*HEADER    PLANT PROTEIN                           20-FEB-19   6JI7              
*TITLE     COFFEETIDES: IRON-BINDING CYSTEINE RICH PEPTIDES FROM COFFEE WASTE    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COFFEETIDE;                                                
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: COFFEA CANEPHORA;                               
*SOURCE   3 ORGANISM_TAXID: 49390                                                
*KEYWDS    COFFEE, CYSTEINE-RICH PEPTIDE, IRON-BINDING, STABLE, COFFEE HUSK,     
*KEYWDS   2 PLANT PROTEIN                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    J.S.FAN,J.Y.HUANG,K.H.WONG,S.V.TAY                                    
*REVDAT   1   26-FEB-20 6JI7    0                                                
# Restraints file 1: constraints.tab
assign (resid 2 and name HA )(resid 2 and name HN ) 2.9 1.1 0.0
assign (resid 2 and name HA )(resid 3 and name HN ) 2.9 1.1 0.0
assign (resid 2 and name HB# )(resid 2 and name HN ) 3.5 1.7 0.6
assign (resid 2 and name HG# )(resid 2 and name HN ) 5 3.2 1.0
assign (resid 2 and name HN )(resid 3 and name HN ) 5 3.2 0.0
assign (resid 3 and name HA# )(resid 3 and name HN ) 2.9 1.1 0.6
assign (resid 3 and name HA# )(resid 4 and name HN ) 2.9 1.1 1.0
assign (resid 3 and name HN )(resid 4 and name HN ) 3.5 1.7 0.0
assign (resid 4 and name HA )(resid 4 and name HN ) 3.5 1.7 0.0
assign (resid 4 and name HA )(resid 5 and name HN ) 2.9 1.1 0.0
assign (resid 4 and name HB# )(resid 4 and name HN ) 3.5 1.7 0.6
assign (resid 4 and name HB# )(resid 5 and name HN ) 3.5 1.7 1.0
assign (resid 4 and name HG# )(resid 4 and name HN ) 5 3.2 1.0
assign (resid 4 and name HG# )(resid 5 and name HN ) 3.5 1.7 1.0
assign (resid 4 and name HN )(resid 5 and name HN ) 3.5 1.7 0.0
assign (resid 5 and name HA )(resid 10 and name HN ) 3.5 1.7 0.0
assign (resid 5 and name HA )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 5 and name HA )(resid 5 and name HN ) 2.9 1.1 0.0
assign (resid 5 and name HA )(resid 6 and name HN ) 2.9 1.1 0.0
assign (resid 5 and name HB# )(resid 10 and name HN ) 3.5 1.7 1.0
assign (resid 5 and name HB# )(resid 20 and name HN ) 3.5 1.7 1.0
assign (resid 5 and name HB# )(resid 5 and name HN ) 2.9 1.1 0.6
assign (resid 5 and name HB# )(resid 6 and name HN ) 3.5 1.7 1.0
assign (resid 5 and name HB# )(resid 19 and name HN ) 5 3.2 1.0
assign (resid 6 and name HA )(resid 10 and name HN ) 5 3.2 0.0
assign (resid 6 and name HA )(resid 6 and name HN ) 3.5 1.7 0.0
assign (resid 6 and name HB# )(resid 10 and name HN ) 5 3.2 1.0
assign (resid 6 and name HB# )(resid 20 and name HN ) 5 3.2 1.0
assign (resid 6 and name HB# )(resid 6 and name HN ) 2.9 1.1 0.6
assign (resid 6 and name HN )(resid 19 and name HA ) 3.5 1.7 0.0
assign (resid 6 and name HN )(resid 10 and name HN ) 5 3.2 0.0
assign (resid 6 and name HN )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 7 and name HA )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 7 and name HA )(resid 8 and name HN ) 2.9 1.1 0.0
assign (resid 7 and name HB# )(resid 8 and name HN ) 2.9 1.1 1.0
assign (resid 8 and name HA )(resid 10 and name HN ) 5 3.2 0.0
assign (resid 8 and name HA )(resid 8 and name HD# ) 2.9 1.1 1.7
assign (resid 8 and name HA )(resid 8 and name HN ) 2.9 1.1 0.0
assign (resid 8 and name HA )(resid 9 and name HN ) 2.9 1.1 0.0
assign (resid 8 and name HB# )(resid 8 and name HD# ) 2.9 1.1 3.4
assign (resid 34 and name HA )(resid 8 and name HD# ) 2.9 1.1 2
assign (resid 8 and name HB# )(resid 8 and name HN ) 2.9 1.1 0.6
assign (resid 8 and name HB# )(resid 9 and name HN ) 5 3.2 1.0
assign (resid 8 and name HD# )(resid 8 and name HN ) 2.9 1.1 1.7
assign (resid 8 and name HD# )(resid 9 and name HN ) 2.9 1.1 2.4
assign (resid 8 and name HD# )(resid 37 and name HN ) 2.9 1.1 2.4
assign (resid 8 and name HN )(resid 9 and name HN ) 5 3.2 0.0
assign (resid 9 and name HA# )(resid 10 and name HN ) 3.5 1.7 1.0
assign (resid 9 and name HA# )(resid 9 and name HN ) 2.9 1.1 0.6
assign (resid 9 and name HN )(resid 10 and name HN ) 3.5 1.7 0.0
assign (resid 9 and name HN )(resid 33 and name HB# ) 3.5 1.7 1.0
assign (resid 9 and name HN )(resid 33 and name HN ) 5 3.2 0.0
assign (resid 10 and name HA )(resid 10 and name HN ) 3.5 1.7 0.0
assign (resid 10 and name HB# )(resid 10 and name HN ) 2.9 1.1 0.6
assign (resid 10 and name HG# )(resid 10 and name HN ) 5 3.2 1.0
assign (resid 11 and name HA )(resid 12 and name HN ) 2.9 1.1 0.0
assign (resid 11 and name HA )(resid 13 and name HN ) 5 3.2 0.0
assign (resid 12 and name HA )(resid 12 and name HN ) 5 3.2 0.0
assign (resid 12 and name HB# )(resid 12 and name HN ) 5 3.2 0.6
assign (resid 12 and name HN )(resid 13 and name HB# ) 3.5 1.7 1.5
assign (resid 12 and name HN )(resid 13 and name HN ) 2.9 1.1 0.0
assign (resid 13 and name HA )(resid 13 and name HN ) 5 3.2 0.0
assign (resid 13 and name HA )(resid 14 and name HN ) 2.9 1.1 0.0
assign (resid 13 and name HA )(resid 15 and name HN ) 5 3.2 0.0
assign (resid 13 and name HB# )(resid 13 and name HN ) 2.9 1.1 1.1
assign (resid 13 and name HB# )(resid 14 and name HN ) 2.9 1.1 1.1
assign (resid 13 and name HB# )(resid 27 and name HD1 ) 5 3.2 1.5
assign (resid 13 and name HB# )(resid 27 and name HZ2 ) 3.5 1.7 1.5
assign (resid 13 and name HN )(resid 14 and name HN ) 5 3.2 0.0
assign (resid 14 and name HA# )(resid 14 and name HN ) 2.9 1.1 0.6
assign (resid 14 and name HA# )(resid 15 and name HN ) 3.5 1.7 1.0
assign (resid 14 and name HA# )(resid 17 and name HN ) 3.5 1.7 1.0
assign (resid 14 and name HN )(resid 15 and name HN ) 2.9 1.1 0.0
assign (resid 15 and name HA )(resid 15 and name HN ) 3.5 1.7 0.0
assign (resid 15 and name HA )(resid 16 and name HA ) 3.5 1.7 0.0
assign (resid 15 and name HA )(resid 17 and name HN ) 5 3.2 0.0
assign (resid 15 and name HB# )(resid 15 and name HD22 ) 3.5 1.7 1.0
assign (resid 15 and name HB# )(resid 15 and name HN ) 2.9 1.1 0.6
assign (resid 15 and name HB# )(resid 18 and name HN ) 5 3.2 1.0
assign (resid 15 and name HD21 )(resid 15 and name HD22 ) 2.9 1.1 0.0
assign (resid 15 and name HN )(resid 17 and name HN ) 3.5 1.7 0.0
assign (resid 16 and name HA )(resid 17 and name HD1 ) 5 3.2 0.0
assign (resid 16 and name HA )(resid 17 and name HN ) 5 3.2 0.0
assign (resid 16 and name HB# )(resid 17 and name HN ) 5 3.2 1.0
assign (resid 16 and name HG# )(resid 17 and name HN ) 5 3.2 1.0
assign (resid 17 and name HA )(resid 17 and name HD1 ) 5 3.2 0.0
assign (resid 17 and name HA )(resid 17 and name HN ) 3.5 1.7 0.0
assign (resid 17 and name HA )(resid 18 and name HN ) 3.5 1.7 0.0
assign (resid 17 and name HB# )(resid 17 and name HD1 ) 3.5 1.7 1.0
assign (resid 17 and name HB# )(resid 17 and name HN ) 2.9 1.1 0.6
assign (resid 17 and name HB# )(resid 18 and name HN ) 5 3.2 1.0
!assign (resid 17 and name HB# )(resid 30 and name HN ) 3.5 1.7 1.0
assign (resid 17 and name HD1 )(resid 17 and name HE1 ) 2.9 1.1 0.0
assign (resid 17 and name HE1 )(resid 17 and name HZ2 ) 2.9 1.1 0.0
assign (resid 18 and name HA# )(resid 18 and name HN ) 2.9 1.1 0.6
assign (resid 18 and name HA# )(resid 19 and name HN ) 2.9 1.1 1.0
assign (resid 18 and name HA# )(resid 20 and name HN ) 5 3.2 1.0
assign (resid 18 and name HN )(resid 17 and name HN ) 3.5 1.7 0.0
assign (resid 18 and name HN )(resid 19 and name HN ) 5 3.2 0.0
assign (resid 19 and name HA )(resid 19 and name HN ) 3.5 1.7 0.0
assign (resid 19 and name HA )(resid 20 and name HN ) 2.9 1.1 0.0
assign (resid 19 and name HB# )(resid 19 and name HN ) 2.9 1.1 0.6
assign (resid 19 and name HB# )(resid 20 and name HN ) 3.5 1.7 1.0
assign (resid 19 and name HN )(resid 23 and name HB# ) 5 3.2 1.0
assign (resid 20 and name HA )(resid 20 and name HN ) 3.5 1.7 0.0
assign (resid 20 and name HB# )(resid 20 and name HN ) 2.9 1.1 0.6
assign (resid 21 and name HA )(resid 22 and name HN ) 2.9 1.1 0.0
assign (resid 21 and name HA )(resid 23 and name HN ) 3.5 1.7 0.0
assign (resid 22 and name HA# )(resid 22 and name HN ) 2.9 1.1 0.6
assign (resid 22 and name HA# )(resid 23 and name HN ) 5 3.2 1.0
assign (resid 22 and name HN )(resid 23 and name HN ) 2.9 1.1 0.0
assign (resid 23 and name HA )(resid 23 and name HN ) 3.5 1.7 0.0
assign (resid 23 and name HA )(resid 24 and name HN ) 2.9 1.1 0.0
assign (resid 23 and name HA )(resid 35 and name HA# ) 5 3.2 1.0
assign (resid 23 and name HA )(resid 36 and name HN ) 3.5 1.7 0.0
assign (resid 23 and name HB# )(resid 23 and name HN ) 3.5 1.7 0.6
assign (resid 23 and name HB# )(resid 24 and name HN ) 2.9 1.1 1.0
assign (resid 23 and name HB# )(resid 34 and name HN ) 5 3.2 1.0
assign (resid 23 and name HN )(resid 37 and name HB# ) 3.5 1.7 1.0
assign (resid 24 and name HA )(resid 24 and name HG2# ) 2.9 1.1 1.5
assign (resid 24 and name HA )(resid 24 and name HN ) 3.5 1.7 0.0
assign (resid 24 and name HA )(resid 25 and name HN ) 2.9 1.1 0.0
assign (resid 24 and name HB )(resid 24 and name HN ) 5 3.2 0.0
assign (resid 24 and name HB )(resid 25 and name HN ) 2.9 1.1 0.0
assign (resid 24 and name HD# )(resid 24 and name HN ) 5 3.2 1.5
assign (resid 24 and name HD# )(resid 25 and name HN ) 5 3.2 1.5
!assign (resid 24 and name HG12 )(resid 24 and name HG13 ) 2.9 1.1 0.0
assign (resid 24 and name HG12 )(resid 24 and name HN ) 3.5 1.7 0.0
assign (resid 24 and name HG12 )(resid 25 and name HN ) 5 3.2 0.0
!assign (resid 24 and name HG13 )(resid 24 and name HN ) 5 3.2 0.0
!assign (resid 24 and name HG13 )(resid 25 and name HN ) 5 3.2 0.0
assign (resid 24 and name HG2# )(resid 24 and name HN ) 2.9 1.1 1.5
assign (resid 24 and name HG2# )(resid 25 and name HN ) 2.9 1.1 1.5
!assign (resid 24 and name HG2# )(resid 29 and name HA ) 2.9 1.1 1.5
assign (resid 24 and name HN )(resid 33 and name HA ) 5 3.2 0.0
assign (resid 24 and name HN )(resid 34 and name HN ) 3.5 1.7 0.0
assign (resid 24 and name HN )(resid 35 and name HA# ) 5 3.2 1.0
assign (resid 25 and name HA )(resid 25 and name HN ) 3.5 1.7 0.0
assign (resid 25 and name HA )(resid 26 and name HN ) 2.9 1.1 0.0
assign (resid 25 and name HA )(resid 33 and name HA ) 5 3.2 0.0
assign (resid 25 and name HA )(resid 34 and name HN ) 5 3.2 0.0
assign (resid 25 and name HB# )(resid 25 and name HN ) 2.9 1.1 0.6
assign (resid 25 and name HB# )(resid 26 and name HN ) 5 3.2 1.0
assign (resid 26 and name HA )(resid 27 and name HN ) 3.5 1.7 0.0
assign (resid 26 and name HB )(resid 26 and name HN ) 3.5 1.7 0.0
assign (resid 26 and name HB )(resid 27 and name HN ) 2.9 1.1 0.0
assign (resid 26 and name HD# )(resid 26 and name HN ) 5 3.2 1.5
assign (resid 26 and name HD# )(resid 27 and name HN ) 5 3.2 1.5
assign (resid 26 and name HG12 )(resid 26 and name HN ) 3.5 1.7 0.0
assign (resid 26 and name HG12 )(resid 27 and name HN ) 5 3.2 0.0
!assign (resid 26 and name HG13 )(resid 26 and name HN ) 3.5 1.7 0.0
!assign (resid 26 and name HG13 )(resid 27 and name HN ) 5 3.2 0.0
assign (resid 26 and name HG2# )(resid 26 and name HN ) 2.9 1.1 1.5
assign (resid 26 and name HG2# )(resid 27 and name HN ) 2.9 1.1 1.5
assign (resid 26 and name HG2# )(resid 28 and name HN ) 5 3.2 1.5
assign (resid 26 and name HG2# )(resid 32 and name HN ) 5 3.2 1.5
assign (resid 24 and name HD# )(resid 34 and name HB ) 3.5 1.7 1.5
assign (resid 26 and name HN )(resid 33 and name HA ) 5 3.2 0.0
assign (resid 27 and name HA )(resid 27 and name HN ) 3.5 1.7 0.0
assign (resid 27 and name HA )(resid 28 and name HN ) 2.9 1.1 0.0
assign (resid 27 and name HA )(resid 31 and name HN ) 5 3.2 0.0
assign (resid 27 and name HA )(resid 32 and name HN ) 3.5 1.7 0.0
assign (resid 27 and name HB# )(resid 27 and name HD1 ) 3.5 1.7 1.0
assign (resid 27 and name HB# )(resid 27 and name HN ) 3.5 1.7 0.6
assign (resid 27 and name HB# )(resid 28 and name HN ) 5 3.2 1.0
assign (resid 27 and name HD1 )(resid 27 and name HE1 ) 2.9 1.1 0.0
assign (resid 27 and name HD1 )(resid 30 and name HA ) 3.5 1.7 0.0
assign (resid 27 and name HE1 )(resid 27 and name HZ2 ) 2.9 1.1 0.0
assign (resid 27 and name HN )(resid 28 and name HN ) 5 3.2 0.0
assign (resid 27 and name HN )(resid 31 and name HN ) 3.5 1.7 0.0
assign (resid 28 and name HA )(resid 28 and name HN ) 3.5 1.7 0.0
assign (resid 28 and name HA )(resid 29 and name HN ) 2.9 1.1 0.0
assign (resid 28 and name HB# )(resid 28 and name HN ) 3.5 1.7 0.6
assign (resid 28 and name HB# )(resid 29 and name HN ) 3.5 1.7 1.0
assign (resid 28 and name HG# )(resid 28 and name HN ) 5 3.2 1.0
!assign (resid 28 and name HN )(resid 36 and name HA ) 5 3.2 0.0
assign (resid 29 and name HA )(resid 30 and name HN ) 3.5 1.7 0.0
assign (resid 29 and name HB# )(resid 30 and name HN ) 2.9 1.1 1.0
assign (resid 29 and name HD# )(resid 29 and name HN ) 5 3.2 1.7
assign (resid 29 and name HD# )(resid 30 and name HN ) 5 3.2 2.4
assign (resid 29 and name HD# )(resid 32 and name HE ) 5 3.2 2.4
assign (resid 29 and name HD# )(resid 29 and name HA ) 2.9 1.1 2.4
assign (resid 29 and name HG )(resid 29 and name HN ) 5 3.2 0.0
assign (resid 30 and name HA )(resid 30 and name HN ) 3.5 1.7 0.0
assign (resid 30 and name HA )(resid 31 and name HN ) 3.5 1.7 0.0
assign (resid 30 and name HB )(resid 30 and name HG2# ) 2.9 1.1 1.5
assign (resid 30 and name HB )(resid 30 and name HN ) 3.5 1.7 0.0
assign (resid 30 and name HB )(resid 31 and name HN ) 2.9 1.1 0.0
assign (resid 30 and name HG2# )(resid 30 and name HN ) 2.9 1.1 1.5
assign (resid 30 and name HG2# )(resid 31 and name HN ) 3.5 1.7 1.5
assign (resid 30 and name HG2# )(resid 32 and name HN ) 5 3.2 1.5
assign (resid 30 and name HN )(resid 31 and name HN ) 5 3.2 0.0
assign (resid 31 and name HA )(resid 31 and name HN ) 3.5 1.7 0.0
assign (resid 31 and name HA )(resid 32 and name HN ) 3.5 1.7 0.0
assign (resid 31 and name HB# )(resid 31 and name HN ) 3.5 1.7 0.6
assign (resid 31 and name HB# )(resid 32 and name HN ) 5 3.2 1.0
assign (resid 32 and name HA )(resid 32 and name HN ) 3.5 1.7 0.0
assign (resid 32 and name HA )(resid 33 and name HN ) 2.9 1.1 0.0
assign (resid 32 and name HB# )(resid 32 and name HE ) 5 3.2 1.0
assign (resid 32 and name HB# )(resid 32 and name HN ) 5 3.2 0.6
assign (resid 32 and name HB# )(resid 33 and name HN ) 3.5 1.7 1.0
