   6.036
  990    HB   ILE 129           HB       ILE 129 -13.314   6.720   4.185
  991   1HG1  ILE 129          1HG1      ILE 129 -11.448   6.171   5.693
  992   2HG1  ILE 129          2HG1      ILE 129 -12.219   7.675   6.195
  993   1HG2  ILE 129          1HG2      ILE 129 -15.123   6.427   6.590
  994   2HG2  ILE 129          2HG2      ILE 129 -14.577   7.993   5.987
  995   3HG2  ILE 129          3HG2      ILE 129 -15.563   6.949   4.964
  996   1HD1  ILE 129          1HD1      ILE 129 -13.620   6.270   7.801
  997   2HD1  ILE 129          2HD1      ILE 129 -12.531   4.931   7.435
  998   3HD1  ILE 129          3HD1      ILE 129 -11.905   6.395   8.194
  999    H    ASP 130           H        ASP 130 -16.212   4.786   5.677
 1000    HA   ASP 130           HA       ASP 130 -17.081   4.109   2.886
 1001   1HB   ASP 130          1HB       ASP 130 -17.073   2.395   4.998
 1002   2HB   ASP 130          2HB       ASP 130 -18.668   3.123   5.196

  No H/Q in entry =        1002