assign (resid 32 and name HD# )(resid 32 and name HE ) 2.9 1.1 1.0
assign (resid 32 and name HE )(resid 32 and name HG# ) 3.5 1.7 1.0
assign (resid 32 and name HG# )(resid 32 and name HN ) 3.5 1.7 1.0
assign (resid 32 and name HG# )(resid 33 and name HN ) 5 3.2 1.0
assign (resid 33 and name HA )(resid 33 and name HN ) 3.5 1.7 0.0
assign (resid 33 and name HA )(resid 34 and name HN ) 2.9 1.1 0.0
assign (resid 33 and name HB# )(resid 33 and name HN ) 2.9 1.1 0.6
assign (resid 33 and name HB# )(resid 34 and name HN ) 5 3.2 1.0
assign (resid 34 and name HA )(resid 34 and name HG# ) 2.9 1.1 1.7
assign (resid 34 and name HA )(resid 34 and name HN ) 3.5 1.7 0.0
assign (resid 34 and name HA )(resid 35 and name HN ) 2.9 1.1 0.0
assign (resid 34 and name HB )(resid 34 and name HN ) 3.5 1.7 0.0
assign (resid 34 and name HB )(resid 35 and name HN ) 2.9 1.1 0.0
assign (resid 34 and name HG# )(resid 34 and name HN ) 2.9 1.1 1.7
assign (resid 34 and name HG# )(resid 35 and name HN ) 2.9 1.1 2.4
assign (resid 35 and name HA# )(resid 35 and name HN ) 2.9 1.1 0.6
assign (resid 35 and name HA# )(resid 36 and name HN ) 2.9 1.1 1.0
assign (resid 36 and name HA )(resid 36 and name HN ) 3.5 1.7 0.0
assign (resid 36 and name HA )(resid 37 and name HN ) 2.9 1.1 0.0
assign (resid 36 and name HB# )(resid 36 and name HN ) 2.9 1.1 0.6
assign (resid 36 and name HN )(resid 37 and name HN ) 3.5 1.7 0.0
assign (resid 37 and name HA )(resid 37 and name HN ) 2.9 1.1 0.0
assign (resid 37 and name HB# )(resid 37 and name HN ) 3.5 1.7 0.6
assign (resid 24 and name O ) (resid 34 and name HN ) 2.2 0.4 0.0
assign (resid 24 and name O ) (resid 34 and name N ) 3.3 1.1 0.0

assign (resid 34 and name O ) (resid 24 and name HN ) 2.2 0.4 0.0
assign (resid 34 and name O ) (resid 24 and name N ) 3.3 1.1 0.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLU   2           H        GLU   2  -2.716  14.229   4.065
    2    HA   GLU   2           HA       GLU   2  -0.431  13.521   5.834
    3    HB2  GLU   2           HB2      GLU   2  -3.053  12.157   5.184
    4    HB3  GLU   2           HB3      GLU   2  -1.744  11.331   6.046
    5    HG2  GLU   2           HG3      GLU   2  -1.838  13.051   7.815
    6    HG3  GLU   2           HG2      GLU   2  -3.155  13.861   6.944
    7    H    GLY   3           H        GLY   3   1.219  12.300   5.195
    8    HA2  GLY   3           HA3      GLY   3   0.946  10.530   2.860
    9    HA3  GLY   3           HA2      GLY   3   2.056  11.899   2.661
   10    H    GLU   4           H        GLU   4   1.346   9.641   5.353
   11    HA   GLU   4           HA       GLU   4   4.210   8.817   5.294
   12    HB2  GLU   4           HB3      GLU   4   4.202   8.798   7.803
   13    HB3  GLU   4           HB2      GLU   4   4.121  10.405   7.068
   14    HG2  GLU   4           HG2      GLU   4   1.712  10.513   7.523
   15    HG3  GLU   4           HG3      GLU   4   1.768   8.896   8.249
   16    H    CYS   5           H        CYS   5   1.643   7.637   4.336
   17    HA   CYS   5           HA       CYS   5   0.521   5.652   4.230
   18    HB2  CYS   5           HB3      CYS   5   1.781   3.633   4.317
   19    HB3  CYS   5           HB2      CYS   5   2.808   4.907   3.645
   20    H    SER   6           H        SER   6  -0.316   3.708   5.291
   21    HA   SER   6           HA       SER   6  -0.413   3.886   8.252
   22    HB2  SER   6           HB3      SER   6  -2.841   3.903   6.416
   23    HB3  SER   6           HB2      SER   6  -2.899   3.633   8.171
   24    HG   SER   6           HG       SER   6  -3.282   5.835   7.599
   25    HA   PRO   7           HA       PRO   7  -0.295  -0.577   8.029
   26    HB2  PRO   7           HB3      PRO   7  -2.573  -0.747   9.965
   27    HB3  PRO   7           HB2      PRO   7  -0.928  -1.435  10.088
   28    HG2  PRO   7           HG2      PRO   7  -1.681   0.677  11.551
   29    HG3  PRO   7           HG3      PRO   7  -0.029   0.538  10.887
   30    HD2  PRO   7           HD3      PRO   7  -2.336   2.214   9.933
   31    HD3  PRO   7           HD2      PRO   7  -0.592   2.614  10.002
   32    H    LEU   8           H        LEU   8  -1.010  -0.948   6.012
   33    HA   LEU   8           HA       LEU   8  -2.364  -1.473   4.242
   34    HB2  LEU   8           HB3      LEU   8  -3.499  -2.871   6.489
   35    HB3  LEU   8           HB2      LEU   8  -4.800  -2.318   5.425
   36    HG   LEU   8           HG       LEU   8  -3.432  -3.354   3.511
   37   HD11  LEU   8          HD11      LEU   8  -1.346  -3.672   4.785
   38   HD12  LEU   8          HD12      LEU   8  -1.964  -5.209   4.135
   39   HD13  LEU   8          HD13      LEU   8  -2.182  -4.819   5.858
   40   HD21  LEU   8          HD21      LEU   8  -4.428  -5.565   3.937
   41   HD22  LEU   8          HD22      LEU   8  -5.551  -4.240   4.323
   42   HD23  LEU   8          HD23      LEU   8  -4.709  -5.102   5.632
   43    H    GLY   9           H        GLY   9  -2.678   0.470   3.333
   44    HA2  GLY   9           HA3      GLY   9  -5.299   1.607   3.376
   45    HA3  GLY   9           HA2      GLY   9  -4.237   2.556   4.428
   46    H    GLU  10           H        GLU  10  -2.142   3.393   3.399
   47    HA   GLU  10           HA       GLU  10  -2.812   4.975   1.145
   48    HB2  GLU  10           HB3      GLU  10  -0.438   4.488   2.766
   49    HB3  GLU  10           HB2      GLU  10  -0.039   4.800   1.069
   50    HG2  GLU  10           HG2      GLU  10  -1.854   6.591   2.699
   51    HG3  GLU  10           HG3      GLU  10  -0.100   6.828   2.586
   52    HA   PRO  11           HA       PRO  11  -2.547   2.104  -2.314
   53    HB2  PRO  11           HB3      PRO  11  -2.122   4.645  -3.868
   54    HB3  PRO  11           HB2      PRO  11  -3.309   3.336  -4.139
   55    HG2  PRO  11           HG2      PRO  11  -4.060   5.669  -3.112
   56    HG3  PRO  11           HG3      PRO  11  -4.745   4.135  -2.505
   57    HD2  PRO  11           HD2      PRO  11  -2.651   5.908  -1.269
   58    HD3  PRO  11           HD3      PRO  11  -3.990   5.003  -0.498
   59    H    CYS  12           H        CYS  12  -1.053   1.560  -4.098
   60    HA   CYS  12           HA       CYS  12   1.737   2.022  -3.269
   61    HB2  CYS  12           HB2      CYS  12   0.658   0.264  -5.485
   62    HB3  CYS  12           HB3      CYS  12   2.276   0.204  -4.765
   63    H    ALA  13           H        ALA  13  -0.399   3.524  -5.403
   64    HA   ALA  13           HA       ALA  13   1.614   4.100  -7.475
   65    HB1  ALA  13           HB1      ALA  13  -0.193   5.387  -8.552
   66    HB2  ALA  13           HB2      ALA  13  -0.690   3.721  -8.172
   67    HB3  ALA  13           HB3      ALA  13  -1.242   5.069  -7.149
   68    H    GLY  14           H        GLY  14   3.151   5.478  -7.035
   69    HA2  GLY  14           HA3      GLY  14   3.221   8.093  -6.934
   70    HA3  GLY  14           HA2      GLY  14   2.558   7.822  -5.310
   71    H    ASN  15           H        ASN  15   3.842   5.897  -4.181
   72    HA   ASN  15           HA       ASN  15   5.708   5.398  -2.955
   73    HB2  ASN  15           HB3      ASN  15   6.863   5.563  -5.736
   74    HB3  ASN  15           HB2      ASN  15   7.849   5.108  -4.332
   75   HD21  ASN  15          HD21      ASN  15   5.105   2.509  -5.941
   76   HD22  ASN  15          HD22      ASN  15   5.188   4.182  -6.448
   77    HA   PRO  16           HA       PRO  16   7.047   5.278  -1.422
   78    HB2  PRO  16           HB3      PRO  16   7.534   6.846   1.001
   79    HB3  PRO  16           HB2      PRO  16   8.628   5.686   0.196
   80    HG2  PRO  16           HG2      PRO  16   9.082   8.383   0.330
   81    HG3  PRO  16           HG3      PRO  16   9.705   7.327  -0.968
   82    HD2  PRO  16           HD2      PRO  16   7.291   9.140  -0.987
   83    HD3  PRO  16           HD3      PRO  16   8.544   8.887  -2.244
   84    H    TRP  17           H        TRP  17   4.716   6.787  -2.205
   85    HA   TRP  17           HA       TRP  17   3.105   7.320   0.184
   86    HB2  TRP  17           HB3      TRP  17   2.487   7.322  -2.786
   87    HB3  TRP  17           HB2      TRP  17   1.285   7.682  -1.535
   88    HD1  TRP  17           HD1      TRP  17   4.597   9.115  -2.964
   89    HE1  TRP  17           HE1      TRP  17   4.690  11.648  -2.482
   90    HE3  TRP  17           HE3      TRP  17   0.368   9.517  -0.103
   91    HZ2  TRP  17           HZ2      TRP  17   3.157  13.534  -1.076
   92    HZ3  TRP  17           HZ3      TRP  17  -0.251  11.733   0.774
   93    HH2  TRP  17           HH2      TRP  17   1.125  13.713   0.289
   94    H    GLY  18           H        GLY  18   4.158   4.476  -0.759
   95    HA2  GLY  18           HA2      GLY  18   1.689   2.972  -1.130
   96    HA3  GLY  18           HA3      GLY  18   3.316   2.304  -0.905
   97    H    CYS  19           H        CYS  19   2.400   0.692   0.440
   98    HA   CYS  19           HA       CYS  19   1.221   1.556   3.002
   99    HB2  CYS  19           HB2      CYS  19   1.840  -1.212   1.922
  100    HB3  CYS  19           HB3      CYS  19   0.945  -0.858   3.410
  101    H    CYS  20           H        CYS  20   2.154   1.391   4.961
  102    HA   CYS  20           HA       CYS  20   4.917   1.746   5.279
  103    HB2  CYS  20           HB2      CYS  20   3.062   0.533   7.341
  104    HB3  CYS  20           HB3      CYS  20   4.546   1.451   7.642
  105    HA   PRO  21           HA       PRO  21   7.144  -2.096   5.053
  106    HB2  PRO  21           HB3      PRO  21   8.086  -1.592   7.878
  107    HB3  PRO  21           HB2      PRO  21   9.040  -2.005   6.423
  108    HG2  PRO  21           HG2      PRO  21   9.002   0.479   7.330
  109    HG3  PRO  21           HG3      PRO  21   8.898   0.161   5.575
  110    HD2  PRO  21           HD3      PRO  21   6.730   0.944   7.504
  111    HD3  PRO  21           HD2      PRO  21   6.993   1.472   5.814
  112    H    GLY  22           H        GLY  22   6.976  -4.256   5.534
  113    HA2  GLY  22           HA3      GLY  22   6.478  -6.056   7.110
  114    HA3  GLY  22           HA2      GLY  22   5.284  -4.994   7.879
  115    H    CYS  23           H        CYS  23   4.743  -4.272   4.807
  116    HA   CYS  23           HA       CYS  23   2.994  -6.626   4.247
  117    HB2  CYS  23           HB3      CYS  23   2.260  -3.695   4.315
  118    HB3  CYS  23           HB2      CYS  23   1.353  -4.856   3.332
  119    H    ILE  24           H        ILE  24   2.537  -7.044   2.088
  120    HA   ILE  24           HA       ILE  24   4.361  -5.669   0.173
  121    HB   ILE  24           HB       ILE  24   4.007  -7.722  -1.292
  122   HG12  ILE  24          HG13      ILE  24   2.041  -8.630   0.037
  123   HG13  ILE  24          HG12      ILE  24   3.285  -9.788  -0.442
  124   HG21  ILE  24          HG21      ILE  24   5.785  -8.997  -0.149
  125   HG22  ILE  24          HG22      ILE  24   5.536  -8.003   1.306
  126   HG23  ILE  24          HG23      ILE  24   6.107  -7.247  -0.202
  127   HD11  ILE  24          HD11      ILE  24   4.035 -10.105   1.746
  128   HD12  ILE  24          HD12      ILE  24   2.270  -9.967   1.928
  129   HD13  ILE  24          HD13      ILE  24   3.316  -8.581   2.320
  130    H    CYS  25           H        CYS  25   3.643  -5.181  -1.932
  131    HA   CYS  25           HA       CYS  25   0.759  -4.502  -1.979
  132    HB2  CYS  25           HB3      CYS  25   2.445  -2.741  -2.410
  133    HB3  CYS  25           HB2      CYS  25   3.022  -3.657  -3.812
  134    H    ILE  26           H        ILE  26  -0.616  -4.961  -3.661
  135    HA   ILE  26           HA       ILE  26   0.161  -7.326  -5.286
  136    HB   ILE  26           HB       ILE  26  -2.589  -6.266  -4.506
  137   HG12  ILE  26          HG12      ILE  26  -1.520  -7.305  -2.613
  138   HG13  ILE  26          HG13      ILE  26  -2.813  -8.358  -3.200
  139   HG21  ILE  26          HG21      ILE  26  -2.625  -7.291  -6.752
  140   HG22  ILE  26          HG22      ILE  26  -3.563  -8.222  -5.560
  141   HG23  ILE  26          HG23      ILE  26  -1.952  -8.788  -6.063
  142   HD11  ILE  26          HD11      ILE  26  -0.543  -9.320  -4.507
  143   HD12  ILE  26          HD12      ILE  26   0.045  -8.888  -2.883
  144   HD13  ILE  26          HD13      ILE  26  -1.313 -10.024  -3.064
  145    H    TRP  27           H        TRP  27  -2.020  -4.477  -5.622
  146    HA   TRP  27           HA       TRP  27  -2.509  -3.100  -7.387
  147    HB2  TRP  27           HB2      TRP  27  -0.101  -2.508  -6.892
  148    HB3  TRP  27           HB3      TRP  27   0.368  -3.522  -8.261
  149    HD1  TRP  27           HD1      TRP  27  -2.672  -1.097  -8.452
  150    HE1  TRP  27           HE1      TRP  27  -2.176   0.733 -10.197
  151    HE3  TRP  27           HE3      TRP  27   2.212  -2.276  -9.458
  152    HZ2  TRP  27           HZ2      TRP  27  -0.000   1.551 -11.764
  153    HZ3  TRP  27           HZ3      TRP  27   3.436  -0.906 -11.097
  154    HH2  TRP  27           HH2      TRP  27   2.342   0.981 -12.235
  155    H    GLN  28           H        GLN  28  -2.800  -6.059  -7.772
  156    HA   GLN  28           HA       GLN  28  -2.612  -6.239 -10.737
  157    HB2  GLN  28           HB2      GLN  28  -3.167  -8.311  -8.596
  158    HB3  GLN  28           HB3      GLN  28  -3.335  -8.641 -10.328
  159    HG2  GLN  28           HG3      GLN  28  -0.946  -8.088 -10.647
  160    HG3  GLN  28           HG2      GLN  28  -0.797  -7.789  -8.904
  161   HE21  GLN  28          HE21      GLN  28  -0.628 -11.180  -7.961
  162   HE22  GLN  28          HE22      GLN  28  -0.852  -9.527  -7.434
  163    H    LEU  29           H        LEU  29  -4.512  -4.783  -8.783
  164    HA   LEU  29           HA       LEU  29  -6.934  -5.148 -10.403
  165    HB2  LEU  29           HB2      LEU  29  -6.961  -6.742  -8.324
  166    HB3  LEU  29           HB3      LEU  29  -7.251  -5.264  -7.398
  167    HG   LEU  29           HG       LEU  29  -9.019  -5.828  -9.749
  168   HD11  LEU  29          HD11      LEU  29  -8.858  -7.999  -8.591
  169   HD12  LEU  29          HD12      LEU  29  -9.301  -7.209  -7.059
  170   HD13  LEU  29          HD13      LEU  29 -10.469  -7.267  -8.401
  171   HD21  LEU  29          HD21      LEU  29  -9.250  -3.750  -8.436
  172   HD22  LEU  29          HD22      LEU  29 -10.700  -4.775  -8.311
  173   HD23  LEU  29          HD23      LEU  29  -9.532  -4.716  -6.968
  174    H    THR  30           H        THR  30  -5.543  -3.612  -7.467
  175    HA   THR  30           HA       THR  30  -6.209  -0.968  -8.586
  176    HB   THR  30           HB       THR  30  -6.936  -0.549  -5.976
  177    HG1  THR  30           HG1      THR  30  -8.346  -2.209  -5.394
  178   HG21  THR  30          HG21      THR  30  -9.239  -0.393  -6.832
  179   HG22  THR  30          HG22      THR  30  -8.750  -1.278  -8.297
  180   HG23  THR  30          HG23      THR  30  -8.068   0.331  -7.960
  181    H    ASP  31           H        ASP  31  -5.056  -2.476  -5.533
  182    HA   ASP  31           HA       ASP  31  -2.395  -1.942  -5.459
  183    HB2  ASP  31           HB2      ASP  31  -2.088   0.252  -4.289
  184    HB3  ASP  31           HB3      ASP  31  -2.601   0.418  -5.976
  185    H    ARG  32           H        ARG  32  -4.180  -3.696  -4.335
  186    HA   ARG  32           HA       ARG  32  -4.634  -3.045  -1.517
  187    HB2  ARG  32           HB2      ARG  32  -5.075  -5.514  -3.200
  188    HB3  ARG  32           HB3      ARG  32  -5.330  -5.514  -1.447
  189    HG2  ARG  32           HG2      ARG  32  -6.993  -3.704  -1.704
  190    HG3  ARG  32           HG3      ARG  32  -6.747  -3.740  -3.463
  191    HD2  ARG  32           HD3      ARG  32  -7.499  -6.087  -3.517
  192    HD3  ARG  32           HD2      ARG  32  -7.737  -6.049  -1.758
  193    HE   ARG  32           HE       ARG  32  -9.226  -3.930  -2.956
  194   HH11  ARG  32          HH11      ARG  32  -9.269  -7.464  -2.671
  195   HH12  ARG  32          HH12      ARG  32 -11.006  -7.563  -2.853
  196   HH21  ARG  32          HH21      ARG  32 -11.463  -4.101  -3.188
  197   HH22  ARG  32          HH22      ARG  32 -12.241  -5.667  -3.145
  198    H    CYS  33           H        CYS  33  -3.363  -3.387   0.147
  199    HA   CYS  33           HA       CYS  33  -0.859  -4.944  -0.262
  200    HB2  CYS  33           HB3      CYS  33  -1.670  -3.007   1.934
  201    HB3  CYS  33           HB2      CYS  33  -0.111  -3.840   1.821
  202    H    VAL  34           H        VAL  34  -0.532  -6.850   0.677
  203    HA   VAL  34           HA       VAL  34  -2.420  -7.682   2.830
  204    HB   VAL  34           HB       VAL  34  -1.770 -10.071   1.998
  205   HG11  VAL  34          HG11      VAL  34  -4.022  -9.074   1.958
  206   HG12  VAL  34          HG12      VAL  34  -3.657  -8.344   0.376
  207   HG13  VAL  34          HG13      VAL  34  -3.716 -10.115   0.547
  208   HG21  VAL  34          HG21      VAL  34  -0.073  -9.361   0.346
  209   HG22  VAL  34          HG22      VAL  34  -1.398 -10.284  -0.402
  210   HG23  VAL  34          HG23      VAL  34  -1.339  -8.513  -0.573
  211    H    GLY  35           H        GLY  35  -1.617  -9.148   4.435
  212    HA2  GLY  35           HA2      GLY  35   0.592 -10.333   5.073
  213    HA3  GLY  35           HA3      GLY  35   1.295  -8.711   4.920
  214    H    ASN  36           H        ASN  36   1.933  -8.476   7.020
  215    HA   ASN  36           HA       ASN  36  -0.259  -7.987   8.957
  216    HB2  ASN  36           HB3      ASN  36   0.825 -10.370   9.172
  217    HB3  ASN  36           HB2      ASN  36   2.187  -9.486   9.886
  218   HD21  ASN  36          HD21      ASN  36   1.946  -8.425  11.887
  219   HD22  ASN  36          HD22      ASN  36   0.603  -8.773  12.953
  220    H    CYS  37           H        CYS  37   0.162  -5.801   8.582
  221    HA   CYS  37           HA       CYS  37   2.600  -4.809   9.984
  222    HB2  CYS  37           HB3      CYS  37   2.757  -2.956   8.361
  223    HB3  CYS  37           HB2      CYS  37   3.027  -4.541   7.618
  Start of MODEL    2
    1    H1   GLU   2           H        GLU   2   4.031  14.678  -0.089
    2    HA   GLU   2           HA       GLU   2   2.525  14.488   2.483
    3    HB2  GLU   2           HB2      GLU   2   1.633  13.690  -0.295
    4    HB3  GLU   2           HB3      GLU   2   0.895  13.013   1.167
    5    HG2  GLU   2           HG3      GLU   2   0.258  15.286   1.886
    6    HG3  GLU   2           HG2      GLU   2   1.000  15.951   0.418
    7    H    GLY   3           H        GLY   3   2.955  12.765   3.678
    8    HA2  GLY   3           HA2      GLY   3   3.736  10.223   2.505
    9    HA3  GLY   3           HA3      GLY   3   5.092  11.061   3.284
   10    H    GLU   4           H        GLU   4   1.916   9.596   3.755
   11    HA   GLU   4           HA       GLU   4   2.646   9.002   6.565
   12    HB2  GLU   4           HB3      GLU   4   1.103  11.145   6.226
   13    HB3  GLU   4           HB2      GLU   4  -0.162   9.921   6.032
   14    HG2  GLU   4           HG2      GLU   4   0.379   8.987   8.231
   15    HG3  GLU   4           HG3      GLU   4   1.665  10.192   8.437
   16    H    CYS   5           H        CYS   5   2.981   6.900   5.884
   17    HA   CYS   5           HA       CYS   5   0.702   5.414   4.721
   18    HB2  CYS   5           HB3      CYS   5   2.350   3.520   4.654
   19    HB3  CYS   5           HB2      CYS   5   2.766   4.934   3.675
   20    H    SER   6           H        SER   6  -0.082   3.467   5.602
   21    HA   SER   6           HA       SER   6   0.528   2.871   8.424
   22    HB2  SER   6           HB3      SER   6  -2.244   3.735   7.514
   23    HB3  SER   6           HB2      SER   6  -1.869   2.998   9.087
   24    HG   SER   6           HG       SER   6  -1.918   5.304   9.175
   25    HA   PRO   7           HA       PRO   7  -0.314  -1.340   7.222
   26    HB2  PRO   7           HB3      PRO   7  -2.018  -1.605   9.694
   27    HB3  PRO   7           HB2      PRO   7  -0.639  -2.610   9.158
   28    HG2  PRO   7           HG3      PRO   7  -0.368  -0.873  11.148
   29    HG3  PRO   7           HG2      PRO   7   0.931  -1.081   9.939
   30    HD2  PRO   7           HD2      PRO   7  -1.108   1.123  10.203
   31    HD3  PRO   7           HD3      PRO   7   0.624   1.212   9.756
   32    H    LEU   8           H        LEU   8  -1.655  -1.635   5.532
   33    HA   LEU   8           HA       LEU   8  -3.538  -1.733   4.216
   34    HB2  LEU   8           HB2      LEU   8  -4.608  -2.439   6.933
   35    HB3  LEU   8           HB3      LEU   8  -5.752  -2.184   5.616
   36    HG   LEU   8           HG       LEU   8  -5.246  -4.559   6.018
   37   HD11  LEU   8          HD11      LEU   8  -5.967  -4.438   3.877
   38   HD12  LEU   8          HD12      LEU   8  -4.302  -4.971   3.544
   39   HD13  LEU   8          HD13      LEU   8  -4.729  -3.249   3.406
   40   HD21  LEU   8          HD21      LEU   8  -2.905  -4.320   6.764
   41   HD22  LEU   8          HD22      LEU   8  -3.090  -5.541   5.482
   42   HD23  LEU   8          HD23      LEU   8  -2.426  -3.936   5.093
   43    H    GLY   9           H        GLY   9  -2.763   0.673   4.242
   44    HA2  GLY   9           HA2      GLY   9  -5.220   2.297   4.588
   45    HA3  GLY   9           HA3      GLY   9  -3.728   2.854   5.367
   46    H    GLU  10           H        GLU  10  -1.768   3.024   3.838
   47    HA   GLU  10           HA       GLU  10  -2.630   4.684   1.591
   48    HB2  GLU  10           HB2      GLU  10  -0.056   4.091   2.956
   49    HB3  GLU  10           HB3      GLU  10   0.043   4.571   1.255
   50    HG2  GLU  10           HG2      GLU  10  -1.420   6.159   3.383
   51    HG3  GLU  10           HG3      GLU  10   0.268   6.446   2.925
   52    HA   PRO  11           HA       PRO  11  -2.374   1.643  -1.637
   53    HB2  PRO  11           HB2      PRO  11  -1.474   3.665  -3.597
   54    HB3  PRO  11           HB3      PRO  11  -3.060   2.854  -3.463
   55    HG2  PRO  11           HG3      PRO  11  -2.700   5.481  -2.929
   56    HG3  PRO  11           HG2      PRO  11  -3.926   4.480  -2.101
   57    HD2  PRO  11           HD3      PRO  11  -1.190   5.328  -1.154
   58    HD3  PRO  11           HD2      PRO  11  -2.743   5.318  -0.260
   59    H    CYS  12           H        CYS  12  -0.921   0.970  -3.609
   60    HA   CYS  12           HA       CYS  12   1.882   0.903  -2.619
   61    HB2  CYS  12           HB2      CYS  12   0.787  -1.251  -2.947
   62    HB3  CYS  12           HB3      CYS  12   0.413  -0.839  -4.628
   63    H    ALA  13           H        ALA  13  -0.058   1.569  -5.537
   64    HA   ALA  13           HA       ALA  13   2.369   2.540  -6.940
   65    HB1  ALA  13           HB1      ALA  13   1.110   2.425  -8.944
   66    HB2  ALA  13           HB2      ALA  13   0.680   0.966  -8.020
   67    HB3  ALA  13           HB3      ALA  13  -0.434   2.353  -8.062
   68    H    GLY  14           H        GLY  14   2.896   4.594  -7.021
   69    HA2  GLY  14           HA2      GLY  14   1.477   6.790  -7.677
   70    HA3  GLY  14           HA3      GLY  14   1.019   6.606  -5.973
   71    H    ASN  15           H        ASN  15   3.033   6.130  -4.521
   72    HA   ASN  15           HA       ASN  15   4.841   7.031  -3.451
   73    HB2  ASN  15           HB2      ASN  15   5.825   7.025  -6.300
   74    HB3  ASN  15           HB3      ASN  15   6.846   7.590  -4.963
   75   HD21  ASN  15          HD21      ASN  15   7.498   4.385  -3.634
   76   HD22  ASN  15          HD22      ASN  15   7.558   6.113  -3.370
   77    HA   PRO  16           HA       PRO  16   5.936   8.115  -2.061
   78    HB2  PRO  16           HB3      PRO  16   5.090  10.246  -0.212
   79    HB3  PRO  16           HB2      PRO  16   6.747   9.735  -0.643
   80    HG2  PRO  16           HG3      PRO  16   5.681  12.129  -1.365
   81    HG3  PRO  16           HG2      PRO  16   6.911  11.274  -2.338
   82    HD2  PRO  16           HD2      PRO  16   3.914  11.383  -2.716
   83    HD3  PRO  16           HD3      PRO  16   5.225  11.539  -3.929
   84    H    TRP  17           H        TRP  17   3.038   8.121  -3.070
   85    HA   TRP  17           HA       TRP  17   1.439   7.826  -0.620
   86    HB2  TRP  17           HB2      TRP  17   0.822   7.496  -3.569
   87    HB3  TRP  17           HB3      TRP  17  -0.365   7.184  -2.292
   88    HD1  TRP  17           HD1      TRP  17   1.689  10.101  -3.813
   89    HE1  TRP  17           HE1      TRP  17   0.493  12.330  -3.303
   90    HE3  TRP  17           HE3      TRP  17  -2.029   8.313  -0.778
   91    HZ2  TRP  17           HZ2      TRP  17  -1.730  13.181  -1.815
   92    HZ3  TRP  17           HZ3      TRP  17  -3.659   9.908   0.151
   93    HH2  TRP  17           HH2      TRP  17  -3.509  12.310  -0.363
   94    H    GLY  18           H        GLY  18   3.564   6.081  -0.514
   95    HA2  GLY  18           HA2      GLY  18   2.492   3.428  -1.304
   96    HA3  GLY  18           HA3      GLY  18   4.150   3.772  -0.776
   97    H    CYS  19           H        CYS  19   2.969   1.619   0.258
   98    HA   CYS  19           HA       CYS  19   1.769   2.360   2.852
   99    HB2  CYS  19           HB3      CYS  19   1.692  -0.175   3.130
  100    HB3  CYS  19           HB2      CYS  19   0.664   0.544   1.881
  101    H    CYS  20           H        CYS  20   2.617   1.859   4.819
  102    HA   CYS  20           HA       CYS  20   5.418   2.229   5.162
  103    HB2  CYS  20           HB3      CYS  20   3.128   1.447   6.945
  104    HB3  CYS  20           HB2      CYS  20   4.785   1.354   7.556
  105    HA   PRO  21           HA       PRO  21   7.446  -1.709   4.858
  106    HB2  PRO  21           HB2      PRO  21   8.773  -1.836   7.360
  107    HB3  PRO  21           HB3      PRO  21   9.396  -1.064   5.874
  108    HG2  PRO  21           HG3      PRO  21   7.991   0.159   8.219
  109    HG3  PRO  21           HG2      PRO  21   9.369   0.778   7.266
  110    HD2  PRO  21           HD2      PRO  21   6.909   1.759   6.895
  111    HD3  PRO  21           HD3      PRO  21   7.990   1.460   5.498
  112    H    GLY  22           H        GLY  22   6.932  -3.797   5.163
  113    HA2  GLY  22           HA3      GLY  22   6.452  -5.601   6.820
  114    HA3  GLY  22           HA2      GLY  22   5.312  -4.477   7.585
  115    H    CYS  23           H        CYS  23   4.462  -3.497   4.866
  116    HA   CYS  23           HA       CYS  23   2.510  -5.679   4.330
  117    HB2  CYS  23           HB2      CYS  23   2.431  -2.857   3.247
  118    HB3  CYS  23           HB3      CYS  23   1.097  -4.011   3.402
  119    H    ILE  24           H        ILE  24   2.168  -6.520   2.285
  120    HA   ILE  24           HA       ILE  24   4.341  -5.935   0.336
  121    HB   ILE  24           HB       ILE  24   3.551  -8.124  -0.777
  122   HG12  ILE  24          HG12      ILE  24   2.765  -9.727   1.195
  123   HG13  ILE  24          HG13      ILE  24   2.015  -8.238   1.794
  124   HG21  ILE  24          HG21      ILE  24   5.670  -7.813   0.443
  125   HG22  ILE  24          HG22      ILE  24   4.850  -8.258   1.958
  126   HG23  ILE  24          HG23      ILE  24   5.007  -9.452   0.647
  127   HD11  ILE  24          HD11      ILE  24   0.441  -9.550   0.459
  128   HD12  ILE  24          HD12      ILE  24   0.803  -7.999  -0.337
  129   HD13  ILE  24          HD13      ILE  24   1.557  -9.500  -0.927
  130    H    CYS  25           H        CYS  25   3.849  -5.956  -1.946
  131    HA   CYS  25           HA       CYS  25   1.434  -4.351  -2.457
  132    HB2  CYS  25           HB2      CYS  25   3.780  -3.818  -3.288
  133    HB3  CYS  25           HB3      CYS  25   3.584  -5.159  -4.428
  134    H    ILE  26           H        ILE  26  -0.304  -4.909  -3.595
  135    HA   ILE  26           HA       ILE  26  -0.478  -7.724  -4.521
  136    HB   ILE  26           HB       ILE  26  -2.705  -5.705  -4.004
  137   HG12  ILE  26          HG12      ILE  26  -1.680  -6.272  -1.902
  138   HG13  ILE  26          HG13      ILE  26  -3.257  -7.062  -2.008
  139   HG21  ILE  26          HG21      ILE  26  -3.639  -8.404  -3.940
  140   HG22  ILE  26          HG22      ILE  26  -2.747  -8.150  -5.459
  141   HG23  ILE  26          HG23      ILE  26  -4.106  -7.082  -5.036
  142   HD11  ILE  26          HD11      ILE  26  -2.135  -9.210  -2.520
  143   HD12  ILE  26          HD12      ILE  26  -0.554  -8.401  -2.393
  144   HD13  ILE  26          HD13      ILE  26  -1.604  -8.532  -0.962
  145    H    TRP  27           H        TRP  27  -2.071  -4.683  -5.604
  146    HA   TRP  27           HA       TRP  27  -2.478  -3.812  -7.688
  147    HB2  TRP  27           HB2      TRP  27   0.083  -3.671  -7.493
  148    HB3  TRP  27           HB3      TRP  27   0.132  -5.032  -8.620
  149    HD1  TRP  27           HD1      TRP  27  -2.678  -2.995  -9.831
  150    HE1  TRP  27           HE1      TRP  27  -1.974  -1.383 -11.714
  151    HE3  TRP  27           HE3      TRP  27   2.407  -3.264  -9.234
  152    HZ2  TRP  27           HZ2      TRP  27   0.417  -0.382 -12.784
  153    HZ3  TRP  27           HZ3      TRP  27   3.835  -1.937 -10.738
  154    HH2  TRP  27           HH2      TRP  27   2.851  -0.519 -12.490
  155    H    GLN  28           H        GLN  28  -3.253  -6.662  -7.098
  156    HA   GLN  28           HA       GLN  28  -3.415  -7.769  -9.853
  157    HB2  GLN  28           HB3      GLN  28  -4.040  -8.938  -7.124
  158    HB3  GLN  28           HB2      GLN  28  -4.474  -9.742  -8.642
  159    HG2  GLN  28           HG2      GLN  28  -2.112  -9.804  -9.298
  160    HG3  GLN  28           HG3      GLN  28  -1.664  -8.995  -7.784
  161   HE21  GLN  28          HE21      GLN  28  -1.790 -10.128  -5.805
  162   HE22  GLN  28          HE22      GLN  28  -1.905 -11.873  -5.756
  163    H    LEU  29           H        LEU  29  -4.859  -5.487  -8.324
  164    HA   LEU  29           HA       LEU  29  -7.466  -5.874  -9.631
  165    HB2  LEU  29           HB2      LEU  29  -7.171  -5.387  -6.649
  166    HB3  LEU  29           HB3      LEU  29  -8.665  -5.082  -7.544
  167    HG   LEU  29           HG       LEU  29  -7.414  -7.809  -7.672
  168   HD11  LEU  29          HD11      LEU  29  -7.410  -7.214  -5.279
  169   HD12  LEU  29          HD12      LEU  29  -9.140  -6.810  -5.383
  170   HD13  LEU  29          HD13      LEU  29  -8.601  -8.486  -5.642
  171   HD21  LEU  29          HD21      LEU  29  -9.372  -7.258  -9.072
  172   HD22  LEU  29          HD22      LEU  29  -9.752  -8.512  -7.868
  173   HD23  LEU  29          HD23      LEU  29 -10.293  -6.837  -7.608
  174    H    THR  30           H        THR  30  -5.492  -3.804  -7.467
  175    HA   THR  30           HA       THR  30  -5.876  -1.557  -9.329
  176    HB   THR  30           HB       THR  30  -6.191  -0.220  -6.957
  177    HG1  THR  30           HG1      THR  30  -7.757  -1.320  -5.764
  178   HG21  THR  30          HG21      THR  30  -8.532   0.095  -7.653
  179   HG22  THR  30          HG22      THR  30  -7.417   0.197  -9.036
  180   HG23  THR  30          HG23      THR  30  -8.379  -1.278  -8.776
  181    H    ASP  31           H        ASP  31  -4.636  -2.128  -6.002
  182    HA   ASP  31           HA       ASP  31  -1.927  -2.165  -6.267
  183    HB2  ASP  31           HB2      ASP  31  -1.126   0.202  -5.980
  184    HB3  ASP  31           HB3      ASP  31  -1.767  -0.152  -7.594
  185    H    ARG  32           H        ARG  32  -3.786  -3.050  -4.482
  186    HA   ARG  32           HA       ARG  32  -3.688  -1.369  -2.058
  187    HB2  ARG  32           HB3      ARG  32  -5.001  -4.012  -2.723
  188    HB3  ARG  32           HB2      ARG  32  -4.956  -3.361  -1.076
  189    HG2  ARG  32           HG2      ARG  32  -6.123  -1.328  -1.857
  190    HG3  ARG  32           HG3      ARG  32  -6.210  -2.020  -3.490
  191    HD2  ARG  32           HD3      ARG  32  -7.521  -3.915  -2.616
  192    HD3  ARG  32           HD2      ARG  32  -7.425  -3.225  -0.983
  193    HE   ARG  32           HE       ARG  32  -8.532  -1.312  -2.811
  194   HH11  ARG  32          HH11      ARG  32 -11.088  -3.882  -1.014
  195   HH12  ARG  32          HH12      ARG  32  -9.382  -4.270  -1.053
  196   HH21  ARG  32          HH21      ARG  32 -10.739  -0.848  -2.739
  197   HH22  ARG  32          HH22      ARG  32 -11.850  -1.955  -1.964
  198    H    CYS  33           H        CYS  33  -2.759  -1.921  -0.100
  199    HA   CYS  33           HA       CYS  33  -0.512  -3.869  -0.322
  200    HB2  CYS  33           HB3      CYS  33  -0.947  -1.419   1.401
  201    HB3  CYS  33           HB2      CYS  33   0.319  -2.610   1.739
  202    H    VAL  34           H        VAL  34  -0.805  -5.759   0.580
  203    HA   VAL  34           HA       VAL  34  -2.334  -5.928   3.144
  204    HB   VAL  34           HB       VAL  34  -2.470  -8.199   1.143
  205   HG11  VAL  34          HG11      VAL  34  -4.902  -8.033   2.423
  206   HG12  VAL  34          HG12      VAL  34  -3.539  -9.065   2.920
  207   HG13  VAL  34          HG13      VAL  34  -3.771  -7.472   3.678
  208   HG21  VAL  34          HG21      VAL  34  -4.729  -6.236   1.188
  209   HG22  VAL  34          HG22      VAL  34  -3.296  -5.863   0.200
  210   HG23  VAL  34          HG23      VAL  34  -4.212  -7.361  -0.091
  211    H    GLY  35           H        GLY  35  -1.920  -8.363   4.030
  212    HA2  GLY  35           HA2      GLY  35   0.138  -9.990   3.673
  213    HA3  GLY  35           HA3      GLY  35   1.034  -8.548   4.190
  214    H    ASN  36           H        ASN  36   1.501  -8.426   6.253
  215    HA   ASN  36           HA       ASN  36  -0.360  -9.661   8.234
  216    HB2  ASN  36           HB2      ASN  36   2.647 -10.017   8.046
  217    HB3  ASN  36           HB3      ASN  36   1.725 -10.366   9.521
  218   HD21  ASN  36          HD21      ASN  36   1.655 -12.907   6.292
  219   HD22  ASN  36          HD22      ASN  36   2.402 -11.328   6.201
  220    H    CYS  37           H        CYS  37  -0.018  -6.896   7.348
  221    HA   CYS  37           HA       CYS  37   1.105  -5.669   9.828
  222    HB2  CYS  37           HB3      CYS  37   1.303  -3.597   8.501
  223    HB3  CYS  37           HB2      CYS  37   2.250  -4.934   7.829
  Start of MODEL    3
    1    H1   GLU   2           H        GLU   2   9.099   6.682   0.364
    2    HA   GLU   2           HA       GLU   2   8.190   6.372   3.192
    3    HB2  GLU   2           HB3      GLU   2  10.781   6.720   2.643
    4    HB3  GLU   2           HB2      GLU   2  10.272   8.411   2.503
    5    HG2  GLU   2           HG2      GLU   2   9.363   8.340   4.779
    6    HG3  GLU   2           HG3      GLU   2   9.858   6.643   4.932
    7    H    GLY   3           H        GLY   3   6.907   7.964   4.004
    8    HA2  GLY   3           HA3      GLY   3   6.583  10.580   3.129
    9    HA3  GLY   3           HA2      GLY   3   5.524   9.621   2.077
   10    H    GLU   4           H        GLU   4   3.657   8.728   2.854
   11    HA   GLU   4           HA       GLU   4   3.031   8.987   5.727
   12    HB2  GLU   4           HB2      GLU   4   1.703  10.562   3.548
   13    HB3  GLU   4           HB3      GLU   4   0.722   9.979   4.905
   14    HG2  GLU   4           HG2      GLU   4   2.163  11.131   6.484
   15    HG3  GLU   4           HG3      GLU   4   3.242  11.641   5.171
   16    H    CYS   5           H        CYS   5   2.994   6.827   5.859
   17    HA   CYS   5           HA       CYS   5   0.783   5.444   4.400
   18    HB2  CYS   5           HB3      CYS   5   2.109   3.361   4.674
   19    HB3  CYS   5           HB2      CYS   5   2.878   4.570   3.635
   20    H    SER   6           H        SER   6   0.101   3.389   5.581
   21    HA   SER   6           HA       SER   6   0.240   3.541   8.517
   22    HB2  SER   6           HB3      SER   6  -2.395   3.874   7.027
   23    HB3  SER   6           HB2      SER   6  -2.236   3.572   8.771
   24    HG   SER   6           HG       SER   6  -2.461   5.813   8.275
   25    HA   PRO   7           HA       PRO   7  -0.149  -0.894   8.158
   26    HB2  PRO   7           HB3      PRO   7  -2.166  -0.896  10.374
   27    HB3  PRO   7           HB2      PRO   7  -0.608  -1.765  10.259
   28    HG2  PRO   7           HG2      PRO   7  -0.913   0.355  11.861
   29    HG3  PRO   7           HG3      PRO   7   0.608   0.069  10.970
   30    HD2  PRO   7           HD3      PRO   7  -1.609   2.014  10.386
   31    HD3  PRO   7           HD2      PRO   7   0.162   2.228  10.229
   32    H    LEU   8           H        LEU   8  -1.149  -1.226   6.275
   33    HA   LEU   8           HA       LEU   8  -2.752  -1.565   4.685
   34    HB2  LEU   8           HB2      LEU   8  -3.693  -2.900   7.014
   35    HB3  LEU   8           HB3      LEU   8  -5.092  -2.149   6.230
   36    HG   LEU   8           HG       LEU   8  -4.166  -3.228   4.061
   37   HD11  LEU   8          HD11      LEU   8  -2.907  -5.315   4.429
   38   HD12  LEU   8          HD12      LEU   8  -1.985  -3.884   4.947
   39   HD13  LEU   8          HD13      LEU   8  -2.772  -4.921   6.160
   40   HD21  LEU   8          HD21      LEU   8  -5.380  -5.311   4.555
   41   HD22  LEU   8          HD22      LEU   8  -5.349  -4.908   6.288
   42   HD23  LEU   8          HD23      LEU   8  -6.246  -3.874   5.151
   43    H    GLY   9           H        GLY   9  -2.823   0.461   3.919
   44    HA2  GLY   9           HA2      GLY   9  -5.323   1.843   4.096
   45    HA3  GLY   9           HA3      GLY   9  -4.108   2.678   5.080
   46    H    GLU  10           H        GLU  10  -1.997   3.247   3.922
   47    HA   GLU  10           HA       GLU  10  -2.730   4.572   1.421
   48    HB2  GLU  10           HB2      GLU  10  -1.158   5.350   3.392
   49    HB3  GLU  10           HB3      GLU  10   0.084   4.495   2.464
   50    HG2  GLU  10           HG2      GLU  10   0.260   6.687   1.708
   51    HG3  GLU  10           HG3      GLU  10  -0.733   5.914   0.459
   52    HA   PRO  11           HA       PRO  11  -1.407   0.944  -1.014
   53    HB2  PRO  11           HB2      PRO  11  -2.243   2.685  -3.302
   54    HB3  PRO  11           HB3      PRO  11  -2.789   1.041  -2.864
   55    HG2  PRO  11           HG3      PRO  11  -4.361   3.170  -2.528
   56    HG3  PRO  11           HG2      PRO  11  -4.357   1.816  -1.362
   57    HD2  PRO  11           HD3      PRO  11  -3.029   4.515  -1.170
   58    HD3  PRO  11           HD2      PRO  11  -3.931   3.606   0.082
   59    H    CYS  12           H        CYS  12  -0.125   0.790  -3.223
   60    HA   CYS  12           HA       CYS  12   2.317   2.408  -2.866
   61    HB2  CYS  12           HB2      CYS  12   1.668  -0.019  -4.552
   62    HB3  CYS  12           HB3      CYS  12   3.231   0.813  -4.603
   63    H    ALA  13           H        ALA  13  -0.470   2.386  -4.873
   64    HA   ALA  13           HA       ALA  13   0.933   4.092  -6.884
   65    HB1  ALA  13           HB1      ALA  13  -0.744   3.451  -8.492
   66    HB2  ALA  13           HB2      ALA  13  -0.080   1.975  -7.752
   67    HB3  ALA  13           HB3      ALA  13  -1.675   2.584  -7.247
   68    H    GLY  14           H        GLY  14   0.654   6.165  -6.526
   69    HA2  GLY  14           HA2      GLY  14  -1.930   7.374  -6.489
   70    HA3  GLY  14           HA3      GLY  14  -1.297   7.307  -4.833
   71    H    ASN  15           H        ASN  15   0.864   8.225  -4.466
   72    HA   ASN  15           HA       ASN  15   1.108  10.771  -5.940
   73    HB2  ASN  15           HB3      ASN  15   1.097  10.416  -3.336
   74    HB3  ASN  15           HB2      ASN  15   2.813  10.042  -3.580
   75   HD21  ASN  15          HD21      ASN  15   4.250  11.659  -4.295
   76   HD22  ASN  15          HD22      ASN  15   3.829  13.355  -4.225
   77    HA   PRO  16           HA       PRO  16   2.039   7.372  -5.002
   78    HB2  PRO  16           HB3      PRO  16   4.373   5.675  -4.780
   79    HB3  PRO  16           HB2      PRO  16   2.962   5.459  -5.852
   80    HG2  PRO  16           HG2      PRO  16   5.540   6.031  -6.697
   81    HG3  PRO  16           HG3      PRO  16   4.056   6.330  -7.643
   82    HD2  PRO  16           HD2      PRO  16   5.694   8.259  -6.010
   83    HD3  PRO  16           HD3      PRO  16   4.876   8.493  -7.587
   84    H    TRP  17           H        TRP  17   1.867   6.881  -2.837
   85    HA   TRP  17           HA       TRP  17   3.766   8.279  -1.045
   86    HB2  TRP  17           HB3      TRP  17   1.050   7.024  -0.534
   87    HB3  TRP  17           HB2      TRP  17   2.055   7.781   0.714
   88    HD1  TRP  17           HD1      TRP  17  -0.550   8.602  -1.834
   89    HE1  TRP  17           HE1      TRP  17  -0.927  11.151  -1.982
   90    HE3  TRP  17           HE3      TRP  17   3.523  10.149   0.857
   91    HZ2  TRP  17           HZ2      TRP  17   0.350  13.479  -1.069
   92    HZ3  TRP  17           HZ3      TRP  17   3.875  12.566   1.176
   93    HH2  TRP  17           HH2      TRP  17   2.307  14.206   0.225
   94    H    GLY  18           H        GLY  18   2.258   5.037  -1.382
   95    HA2  GLY  18           HA3      GLY  18   3.509   3.010  -1.140
   96    HA3  GLY  18           HA2      GLY  18   4.714   3.887  -0.180
   97    H    CYS  19           H        CYS  19   3.576   1.391   0.469
   98    HA   CYS  19           HA       CYS  19   1.793   1.980   2.780
   99    HB2  CYS  19           HB2      CYS  19   1.983  -0.145   0.893
  100    HB3  CYS  19           HB3      CYS  19   2.447  -0.813   2.466
  101    H    CYS  20           H        CYS  20   2.399   1.582   4.860
  102    HA   CYS  20           HA       CYS  20   5.137   1.842   5.566
  103    HB2  CYS  20           HB2      CYS  20   2.625   1.126   7.049
  104    HB3  CYS  20           HB3      CYS  20   4.189   1.051   7.874
  105    HA   PRO  21           HA       PRO  21   7.174  -2.098   5.574
  106    HB2  PRO  21           HB2      PRO  21   7.894  -2.302   8.332
  107    HB3  PRO  21           HB3      PRO  21   8.875  -1.599   7.015
  108    HG2  PRO  21           HG3      PRO  21   7.084  -0.251   8.992
  109    HG3  PRO  21           HG2      PRO  21   8.646   0.288   8.313
  110    HD2  PRO  21           HD2      PRO  21   6.362   1.369   7.456
  111    HD3  PRO  21           HD3      PRO  21   7.663   0.966   6.291
  112    H    GLY  22           H        GLY  22   6.702  -4.223   5.785
  113    HA2  GLY  22           HA3      GLY  22   5.798  -6.126   6.950
  114    HA3  GLY  22           HA2      GLY  22   4.728  -5.038   7.856
  115    H    CYS  23           H        CYS  23   3.994  -3.521   5.436
  116    HA   CYS  23           HA       CYS  23   1.991  -5.448   4.364
  117    HB2  CYS  23           HB3      CYS  23   1.989  -2.437   4.040
  118    HB3  CYS  23           HB2      CYS  23   0.639  -3.566   3.847
  119    H    ILE  24           H        ILE  24   1.876  -5.965   2.255
  120    HA   ILE  24           HA       ILE  24   3.749  -4.560   0.400
  121    HB   ILE  24           HB       ILE  24   3.725  -6.764  -0.933
  122   HG12  ILE  24          HG12      ILE  24   3.637  -8.715   0.905
  123   HG13  ILE  24          HG13      ILE  24   2.404  -7.648   1.598
  124   HG21  ILE  24          HG21      ILE  24   5.665  -5.862   0.293
  125   HG22  ILE  24          HG22      ILE  24   5.617  -7.641   0.321
  126   HG23  ILE  24          HG23      ILE  24   5.122  -6.714   1.758
  127   HD11  ILE  24          HD11      ILE  24   1.398  -9.334   0.138
  128   HD12  ILE  24          HD12      ILE  24   1.168  -7.702  -0.533
  129   HD13  ILE  24          HD13      ILE  24   2.408  -8.779  -1.219
  130    H    CYS  25           H        CYS  25   3.129  -4.534  -1.869
  131    HA   CYS  25           HA       CYS  25   0.168  -4.265  -2.124
  132    HB2  CYS  25           HB2      CYS  25   2.428  -2.972  -3.676
  133    HB3  CYS  25           HB3      CYS  25   0.710  -2.779  -4.059
  134    H    ILE  26           H        ILE  26  -0.961  -5.270  -3.677
  135    HA   ILE  26           HA       ILE  26   0.450  -7.388  -5.189
  136    HB   ILE  26           HB       ILE  26  -2.546  -7.045  -5.250
  137   HG12  ILE  26          HG12      ILE  26  -2.123  -6.806  -2.882
  138   HG13  ILE  26          HG13      ILE  26  -2.827  -8.396  -3.198
  139   HG21  ILE  26          HG21      ILE  26  -1.437  -8.766  -6.628
  140   HG22  ILE  26          HG22      ILE  26  -0.789  -9.514  -5.149
  141   HG23  ILE  26          HG23      ILE  26  -2.546  -9.468  -5.426
  142   HD11  ILE  26          HD11      ILE  26  -1.081  -8.526  -1.488
  143   HD12  ILE  26          HD12      ILE  26   0.101  -7.821  -2.616
  144   HD13  ILE  26          HD13      ILE  26  -0.592  -9.427  -2.944
  145    H    TRP  27           H        TRP  27  -2.034  -4.866  -5.766
  146    HA   TRP  27           HA       TRP  27  -2.637  -3.655  -7.607
  147    HB2  TRP  27           HB3      TRP  27  -0.249  -2.878  -7.239
  148    HB3  TRP  27           HB2      TRP  27   0.227  -3.970  -8.546
  149    HD1  TRP  27           HD1      TRP  27  -2.963  -1.769  -8.839
  150    HE1  TRP  27           HE1      TRP  27  -2.631  -0.071 -10.749
  151    HE3  TRP  27           HE3      TRP  27   1.967  -2.708  -9.876
  152    HZ2  TRP  27           HZ2      TRP  27  -0.551   0.748 -12.438
  153    HZ3  TRP  27           HZ3      TRP  27   3.057  -1.412 -11.662
  154    HH2  TRP  27           HH2      TRP  27   1.814   0.294 -12.924
  155    H    GLN  28           H        GLN  28  -2.779  -6.635  -7.745
  156    HA   GLN  28           HA       GLN  28  -2.649  -7.047 -10.688
  157    HB2  GLN  28           HB3      GLN  28  -1.756  -8.718  -8.872
  158    HB3  GLN  28           HB2      GLN  28  -3.463  -9.155  -8.695
  159    HG2  GLN  28           HG3      GLN  28  -3.572  -9.734 -11.082
  160    HG3  GLN  28           HG2      GLN  28  -1.864  -9.293 -11.265
  161   HE21  GLN  28          HE21      GLN  28  -0.236 -10.619 -10.384
  162   HE22  GLN  28          HE22      GLN  28  -0.564 -12.264  -9.887
  163    H    LEU  29           H        LEU  29  -4.575  -5.522  -8.800
  164    HA   LEU  29           HA       LEU  29  -7.027  -6.196 -10.291
  165    HB2  LEU  29           HB3      LEU  29  -6.890  -6.187  -7.254
  166    HB3  LEU  29           HB2      LEU  29  -8.391  -6.093  -8.185
  167    HG   LEU  29           HG       LEU  29  -7.293  -8.331  -9.260
  168   HD11  LEU  29          HD11      LEU  29  -5.385  -8.275  -7.700
  169   HD12  LEU  29          HD12      LEU  29  -6.515  -8.335  -6.326
  170   HD13  LEU  29          HD13      LEU  29  -6.404  -9.713  -7.447
  171   HD21  LEU  29          HD21      LEU  29  -9.589  -8.033  -8.413
  172   HD22  LEU  29          HD22      LEU  29  -8.877  -9.571  -7.868
  173   HD23  LEU  29          HD23      LEU  29  -8.988  -8.194  -6.745
  174    H    THR  30           H        THR  30  -5.628  -4.169  -7.675
  175    HA   THR  30           HA       THR  30  -6.499  -1.757  -9.134
  176    HB   THR  30           HB       THR  30  -7.145  -1.008  -6.575
  177    HG1  THR  30           HG1      THR  30  -8.421  -2.647  -5.694
  178   HG21  THR  30          HG21      THR  30  -9.486  -1.112  -7.326
  179   HG22  THR  30          HG22      THR  30  -9.003  -2.170  -8.674
  180   HG23  THR  30          HG23      THR  30  -8.413  -0.492  -8.604
  181    H    ASP  31           H        ASP  31  -5.016  -2.932  -6.101
  182    HA   ASP  31           HA       ASP  31  -2.497  -2.393  -5.961
  183    HB2  ASP  31           HB3      ASP  31  -3.082  -0.097  -7.205
  184    HB3  ASP  31           HB2      ASP  31  -3.318   0.465  -5.539
  185    H    ARG  32           H        ARG  32  -4.214  -3.637  -4.419
  186    HA   ARG  32           HA       ARG  32  -4.733  -2.108  -1.949
  187    HB2  ARG  32           HB2      ARG  32  -5.356  -4.927  -2.844
  188    HB3  ARG  32           HB3      ARG  32  -5.629  -4.385  -1.179
  189    HG2  ARG  32           HG2      ARG  32  -7.144  -2.624  -2.013
  190    HG3  ARG  32           HG3      ARG  32  -6.877  -3.189  -3.676
  191    HD2  ARG  32           HD3      ARG  32  -7.808  -5.392  -3.071
  192    HD3  ARG  32           HD2      ARG  32  -8.071  -4.821  -1.411
  193    HE   ARG  32           HE       ARG  32  -9.372  -3.042  -3.208
  194   HH11  ARG  32          HH11      ARG  32  -9.685  -6.358  -1.994
  195   HH12  ARG  32          HH12      ARG  32 -11.419  -6.390  -2.226
  196   HH21  ARG  32          HH21      ARG  32 -11.609  -3.125  -3.491
  197   HH22  ARG  32          HH22      ARG  32 -12.501  -4.570  -3.069
  198    H    CYS  33           H        CYS  33  -3.912  -2.564   0.078
  199    HA   CYS  33           HA       CYS  33  -1.210  -3.785   0.043
  200    HB2  CYS  33           HB2      CYS  33  -2.667  -1.931   1.923
  201    HB3  CYS  33           HB3      CYS  33  -1.211  -2.792   2.446
  202    H    VAL  34           H        VAL  34  -0.918  -5.786   0.641
  203    HA   VAL  34           HA       VAL  34  -2.588  -6.925   2.836
  204    HB   VAL  34           HB       VAL  34  -1.724  -8.828   0.695
  205   HG11  VAL  34          HG11      VAL  34  -2.858  -9.559   2.764
  206   HG12  VAL  34          HG12      VAL  34  -4.281  -8.592   2.309
  207   HG13  VAL  34          HG13      VAL  34  -3.785  -9.972   1.301
  208   HG21  VAL  34          HG21      VAL  34  -3.934  -8.448  -0.523
  209   HG22  VAL  34          HG22      VAL  34  -3.988  -6.864   0.286
  210   HG23  VAL  34          HG23      VAL  34  -2.645  -7.256  -0.814
  211    H    GLY  35           H        GLY  35  -1.523  -9.073   3.628
  212    HA2  GLY  35           HA3      GLY  35   0.970  -9.992   3.328
  213    HA3  GLY  35           HA2      GLY  35   1.324  -8.419   4.066
  214    H    ASN  36           H        ASN  36   1.690  -8.488   6.146
  215    HA   ASN  36           HA       ASN  36   0.078 -10.353   7.822
  216    HB2  ASN  36           HB2      ASN  36   2.142 -10.845   9.169
  217    HB3  ASN  36           HB3      ASN  36   2.143 -11.529   7.535
  218   HD21  ASN  36          HD21      ASN  36   3.568 -10.685   5.948
  219   HD22  ASN  36          HD22      ASN  36   4.943  -9.697   6.389
  220    H    CYS  37           H        CYS  37  -0.096  -7.464   7.289
  221    HA   CYS  37           HA       CYS  37   0.459  -6.424  10.033
  222    HB2  CYS  37           HB3      CYS  37   0.402  -4.169   8.986
  223    HB3  CYS  37           HB2      CYS  37   1.718  -5.200   8.399
  Start of MODEL    4
    1    H1   GLU   2           H        GLU   2  -3.471  13.539   6.595
    2    HA   GLU   2           HA       GLU   2  -2.626  10.725   7.130
    3    HB2  GLU   2           HB3      GLU   2  -3.142  12.050   4.455
    4    HB3  GLU   2           HB2      GLU   2  -2.133  10.604   4.630
    5    HG2  GLU   2           HG2      GLU   2  -4.025   9.381   5.592
    6    HG3  GLU   2           HG3      GLU   2  -5.046  10.823   5.440
    7    H    GLY   3           H        GLY   3  -0.522  10.440   7.430
    8    HA2  GLY   3           HA2      GLY   3   1.253  12.775   6.895
    9    HA3  GLY   3           HA3      GLY   3   1.538  11.527   8.123
   10    H    GLU   4           H        GLU   4   2.258   9.449   7.482
   11    HA   GLU   4           HA       GLU   4   3.138   9.148   4.673
   12    HB2  GLU   4           HB2      GLU   4   4.951   9.363   7.052
   13    HB3  GLU   4           HB3      GLU   4   5.385   8.249   5.742
   14    HG2  GLU   4           HG3      GLU   4   5.320  10.074   4.131
   15    HG3  GLU   4           HG2      GLU   4   4.779  11.196   5.395
   16    H    CYS   5           H        CYS   5   1.625   7.619   4.440
   17    HA   CYS   5           HA       CYS   5   0.597   5.583   4.476
   18    HB2  CYS   5           HB3      CYS   5   2.045   3.586   4.512
   19    HB3  CYS   5           HB2      CYS   5   2.592   4.858   3.411
   20    H    SER   6           H        SER   6   0.094   3.519   5.599
   21    HA   SER   6           HA       SER   6   0.553   3.487   8.503
   22    HB2  SER   6           HB3      SER   6  -2.240   3.884   7.356
   23    HB3  SER   6           HB2      SER   6  -1.870   3.491   9.049
   24    HG   SER   6           HG       SER   6  -2.161   5.753   8.706
   25    HA   PRO   7           HA       PRO   7   0.132  -0.919   7.919
   26    HB2  PRO   7           HB2      PRO   7  -1.604  -1.075  10.361
   27    HB3  PRO   7           HB3      PRO   7  -0.064  -1.909  10.002
   28    HG2  PRO   7           HG3      PRO   7  -0.186   0.106  11.751
   29    HG3  PRO   7           HG2      PRO   7   1.221  -0.115  10.674
   30    HD2  PRO   7           HD2      PRO   7  -1.051   1.852  10.478
   31    HD3  PRO   7           HD3      PRO   7   0.688   2.070  10.111
   32    H    LEU   8           H        LEU   8  -1.093  -1.269   6.180
   33    HA   LEU   8           HA       LEU   8  -2.876  -1.548   4.783
   34    HB2  LEU   8           HB3      LEU   8  -3.497  -2.989   7.127
   35    HB3  LEU   8           HB2      LEU   8  -4.984  -2.151   6.655
   36    HG   LEU   8           HG       LEU   8  -4.553  -3.080   4.301
   37   HD11  LEU   8          HD11      LEU   8  -3.265  -5.183   4.222
   38   HD12  LEU   8          HD12      LEU   8  -2.758  -4.929   5.909
   39   HD13  LEU   8          HD13      LEU   8  -2.236  -3.792   4.643
   40   HD21  LEU   8          HD21      LEU   8  -5.654  -5.203   4.880
   41   HD22  LEU   8          HD22      LEU   8  -5.244  -4.939   6.592
   42   HD23  LEU   8          HD23      LEU   8  -6.355  -3.824   5.761
   43    H    GLY   9           H        GLY   9  -2.951   0.536   4.139
   44    HA2  GLY   9           HA2      GLY   9  -5.430   1.915   4.592
   45    HA3  GLY   9           HA3      GLY   9  -4.106   2.718   5.456
   46    H    GLU  10           H        GLU  10  -2.131   3.292   4.103
   47    HA   GLU  10           HA       GLU  10  -3.060   4.701   1.733
   48    HB2  GLU  10           HB3      GLU  10  -0.435   4.445   3.180
   49    HB3  GLU  10           HB2      GLU  10  -0.495   5.171   1.566
   50    HG2  GLU  10           HG2      GLU  10  -0.609   6.971   3.082
   51    HG3  GLU  10           HG3      GLU  10  -2.255   6.761   2.461
   52    HA   PRO  11           HA       PRO  11  -2.466   1.351  -1.231
   53    HB2  PRO  11           HB3      PRO  11  -2.229   3.674  -3.137
   54    HB3  PRO  11           HB2      PRO  11  -3.253   2.214  -3.254
   55    HG2  PRO  11           HG2      PRO  11  -4.304   4.558  -2.587
   56    HG3  PRO  11           HG3      PRO  11  -4.831   3.057  -1.774
   57    HD2  PRO  11           HD2      PRO  11  -3.012   5.231  -0.770
   58    HD3  PRO  11           HD3      PRO  11  -4.248   4.274   0.102
   59    H    CYS  12           H        CYS  12  -0.886   0.595  -2.787
   60    HA   CYS  12           HA       CYS  12   1.836   1.569  -2.145
   61    HB2  CYS  12           HB2      CYS  12   1.261  -0.830  -1.926
   62    HB3  CYS  12           HB3      CYS  12   0.924  -0.898  -3.663
   63    H    ALA  13           H        ALA  13  -0.361   2.515  -4.338
   64    HA   ALA  13           HA       ALA  13   1.357   2.445  -6.733
   65    HB1  ALA  13           HB1      ALA  13  -0.553   3.537  -7.842
   66    HB2  ALA  13           HB2      ALA  13  -1.022   2.041  -6.999
   67    HB3  ALA  13           HB3      ALA  13  -1.395   3.624  -6.276
   68    H    GLY  14           H        GLY  14   1.809   4.052  -4.151
   69    HA2  GLY  14           HA3      GLY  14   3.143   5.941  -3.805
   70    HA3  GLY  14           HA2      GLY  14   2.924   6.393  -5.506
   71    H    ASN  15           H        ASN  15   0.440   5.761  -3.029
   72    HA   ASN  15           HA       ASN  15  -0.333   8.640  -3.186
   73    HB2  ASN  15           HB3      ASN  15  -2.130   6.204  -3.393
   74    HB3  ASN  15           HB2      ASN  15  -2.736   7.825  -3.005
   75   HD21  ASN  15          HD21      ASN  15  -2.495   9.106  -6.280
   76   HD22  ASN  15          HD22      ASN  15  -2.708   9.469  -4.582
   77    HA   PRO  16           HA       PRO  16   0.178  10.173  -1.990
   78    HB2  PRO  16           HB3      PRO  16   1.937  10.653   0.341
   79    HB3  PRO  16           HB2      PRO  16   0.615  11.672  -0.296
   80    HG2  PRO  16           HG2      PRO  16   0.433  10.359   2.057
   81    HG3  PRO  16           HG3      PRO  16  -0.978  10.633   0.998
   82    HD2  PRO  16           HD2      PRO  16   0.703   8.144   1.315
   83    HD3  PRO  16           HD3      PRO  16  -1.079   8.318   1.235
   84    H    TRP  17           H        TRP  17   2.027   7.617  -0.459
   85    HA   TRP  17           HA       TRP  17   4.164   7.922  -2.498
   86    HB2  TRP  17           HB2      TRP  17   4.613   7.781   0.495
   87    HB3  TRP  17           HB3      TRP  17   5.874   7.393  -0.689
   88    HD1  TRP  17           HD1      TRP  17   4.149  10.317   0.993
   89    HE1  TRP  17           HE1      TRP  17   5.202  12.542   0.224
   90    HE3  TRP  17           HE3      TRP  17   7.025   8.530  -2.849
   91    HZ2  TRP  17           HZ2      TRP  17   7.008  13.393  -1.753
   92    HZ3  TRP  17           HZ3      TRP  17   8.392  10.122  -4.134
   93    HH2  TRP  17           HH2      TRP  17   8.384  12.521  -3.590
   94    H    GLY  18           H        GLY  18   2.556   5.972  -0.004
   95    HA2  GLY  18           HA3      GLY  18   2.226   3.648  -1.391
   96    HA3  GLY  18           HA2      GLY  18   3.912   3.522  -0.855
   97    H    CYS  19           H        CYS  19   3.126   1.594   0.219
   98    HA   CYS  19           HA       CYS  19   1.593   2.126   2.713
   99    HB2  CYS  19           HB2      CYS  19   1.585   0.020   0.831
  100    HB3  CYS  19           HB3      CYS  19   2.333  -0.644   2.293
  101    H    CYS  20           H        CYS  20   2.433   1.834   4.689
  102    HA   CYS  20           HA       CYS  20   5.233   2.115   5.104
  103    HB2  CYS  20           HB3      CYS  20   2.873   1.487   6.863
  104    HB3  CYS  20           HB2      CYS  20   4.515   1.416   7.519
  105    HA   PRO  21           HA       PRO  21   7.186  -1.873   5.078
  106    HB2  PRO  21           HB2      PRO  21   8.261  -1.958   7.715
  107    HB3  PRO  21           HB3      PRO  21   9.062  -1.306   6.257
  108    HG2  PRO  21           HG2      PRO  21   7.537   0.125   8.400
  109    HG3  PRO  21           HG3      PRO  21   9.006   0.620   7.511
  110    HD2  PRO  21           HD3      PRO  21   6.630   1.678   6.912
  111    HD3  PRO  21           HD2      PRO  21   7.790   1.263   5.610
  112    H    GLY  22           H        GLY  22   6.668  -3.959   5.433
  113    HA2  GLY  22           HA2      GLY  22   5.954  -5.727   6.986
  114    HA3  GLY  22           HA3      GLY  22   4.831  -4.562   7.715
  115    H    CYS  23           H        CYS  23   4.088  -3.471   5.058
  116    HA   CYS  23           HA       CYS  23   2.132  -5.588   4.319
  117    HB2  CYS  23           HB3      CYS  23   2.151  -2.686   3.441
  118    HB3  CYS  23           HB2      CYS  23   0.805  -3.837   3.391
  119    H    ILE  24           H        ILE  24   2.053  -6.505   2.335
  120    HA   ILE  24           HA       ILE  24   4.201  -5.722   0.437
  121    HB   ILE  24           HB       ILE  24   3.651  -7.907  -0.736
  122   HG12  ILE  24          HG13      ILE  24   2.682  -9.563   1.176
  123   HG13  ILE  24          HG12      ILE  24   1.752  -8.099   1.542
  124   HG21  ILE  24          HG21      ILE  24   5.597  -7.582   0.744
  125   HG22  ILE  24          HG22      ILE  24   4.613  -8.107   2.132
  126   HG23  ILE  24          HG23      ILE  24   4.967  -9.246   0.810
  127   HD11  ILE  24          HD11      ILE  24   0.530  -9.566   0.012
  128   HD12  ILE  24          HD12      ILE  24   1.876  -9.488  -1.150
  129   HD13  ILE  24          HD13      ILE  24   0.941  -8.022  -0.773
  130    H    CYS  25           H        CYS  25   3.776  -5.671  -1.847
  131    HA   CYS  25           HA       CYS  25   1.095  -4.481  -2.384
  132    HB2  CYS  25           HB3      CYS  25   3.582  -4.218  -4.087
  133    HB3  CYS  25           HB2      CYS  25   2.114  -3.228  -4.124
  134    H    ILE  26           H        ILE  26  -0.188  -5.149  -4.002
  135    HA   ILE  26           HA       ILE  26   0.675  -7.590  -5.476
  136    HB   ILE  26           HB       ILE  26  -1.921  -7.879  -5.733
  137   HG12  ILE  26          HG13      ILE  26  -2.527  -7.039  -3.086
  138   HG13  ILE  26          HG12      ILE  26  -1.820  -5.643  -3.918
  139   HG21  ILE  26          HG21      ILE  26  -0.382  -9.402  -4.572
  140   HG22  ILE  26          HG22      ILE  26  -0.548  -8.425  -3.094
  141   HG23  ILE  26          HG23      ILE  26  -1.959  -9.283  -3.757
  142   HD11  ILE  26          HD11      ILE  26  -4.254  -5.674  -4.152
  143   HD12  ILE  26          HD12      ILE  26  -3.455  -5.878  -5.730
  144   HD13  ILE  26          HD13      ILE  26  -4.168  -7.285  -4.904
  145    H    TRP  27           H        TRP  27  -1.846  -5.079  -5.812
  146    HA   TRP  27           HA       TRP  27  -2.593  -3.832  -7.581
  147    HB2  TRP  27           HB2      TRP  27  -0.185  -3.004  -7.337
  148    HB3  TRP  27           HB3      TRP  27   0.201  -3.994  -8.750
  149    HD1  TRP  27           HD1      TRP  27  -3.151  -2.580  -9.426
  150    HE1  TRP  27           HE1      TRP  27  -3.025  -0.465 -10.893
  151    HE3  TRP  27           HE3      TRP  27   1.867  -1.627  -9.000
  152    HZ2  TRP  27           HZ2      TRP  27  -1.053   1.342 -11.740
  153    HZ3  TRP  27           HZ3      TRP  27   2.795   0.325 -10.177
  154    HH2  TRP  27           HH2      TRP  27   1.352   1.789 -11.527
  155    H    GLN  28           H        GLN  28  -2.754  -6.757  -7.767
  156    HA   GLN  28           HA       GLN  28  -2.519  -7.263 -10.673
  157    HB2  GLN  28           HB3      GLN  28  -3.236  -9.014  -8.308
  158    HB3  GLN  28           HB2      GLN  28  -3.409  -9.556  -9.986
  159    HG2  GLN  28           HG2      GLN  28  -1.014  -9.194 -10.363
  160    HG3  GLN  28           HG3      GLN  28  -0.827  -8.641  -8.688
  161   HE21  GLN  28          HE21      GLN  28  -0.968 -10.141  -6.971
  162   HE22  GLN  28          HE22      GLN  28  -0.829 -11.862  -7.247
  163    H    LEU  29           H        LEU  29  -4.489  -5.446  -9.135
  164    HA   LEU  29           HA       LEU  29  -6.744  -5.881 -10.903
  165    HB2  LEU  29           HB3      LEU  29  -8.468  -6.052  -9.089
  166    HB3  LEU  29           HB2      LEU  29  -7.486  -7.499  -9.333
  167    HG   LEU  29           HG       LEU  29  -6.618  -5.601  -7.196
  168   HD11  LEU  29          HD11      LEU  29  -9.060  -5.738  -6.884
  169   HD12  LEU  29          HD12      LEU  29  -8.180  -6.574  -5.583
  170   HD13  LEU  29          HD13      LEU  29  -8.955  -7.515  -6.881
  171   HD21  LEU  29          HD21      LEU  29  -5.333  -7.638  -7.732
  172   HD22  LEU  29          HD22      LEU  29  -6.768  -8.630  -7.379
  173   HD23  LEU  29          HD23      LEU  29  -5.993  -7.690  -6.080
  174    H    THR  30           H        THR  30  -5.589  -4.252  -7.927
  175    HA   THR  30           HA       THR  30  -6.519  -1.684  -9.090
  176    HB   THR  30           HB       THR  30  -7.034  -1.325  -6.395
  177    HG1  THR  30           HG1      THR  30  -8.325  -3.082  -5.781
  178   HG21  THR  30          HG21      THR  30  -9.400  -1.283  -7.070
  179   HG22  THR  30          HG22      THR  30  -8.362  -0.461  -8.259
  180   HG23  THR  30          HG23      THR  30  -8.975  -2.097  -8.595
  181    H    ASP  31           H        ASP  31  -4.781  -3.214  -6.382
  182    HA   ASP  31           HA       ASP  31  -2.429  -2.751  -5.952
  183    HB2  ASP  31           HB2      ASP  31  -2.392  -0.775  -7.586
  184    HB3  ASP  31           HB3      ASP  31  -3.002   0.217  -6.248
  185    H    ARG  32           H        ARG  32  -4.036  -3.635  -4.312
  186    HA   ARG  32           HA       ARG  32  -4.507  -1.712  -2.091
  187    HB2  ARG  32           HB3      ARG  32  -5.528  -4.511  -2.652
  188    HB3  ARG  32           HB2      ARG  32  -5.756  -3.697  -1.095
  189    HG2  ARG  32           HG2      ARG  32  -7.027  -1.921  -2.154
  190    HG3  ARG  32           HG3      ARG  32  -6.725  -2.617  -3.759
  191    HD2  ARG  32           HD2      ARG  32  -8.916  -3.293  -3.156
  192    HD3  ARG  32           HD3      ARG  32  -7.889  -4.722  -2.923
  193    HE   ARG  32           HE       ARG  32  -7.974  -3.414  -0.448
  194   HH11  ARG  32          HH11      ARG  32 -10.320  -4.927  -2.632
  195   HH12  ARG  32          HH12      ARG  32 -11.401  -5.372  -1.331
  196   HH21  ARG  32          HH21      ARG  32  -9.395  -4.007   1.202
  197   HH22  ARG  32          HH22      ARG  32 -10.879  -4.854   0.828
  198    H    CYS  33           H        CYS  33  -3.879  -2.215   0.066
  199    HA   CYS  33           HA       CYS  33  -1.248  -3.533   0.179
  200    HB2  CYS  33           HB3      CYS  33  -2.849  -1.971   2.229
  201    HB3  CYS  33           HB2      CYS  33  -1.251  -2.672   2.533
  202    H    VAL  34           H        VAL  34  -0.906  -5.532   0.792
  203    HA   VAL  34           HA       VAL  34  -2.799  -6.825   2.683
  204    HB   VAL  34           HB       VAL  34  -2.117  -8.963   1.140
  205   HG11  VAL  34          HG11      VAL  34  -4.344  -8.373   2.011
  206   HG12  VAL  34          HG12      VAL  34  -4.531  -7.186   0.698
  207   HG13  VAL  34          HG13      VAL  34  -4.403  -8.920   0.318
  208   HG21  VAL  34          HG21      VAL  34  -2.331  -8.508  -1.189
  209   HG22  VAL  34          HG22      VAL  34  -1.079  -7.409  -0.563
  210   HG23  VAL  34          HG23      VAL  34  -2.718  -6.796  -0.890
  211    H    GLY  35           H        GLY  35  -1.882  -8.892   3.596
  212    HA2  GLY  35           HA2      GLY  35   0.497 -10.017   3.572
  213    HA3  GLY  35           HA3      GLY  35   0.998  -8.421   4.161
  214    H    ASN  36           H        ASN  36   1.362  -8.418   6.250
  215    HA   ASN  36           HA       ASN  36  -0.532  -9.889   8.033
  216    HB2  ASN  36           HB3      ASN  36   1.831 -10.960   7.575
  217    HB3  ASN  36           HB2      ASN  36   2.401  -9.708   8.694
  218   HD21  ASN  36          HD21      ASN  36   1.808  -9.771  10.886
  219   HD22  ASN  36          HD22      ASN  36   1.117 -11.204  11.613
  220    H    CYS  37           H        CYS  37  -0.369  -7.065   7.199
  221    HA   CYS  37           HA       CYS  37   0.280  -5.791   9.821
  222    HB2  CYS  37           HB3      CYS  37   0.419  -3.671   8.533
  223    HB3  CYS  37           HB2      CYS  37   1.622  -4.878   8.050
  Start of MODEL    5
    1    H1   GLU   2           H        GLU   2   2.772  15.896   1.840
    2    HA   GLU   2           HA       GLU   2   1.085  13.456   1.509
    3    HB2  GLU   2           HB2      GLU   2   2.796  14.842  -0.571
    4    HB3  GLU   2           HB3      GLU   2   2.284  13.154  -0.725
    5    HG2  GLU   2           HG2      GLU   2   0.290  15.383  -0.310
    6    HG3  GLU   2           HG3      GLU   2   0.908  14.982  -1.923
    7    H    GLY   3           H        GLY   3   2.159  11.478   1.505
    8    HA2  GLY   3           HA3      GLY   3   4.184  10.156   1.551
    9    HA3  GLY   3           HA2      GLY   3   5.058  11.567   2.179
   10    H    GLU   4           H        GLU   4   2.135   9.700   3.092
   11    HA   GLU   4           HA       GLU   4   3.341   9.016   5.683
   12    HB2  GLU   4           HB3      GLU   4   1.032  10.927   5.399
   13    HB3  GLU   4           HB2      GLU   4   1.107   9.829   6.789
   14    HG2  GLU   4           HG3      GLU   4   3.269  10.722   7.434
   15    HG3  GLU   4           HG2      GLU   4   3.302  11.753   5.991
   16    H    CYS   5           H        CYS   5   3.236   6.932   5.198
   17    HA   CYS   5           HA       CYS   5   0.741   5.690   4.261
   18    HB2  CYS   5           HB2      CYS   5   2.118   3.574   4.446
   19    HB3  CYS   5           HB3      CYS   5   2.687   4.781   3.283
   20    H    SER   6           H        SER   6  -0.329   3.991   5.311
   21    HA   SER   6           HA       SER   6   0.046   3.925   8.272
   22    HB2  SER   6           HB2      SER   6  -2.583   3.995   6.746
   23    HB3  SER   6           HB3      SER   6  -2.415   3.771   8.500
   24    HG   SER   6           HG       SER   6  -2.830   5.965   7.920
   25    HA   PRO   7           HA       PRO   7   0.118  -0.523   7.959
   26    HB2  PRO   7           HB2      PRO   7  -2.006  -0.707  10.072
   27    HB3  PRO   7           HB3      PRO   7  -0.373  -1.434  10.029
   28    HG2  PRO   7           HG2      PRO   7  -0.921   0.653  11.604
   29    HG3  PRO   7           HG3      PRO   7   0.653   0.491  10.775
   30    HD2  PRO   7           HD2      PRO   7  -1.680   2.268  10.107
   31    HD3  PRO   7           HD3      PRO   7   0.078   2.589   9.992
   32    H    LEU   8           H        LEU   8  -0.732  -0.950   6.022
   33    HA   LEU   8           HA       LEU   8  -2.200  -1.496   4.357
   34    HB2  LEU   8           HB3      LEU   8  -3.119  -2.896   6.664
   35    HB3  LEU   8           HB2      LEU   8  -4.541  -2.302   5.795
   36    HG   LEU   8           HG       LEU   8  -3.542  -3.330   3.700
   37   HD11  LEU   8          HD11      LEU   8  -1.234  -3.584   4.534
   38   HD12  LEU   8          HD12      LEU   8  -1.803  -4.768   5.734
   39   HD13  LEU   8          HD13      LEU   8  -1.917  -5.137   3.997
   40   HD21  LEU   8          HD21      LEU   8  -4.355  -5.578   4.283
   41   HD22  LEU   8          HD22      LEU   8  -4.315  -5.136   6.007
   42   HD23  LEU   8          HD23      LEU   8  -5.428  -4.298   4.899
   43    H    GLY   9           H        GLY   9  -2.454   0.519   3.546
   44    HA2  GLY   9           HA3      GLY   9  -5.104   1.629   3.621
   45    HA3  GLY   9           HA2      GLY   9  -4.007   2.591   4.624
   46    H    GLU  10           H        GLU  10  -1.930   3.372   3.518
   47    HA   GLU  10           HA       GLU  10  -2.603   4.971   1.290
   48    HB2  GLU  10           HB2      GLU  10  -0.299   4.482   2.894
   49    HB3  GLU  10           HB3      GLU  10   0.204   4.452   1.196
   50    HG2  GLU  10           HG3      GLU  10  -1.337   6.670   1.165
   51    HG3  GLU  10           HG2      GLU  10  -0.817   6.695   2.861
   52    HA   PRO  11           HA       PRO  11  -2.206   2.230  -2.229
   53    HB2  PRO  11           HB2      PRO  11  -1.860   4.505  -4.045
   54    HB3  PRO  11           HB3      PRO  11  -3.307   3.489  -3.793
   55    HG2  PRO  11           HG2      PRO  11  -3.152   6.120  -3.075
   56    HG3  PRO  11           HG3      PRO  11  -4.211   4.924  -2.277
   57    HD2  PRO  11           HD3      PRO  11  -1.530   5.982  -1.400
   58    HD3  PRO  11           HD2      PRO  11  -3.006   5.682  -0.428
   59    H    CYS  12           H        CYS  12  -0.693   1.390  -3.693
   60    HA   CYS  12           HA       CYS  12   2.088   2.256  -3.202
   61    HB2  CYS  12           HB3      CYS  12   1.098  -0.152  -4.752
   62    HB3  CYS  12           HB2      CYS  12   2.727   0.131  -4.116
   63    H    ALA  13           H        ALA  13   0.004   3.567  -5.155
   64    HA   ALA  13           HA       ALA  13   1.944   3.780  -7.412
   65    HB1  ALA  13           HB1      ALA  13  -0.071   4.077  -8.928
   66    HB2  ALA  13           HB2      ALA  13   0.202   2.431  -8.307
   67    HB3  ALA  13           HB3      ALA  13  -1.062   3.456  -7.586
   68    H    GLY  14           H        GLY  14   2.700   5.753  -7.597
   69    HA2  GLY  14           HA2      GLY  14   1.307   8.074  -8.044
   70    HA3  GLY  14           HA3      GLY  14   1.379   7.993  -6.273
   71    H    ASN  15           H        ASN  15   3.644   7.475  -5.406
   72    HA   ASN  15           HA       ASN  15   5.485   9.426  -6.650
   73    HB2  ASN  15           HB2      ASN  15   4.771   9.290  -4.132
   74    HB3  ASN  15           HB3      ASN  15   6.023   8.037  -4.039
   75   HD21  ASN  15          HD21      ASN  15   8.219   8.592  -4.381
   76   HD22  ASN  15          HD22      ASN  15   8.764  10.252  -4.294
   77    HA   PRO  16           HA       PRO  16   4.254   6.121  -5.760
   78    HB2  PRO  16           HB3      PRO  16   5.197   3.450  -5.186
   79    HB3  PRO  16           HB2      PRO  16   4.162   3.974  -6.543
   80    HG2  PRO  16           HG2      PRO  16   6.760   3.019  -6.774
   81    HG3  PRO  16           HG3      PRO  16   5.906   4.001  -7.996
   82    HD2  PRO  16           HD3      PRO  16   7.916   4.854  -5.928
   83    HD3  PRO  16           HD2      PRO  16   7.729   5.397  -7.625
   84    H    TRP  17           H        TRP  17   3.412   5.991  -3.741
   85    HA   TRP  17           HA       TRP  17   5.263   5.476  -1.463
   86    HB2  TRP  17           HB2      TRP  17   3.864   7.255  -0.210
   87    HB3  TRP  17           HB3      TRP  17   5.143   7.797  -1.302
   88    HD1  TRP  17           HD1      TRP  17   1.534   6.847  -2.464
   89    HE1  TRP  17           HE1      TRP  17   0.433   8.923  -3.524
   90    HE3  TRP  17           HE3      TRP  17   5.191  10.285  -1.430
   91    HZ2  TRP  17           HZ2      TRP  17   1.048  11.641  -3.850
   92    HZ3  TRP  17           HZ3      TRP  17   4.849  12.615  -2.149
   93    HH2  TRP  17           HH2      TRP  17   2.802  13.281  -3.341
   94    H    GLY  18           H        GLY  18   4.411   3.356  -1.532
   95    HA2  GLY  18           HA2      GLY  18   1.563   2.911  -1.130
   96    HA3  GLY  18           HA3      GLY  18   2.840   1.683  -1.138
   97    H    CYS  19           H        CYS  19   1.895   0.621   0.562
   98    HA   CYS  19           HA       CYS  19   1.360   1.900   3.102
   99    HB2  CYS  19           HB2      CYS  19   1.673  -1.036   2.414
  100    HB3  CYS  19           HB3      CYS  19   0.957  -0.382   3.897
  101    H    CYS  20           H        CYS  20   2.465   1.885   4.964
  102    HA   CYS  20           HA       CYS  20   5.256   2.097   5.013
  103    HB2  CYS  20           HB2      CYS  20   3.237   1.453   7.166
  104    HB3  CYS  20           HB3      CYS  20   4.953   1.671   7.531
  105    HA   PRO  21           HA       PRO  21   7.269  -1.870   5.024
  106    HB2  PRO  21           HB2      PRO  21   8.688  -1.734   7.494
  107    HB3  PRO  21           HB3      PRO  21   9.278  -1.210   5.891
  108    HG2  PRO  21           HG3      PRO  21   8.030   0.395   8.086
  109    HG3  PRO  21           HG2      PRO  21   9.364   0.821   6.978
  110    HD2  PRO  21           HD3      PRO  21   6.916   1.817   6.611
  111    HD3  PRO  21           HD2      PRO  21   7.890   1.289   5.203
  112    H    GLY  22           H        GLY  22   6.513  -3.823   5.431
  113    HA2  GLY  22           HA2      GLY  22   6.155  -5.450   7.380
  114    HA3  GLY  22           HA3      GLY  22   4.969  -4.260   7.951
  115    H    CYS  23           H        CYS  23   4.251  -3.649   5.082
  116    HA   CYS  23           HA       CYS  23   2.619  -6.099   4.526
  117    HB2  CYS  23           HB2      CYS  23   1.670  -3.408   3.641
  118    HB3  CYS  23           HB3      CYS  23   0.738  -4.833   4.124
  119    H    ILE  24           H        ILE  24   2.172  -6.564   2.322
  120    HA   ILE  24           HA       ILE  24   4.141  -5.320   0.459
  121    HB   ILE  24           HB       ILE  24   3.699  -7.437  -0.959
  122   HG12  ILE  24          HG13      ILE  24   3.326  -9.422   0.790
  123   HG13  ILE  24          HG12      ILE  24   2.356  -8.187   1.608
  124   HG21  ILE  24          HG21      ILE  24   5.794  -6.909   0.228
  125   HG22  ILE  24          HG22      ILE  24   5.451  -8.655   0.208
  126   HG23  ILE  24          HG23      ILE  24   5.156  -7.707   1.686
  127   HD11  ILE  24          HD11      ILE  24   0.971  -9.579   0.153
  128   HD12  ILE  24          HD12      ILE  24   0.999  -7.892  -0.413
  129   HD13  ILE  24          HD13      ILE  24   1.973  -9.127  -1.247
  130    H    CYS  25           H        CYS  25   3.552  -5.093  -1.792
  131    HA   CYS  25           HA       CYS  25   0.730  -4.178  -2.032
  132    HB2  CYS  25           HB2      CYS  25   3.150  -3.596  -3.766
  133    HB3  CYS  25           HB3      CYS  25   1.537  -2.898  -3.977
  134    H    ILE  26           H        ILE  26  -0.649  -4.889  -3.576
  135    HA   ILE  26           HA       ILE  26   0.193  -7.328  -5.046
  136    HB   ILE  26           HB       ILE  26  -2.636  -6.279  -4.626
  137   HG12  ILE  26          HG13      ILE  26  -1.736  -6.734  -2.423
  138   HG13  ILE  26          HG12      ILE  26  -2.907  -7.982  -2.865
  139   HG21  ILE  26          HG21      ILE  26  -2.337  -7.825  -6.525
  140   HG22  ILE  26          HG22      ILE  26  -3.357  -8.515  -5.240
  141   HG23  ILE  26          HG23      ILE  26  -1.665  -9.041  -5.412
  142   HD11  ILE  26          HD11      ILE  26  -1.028  -9.526  -3.403
  143   HD12  ILE  26          HD12      ILE  26   0.114  -8.280  -2.844
  144   HD13  ILE  26          HD13      ILE  26  -1.045  -9.002  -1.702
  145    H    TRP  27           H        TRP  27  -2.018  -4.550  -5.634
  146    HA   TRP  27           HA       TRP  27  -2.475  -3.290  -7.487
  147    HB2  TRP  27           HB2      TRP  27  -0.037  -2.743  -7.161
  148    HB3  TRP  27           HB3      TRP  27   0.345  -3.927  -8.417
  149    HD1  TRP  27           HD1      TRP  27  -2.587  -1.376  -8.744
  150    HE1  TRP  27           HE1      TRP  27  -2.105   0.197 -10.728
  151    HE3  TRP  27           HE3      TRP  27   2.149  -2.972  -9.877
  152    HZ2  TRP  27           HZ2      TRP  27   0.005   0.679 -12.510
  153    HZ3  TRP  27           HZ3      TRP  27   3.335  -1.892 -11.746
  154    HH2  TRP  27           HH2      TRP  27   2.277  -0.088 -13.039
  155    H    GLN  28           H        GLN  28  -2.883  -6.272  -7.551
  156    HA   GLN  28           HA       GLN  28  -2.860  -6.743 -10.490
  157    HB2  GLN  28           HB2      GLN  28  -3.439  -8.593  -8.156
  158    HB3  GLN  28           HB3      GLN  28  -3.624  -9.061  -9.855
  159    HG2  GLN  28           HG3      GLN  28  -1.228  -8.664 -10.230
  160    HG3  GLN  28           HG2      GLN  28  -1.045  -8.157  -8.539
  161   HE21  GLN  28          HE21      GLN  28  -1.571 -10.866 -10.729
  162   HE22  GLN  28          HE22      GLN  28  -1.245 -12.129  -9.563
  163    H    LEU  29           H        LEU  29  -4.606  -5.047  -8.572
  164    HA   LEU  29           HA       LEU  29  -7.131  -5.486 -10.025
  165    HB2  LEU  29           HB2      LEU  29  -6.931  -5.538  -6.996
  166    HB3  LEU  29           HB3      LEU  29  -8.443  -5.289  -7.877
  167    HG   LEU  29           HG       LEU  29  -6.813  -7.738  -8.467
  168   HD11  LEU  29          HD11      LEU  29  -6.876  -7.607  -6.005
  169   HD12  LEU  29          HD12      LEU  29  -7.875  -8.945  -6.622
  170   HD13  LEU  29          HD13      LEU  29  -8.648  -7.441  -6.065
  171   HD21  LEU  29          HD21      LEU  29  -8.840  -7.219  -9.777
  172   HD22  LEU  29          HD22      LEU  29  -9.028  -8.717  -8.836
  173   HD23  LEU  29          HD23      LEU  29  -9.800  -7.214  -8.278
  174    H    THR  30           H        THR  30  -5.534  -3.650  -7.386
  175    HA   THR  30           HA       THR  30  -6.110  -1.139  -8.813
  176    HB   THR  30           HB       THR  30  -6.753  -0.349  -6.273
  177    HG1  THR  30           HG1      THR  30  -8.208  -1.849  -5.432
  178   HG21  THR  30          HG21      THR  30  -9.072  -0.207  -7.088
  179   HG22  THR  30          HG22      THR  30  -8.664  -1.303  -8.429
  180   HG23  THR  30          HG23      THR  30  -7.905   0.304  -8.332
  181    H    ASP  31           H        ASP  31  -4.932  -2.405  -5.676
  182    HA   ASP  31           HA       ASP  31  -2.262  -2.013  -5.665
  183    HB2  ASP  31           HB2      ASP  31  -3.512   0.674  -5.743
  184    HB3  ASP  31           HB3      ASP  31  -2.343   0.452  -4.427
  185    H    ARG  32           H        ARG  32  -4.110  -3.518  -4.355
  186    HA   ARG  32           HA       ARG  32  -4.548  -2.534  -1.632
  187    HB2  ARG  32           HB2      ARG  32  -5.089  -5.162  -3.026
  188    HB3  ARG  32           HB3      ARG  32  -5.381  -4.931  -1.294
  189    HG2  ARG  32           HG2      ARG  32  -6.995  -3.176  -1.759
  190    HG3  ARG  32           HG3      ARG  32  -6.633  -3.255  -3.495
  191    HD2  ARG  32           HD3      ARG  32  -8.643  -4.476  -3.206
  192    HD3  ARG  32           HD2      ARG  32  -7.366  -5.692  -3.400
  193    HE   ARG  32           HE       ARG  32  -7.559  -5.346  -0.663
  194   HH11  ARG  32          HH11      ARG  32 -10.838  -7.198  -2.145
  195   HH12  ARG  32          HH12      ARG  32  -9.854  -6.229  -3.218
  196   HH21  ARG  32          HH21      ARG  32  -8.856  -6.605   0.688
  197   HH22  ARG  32          HH22      ARG  32 -10.275  -7.409   0.054
  198    H    CYS  33           H        CYS  33  -3.557  -3.086   0.221
  199    HA   CYS  33           HA       CYS  33  -0.958  -4.516  -0.041
  200    HB2  CYS  33           HB2      CYS  33  -2.056  -2.693   2.120
  201    HB3  CYS  33           HB3      CYS  33  -0.492  -3.516   2.209
  202    H    VAL  34           H        VAL  34  -0.625  -6.445   0.829
  203    HA   VAL  34           HA       VAL  34  -2.476  -7.412   2.960
  204    HB   VAL  34           HB       VAL  34  -1.507  -9.437   0.963
  205   HG11  VAL  34          HG11      VAL  34  -4.143  -9.972   1.573
  206   HG12  VAL  34          HG12      VAL  34  -2.724 -10.642   2.412
  207   HG13  VAL  34          HG13      VAL  34  -3.545  -9.203   3.062
  208   HG21  VAL  34          HG21      VAL  34  -2.446  -7.671  -0.489
  209   HG22  VAL  34          HG22      VAL  34  -3.966  -7.739   0.434
  210   HG23  VAL  34          HG23      VAL  34  -3.430  -9.154  -0.503
  211    H    GLY  35           H        GLY  35  -1.535  -9.546   3.926
  212    HA2  GLY  35           HA3      GLY  35   0.797 -10.665   4.052
  213    HA3  GLY  35           HA2      GLY  35   1.360  -9.020   4.403
  214    H    ASN  36           H        ASN  36   1.930  -8.943   6.462
  215    HA   ASN  36           HA       ASN  36  -0.099  -9.709   8.490
  216    HB2  ASN  36           HB3      ASN  36   2.780 -10.678   8.467
  217    HB3  ASN  36           HB2      ASN  36   1.742 -10.712   9.906
  218   HD21  ASN  36          HD21      ASN  36  -0.024 -12.148  10.013
  219   HD22  ASN  36          HD22      ASN  36  -0.171 -13.502   8.916
  220    H    CYS  37           H        CYS  37  -0.425  -7.434   8.568
  221    HA   CYS  37           HA       CYS  37   1.460  -6.119  10.431
  222    HB2  CYS  37           HB3      CYS  37   1.261  -3.976   9.084
  223    HB3  CYS  37           HB2      CYS  37   2.308  -5.238   8.414
  Start of MODEL    6
    1    H1   GLU   2           H        GLU   2   9.318  13.373   5.028
    2    HA   GLU   2           HA       GLU   2   7.934  12.348   2.602
    3    HB2  GLU   2           HB3      GLU   2  10.715  11.928   3.726
    4    HB3  GLU   2           HB2      GLU   2  10.053  10.939   2.414
    5    HG2  GLU   2           HG2      GLU   2   9.759  12.939   1.032
    6    HG3  GLU   2           HG3      GLU   2  10.400  13.950   2.341
    7    H    GLY   3           H        GLY   3   6.847  10.500   2.576
    8    HA2  GLY   3           HA3      GLY   3   6.506   8.208   3.205
    9    HA3  GLY   3           HA2      GLY   3   7.326   8.528   4.746
   10    H    GLU   4           H        GLU   4   4.365   8.120   3.195
   11    HA   GLU   4           HA       GLU   4   2.925   8.854   5.667
   12    HB2  GLU   4           HB3      GLU   4   2.467  10.112   2.980
   13    HB3  GLU   4           HB2      GLU   4   1.078   9.800   4.037
   14    HG2  GLU   4           HG3      GLU   4   2.076  11.126   5.810
   15    HG3  GLU   4           HG2      GLU   4   3.538  11.371   4.835
   16    H    CYS   5           H        CYS   5   2.663   6.747   6.082
   17    HA   CYS   5           HA       CYS   5   0.592   5.365   4.464
   18    HB2  CYS   5           HB2      CYS   5   1.819   3.211   4.755
   19    HB3  CYS   5           HB3      CYS   5   2.605   4.353   3.652
   20    H    SER   6           H        SER   6  -0.274   3.443   5.619
   21    HA   SER   6           HA       SER   6  -0.101   3.622   8.577
   22    HB2  SER   6           HB3      SER   6  -1.996   5.101   7.736
   23    HB3  SER   6           HB2      SER   6  -2.760   3.627   7.103
   24    HG   SER   6           HG       SER   6  -3.417   4.319   9.282
   25    HA   PRO   7           HA       PRO   7  -0.200  -0.854   8.307
   26    HB2  PRO   7           HB3      PRO   7  -2.244  -0.818  10.511
   27    HB3  PRO   7           HB2      PRO   7  -0.704  -1.719  10.409
   28    HG2  PRO   7           HG2      PRO   7  -0.949   0.432  11.969
   29    HG3  PRO   7           HG3      PRO   7   0.553   0.114  11.058
   30    HD2  PRO   7           HD2      PRO   7  -1.620   2.112  10.509
   31    HD3  PRO   7           HD3      PRO   7   0.147   2.237  10.252
   32    H    LEU   8           H        LEU   8  -1.159  -1.198   6.398
   33    HA   LEU   8           HA       LEU   8  -2.731  -1.620   4.790
   34    HB2  LEU   8           HB2      LEU   8  -3.717  -2.929   7.165
   35    HB3  LEU   8           HB3      LEU   8  -5.075  -2.341   6.194
   36    HG   LEU   8           HG       LEU   8  -3.822  -3.482   4.213
   37   HD11  LEU   8          HD11      LEU   8  -2.521  -5.466   4.879
   38   HD12  LEU   8          HD12      LEU   8  -1.741  -3.955   5.404
   39   HD13  LEU   8          HD13      LEU   8  -2.624  -4.956   6.581
   40   HD21  LEU   8          HD21      LEU   8  -4.985  -5.596   4.700
   41   HD22  LEU   8          HD22      LEU   8  -5.990  -4.177   5.078
   42   HD23  LEU   8          HD23      LEU   8  -5.196  -5.081   6.390
   43    H    GLY   9           H        GLY   9  -3.025   0.330   3.916
   44    HA2  GLY   9           HA3      GLY   9  -5.548   1.625   4.219
   45    HA3  GLY   9           HA2      GLY   9  -4.338   2.502   5.169
   46    H    GLU  10           H        GLU  10  -2.320   3.252   3.961
   47    HA   GLU  10           HA       GLU  10  -3.148   4.796   1.711
   48    HB2  GLU  10           HB3      GLU  10  -0.550   4.223   3.057
   49    HB3  GLU  10           HB2      GLU  10  -0.502   4.924   1.431
   50    HG2  GLU  10           HG3      GLU  10  -0.420   6.757   2.920
   51    HG3  GLU  10           HG2      GLU  10  -2.071   6.724   2.277
   52    HA   PRO  11           HA       PRO  11  -2.872   2.035  -1.742
   53    HB2  PRO  11           HB2      PRO  11  -2.324   3.865  -3.762
   54    HB3  PRO  11           HB3      PRO  11  -3.942   3.610  -3.047
   55    HG2  PRO  11           HG3      PRO  11  -1.905   5.729  -2.453
   56    HG3  PRO  11           HG2      PRO  11  -3.676   5.873  -2.636
   57    HD2  PRO  11           HD3      PRO  11  -2.460   5.817  -0.215
   58    HD3  PRO  11           HD2      PRO  11  -4.082   5.108  -0.479
   59    H    CYS  12           H        CYS  12  -1.443   1.265  -3.467
   60    HA   CYS  12           HA       CYS  12   1.388   1.445  -2.636
   61    HB2  CYS  12           HB2      CYS  12   0.286  -0.745  -2.940
   62    HB3  CYS  12           HB3      CYS  12   0.024  -0.369  -4.650
   63    H    ALA  13           H        ALA  13  -0.619   2.943  -4.924
   64    HA   ALA  13           HA       ALA  13   1.527   3.231  -6.943
   65    HB1  ALA  13           HB1      ALA  13  -0.546   4.770  -7.852
   66    HB2  ALA  13           HB2      ALA  13  -0.308   3.048  -8.232
   67    HB3  ALA  13           HB3      ALA  13  -1.405   3.526  -6.914
   68    H    GLY  14           H        GLY  14   3.013   4.698  -6.618
   69    HA2  GLY  14           HA3      GLY  14   2.840   7.373  -6.746
   70    HA3  GLY  14           HA2      GLY  14   2.407   7.113  -5.044
   71    H    ASN  15           H        ASN  15   3.944   5.501  -3.909
   72    HA   ASN  15           HA       ASN  15   5.994   5.199  -2.925
   73    HB2  ASN  15           HB3      ASN  15   6.265   4.112  -5.304
   74    HB3  ASN  15           HB2      ASN  15   7.372   5.469  -5.585
   75   HD21  ASN  15          HD21      ASN  15   6.785   2.522  -3.739
   76   HD22  ASN  15          HD22      ASN  15   8.413   2.346  -3.124
   77    HA   PRO  16           HA       PRO  16   7.351   5.429  -1.442
   78    HB2  PRO  16           HB3      PRO  16   7.730   7.401   0.701
   79    HB3  PRO  16           HB2      PRO  16   8.891   6.192   0.085
   80    HG2  PRO  16           HG2      PRO  16   9.198   8.881  -0.243
   81    HG3  PRO  16           HG3      PRO  16   9.834   7.667  -1.388
   82    HD2  PRO  16           HD2      PRO  16   7.316   9.323  -1.580
   83    HD3  PRO  16           HD3      PRO  16   8.545   8.960  -2.833
   84    H    TRP  17           H        TRP  17   4.902   6.981  -2.314
   85    HA   TRP  17           HA       TRP  17   3.341   7.362   0.150
   86    HB2  TRP  17           HB3      TRP  17   2.680   7.634  -2.799
   87    HB3  TRP  17           HB2      TRP  17   1.497   7.885  -1.503
   88    HD1  TRP  17           HD1      TRP  17   4.747   9.442  -2.915
   89    HE1  TRP  17           HE1      TRP  17   4.889  11.911  -2.178
   90    HE3  TRP  17           HE3      TRP  17   0.689   9.556   0.206
   91    HZ2  TRP  17           HZ2      TRP  17   3.453  13.645  -0.499
   92    HZ3  TRP  17           HZ3      TRP  17   0.138  11.668   1.343
   93    HH2  TRP  17           HH2      TRP  17   1.502  13.684   0.994
   94    H    GLY  18           H        GLY  18   4.365   4.666  -0.369
   95    HA2  GLY  18           HA3      GLY  18   1.960   3.115  -1.118
   96    HA3  GLY  18           HA2      GLY  18   3.582   2.473  -0.794
   97    H    CYS  19           H        CYS  19   2.680   0.846   0.508
   98    HA   CYS  19           HA       CYS  19   1.410   1.724   3.040
   99    HB2  CYS  19           HB2      CYS  19   1.151  -0.759   3.397
  100    HB3  CYS  19           HB3      CYS  19   0.263  -0.088   2.019
  101    H    CYS  20           H        CYS  20   2.291   1.455   5.005
  102    HA   CYS  20           HA       CYS  20   5.048   1.683   5.402
  103    HB2  CYS  20           HB3      CYS  20   2.868   0.668   7.244
  104    HB3  CYS  20           HB2      CYS  20   4.525   0.987   7.776
  105    HA   PRO  21           HA       PRO  21   7.171  -2.192   5.028
  106    HB2  PRO  21           HB2      PRO  21   8.432  -2.333   7.575
  107    HB3  PRO  21           HB3      PRO  21   9.090  -1.566   6.102
  108    HG2  PRO  21           HG3      PRO  21   7.630  -0.338   8.407
  109    HG3  PRO  21           HG2      PRO  21   9.015   0.289   7.470
  110    HD2  PRO  21           HD3      PRO  21   6.554   1.236   7.068
  111    HD3  PRO  21           HD2      PRO  21   7.646   0.952   5.676
  112    H    GLY  22           H        GLY  22   7.053  -4.372   5.517
  113    HA2  GLY  22           HA3      GLY  22   6.492  -6.183   7.057
  114    HA3  GLY  22           HA2      GLY  22   5.263  -5.129   7.783
  115    H    CYS  23           H        CYS  23   4.301  -4.137   5.201
  116    HA   CYS  23           HA       CYS  23   2.677  -6.514   4.438
  117    HB2  CYS  23           HB3      CYS  23   2.211  -3.534   4.343
  118    HB3  CYS  23           HB2      CYS  23   1.255  -4.639   3.342
  119    H    ILE  24           H        ILE  24   2.132  -6.875   2.223
  120    HA   ILE  24           HA       ILE  24   4.292  -5.980   0.374
  121    HB   ILE  24           HB       ILE  24   3.525  -8.023  -1.020
  122   HG12  ILE  24          HG12      ILE  24   2.831  -9.896   0.740
  123   HG13  ILE  24          HG13      ILE  24   2.071  -8.520   1.557
  124   HG21  ILE  24          HG21      ILE  24   5.672  -7.820   0.173
  125   HG22  ILE  24          HG22      ILE  24   4.908  -8.480   1.638
  126   HG23  ILE  24          HG23      ILE  24   5.053  -9.488   0.178
  127   HD11  ILE  24          HD11      ILE  24   0.480  -9.679   0.105
  128   HD12  ILE  24          HD12      ILE  24   0.783  -8.027  -0.484
  129   HD13  ILE  24          HD13      ILE  24   1.548  -9.416  -1.294
  130    H    CYS  25           H        CYS  25   3.764  -5.712  -1.890
  131    HA   CYS  25           HA       CYS  25   1.175  -4.291  -2.178
  132    HB2  CYS  25           HB2      CYS  25   3.267  -3.109  -2.728
  133    HB3  CYS  25           HB3      CYS  25   3.641  -4.332  -3.952
  134    H    ILE  26           H        ILE  26  -0.380  -4.813  -3.610
  135    HA   ILE  26           HA       ILE  26  -0.094  -7.431  -4.978
  136    HB   ILE  26           HB       ILE  26  -2.622  -5.809  -4.449
  137   HG12  ILE  26          HG12      ILE  26  -1.693  -6.482  -2.320
  138   HG13  ILE  26          HG13      ILE  26  -3.149  -7.423  -2.663
  139   HG21  ILE  26          HG21      ILE  26  -2.793  -7.354  -6.366
  140   HG22  ILE  26          HG22      ILE  26  -3.859  -7.817  -5.018
  141   HG23  ILE  26          HG23      ILE  26  -2.342  -8.705  -5.299
  142   HD11  ILE  26          HD11      ILE  26  -1.699  -9.350  -3.321
  143   HD12  ILE  26          HD12      ILE  26  -1.478  -8.845  -1.629
  144   HD13  ILE  26          HD13      ILE  26  -0.273  -8.389  -2.858
  145    H    TRP  27           H        TRP  27  -2.001  -4.481  -5.748
  146    HA   TRP  27           HA       TRP  27  -2.360  -3.336  -7.698
  147    HB2  TRP  27           HB3      TRP  27   0.151  -2.916  -7.230
  148    HB3  TRP  27           HB2      TRP  27   0.444  -4.027  -8.574
  149    HD1  TRP  27           HD1      TRP  27  -2.536  -2.155  -9.633
  150    HE1  TRP  27           HE1      TRP  27  -1.939  -0.162 -11.156
  151    HE3  TRP  27           HE3      TRP  27   2.499  -1.934  -8.699
  152    HZ2  TRP  27           HZ2      TRP  27   0.360   1.281 -11.853
  153    HZ3  TRP  27           HZ3      TRP  27   3.830  -0.207  -9.845
  154    HH2  TRP  27           HH2      TRP  27   2.772   1.377 -11.401
  155    H    GLN  28           H        GLN  28  -2.758  -6.320  -7.647
  156    HA   GLN  28           HA       GLN  28  -2.562  -6.936 -10.550
  157    HB2  GLN  28           HB3      GLN  28  -3.191  -8.653  -8.129
  158    HB3  GLN  28           HB2      GLN  28  -3.374  -9.221  -9.797
  159    HG2  GLN  28           HG2      GLN  28  -0.988  -8.832 -10.205
  160    HG3  GLN  28           HG3      GLN  28  -0.791  -8.252  -8.539
  161   HE21  GLN  28          HE21      GLN  28  -0.896  -9.730  -6.799
  162   HE22  GLN  28          HE22      GLN  28  -0.736 -11.454  -7.053
  163    H    LEU  29           H        LEU  29  -4.419  -5.148  -8.851
  164    HA   LEU  29           HA       LEU  29  -6.855  -5.699 -10.403
  165    HB2  LEU  29           HB3      LEU  29  -6.915  -6.885  -8.052
  166    HB3  LEU  29           HB2      LEU  29  -7.170  -5.247  -7.440
  167    HG   LEU  29           HG       LEU  29  -8.955  -6.187  -9.643
  168   HD11  LEU  29          HD11      LEU  29  -8.856  -8.118  -8.113
  169   HD12  LEU  29          HD12      LEU  29  -9.270  -7.051  -6.749
  170   HD13  LEU  29          HD13      LEU  29 -10.444  -7.315  -8.061
  171   HD21  LEU  29          HD21      LEU  29  -9.115  -3.901  -8.727
  172   HD22  LEU  29          HD22      LEU  29 -10.596  -4.841  -8.422
  173   HD23  LEU  29          HD23      LEU  29  -9.423  -4.578  -7.110
  174    H    THR  30           H        THR  30  -5.364  -3.710  -7.810
  175    HA   THR  30           HA       THR  30  -5.984  -1.294  -9.377
  176    HB   THR  30           HB       THR  30  -6.616  -0.380  -6.871
  177    HG1  THR  30           HG1      THR  30  -8.055  -1.857  -5.960
  178   HG21  THR  30          HG21      THR  30  -8.939  -0.304  -7.684
  179   HG22  THR  30          HG22      THR  30  -8.522  -1.457  -8.974
  180   HG23  THR  30          HG23      THR  30  -7.783   0.162  -8.955
  181    H    ASP  31           H        ASP  31  -4.795  -2.216  -6.110
  182    HA   ASP  31           HA       ASP  31  -2.102  -1.757  -6.234
  183    HB2  ASP  31           HB3      ASP  31  -3.479   0.836  -6.502
  184    HB3  ASP  31           HB2      ASP  31  -2.343   0.786  -5.139
  185    H    ARG  32           H        ARG  32  -4.250  -3.033  -4.736
  186    HA   ARG  32           HA       ARG  32  -4.325  -1.906  -2.054
  187    HB2  ARG  32           HB3      ARG  32  -5.203  -4.551  -3.236
  188    HB3  ARG  32           HB2      ARG  32  -5.327  -4.192  -1.506
  189    HG2  ARG  32           HG3      ARG  32  -6.763  -2.252  -2.010
  190    HG3  ARG  32           HG2      ARG  32  -6.652  -2.630  -3.742
  191    HD2  ARG  32           HD2      ARG  32  -7.693  -4.819  -3.337
  192    HD3  ARG  32           HD3      ARG  32  -7.802  -4.453  -1.603
  193    HE   ARG  32           HE       ARG  32  -9.092  -2.382  -3.075
  194   HH11  ARG  32          HH11      ARG  32  -9.559  -5.794  -2.232
  195   HH12  ARG  32          HH12      ARG  32 -11.303  -5.688  -2.335
  196   HH21  ARG  32          HH21      ARG  32 -11.342  -2.289  -3.198
  197   HH22  ARG  32          HH22      ARG  32 -12.305  -3.715  -2.879
  198    H    CYS  33           H        CYS  33  -3.324  -2.559  -0.201
  199    HA   CYS  33           HA       CYS  33  -0.936  -4.317  -0.579
  200    HB2  CYS  33           HB3      CYS  33  -0.522  -1.885  -0.058
  201    HB3  CYS  33           HB2      CYS  33  -1.337  -2.143   1.493
  202    H    VAL  34           H        VAL  34  -0.846  -6.151   0.528
  203    HA   VAL  34           HA       VAL  34  -2.586  -6.437   2.943
  204    HB   VAL  34           HB       VAL  34  -2.052  -8.906   1.347
  205   HG11  VAL  34          HG11      VAL  34  -3.292  -8.927   3.483
  206   HG12  VAL  34          HG12      VAL  34  -4.278  -9.516   2.124
  207   HG13  VAL  34          HG13      VAL  34  -4.531  -7.873   2.760
  208   HG21  VAL  34          HG21      VAL  34  -4.160  -8.470  -0.017
  209   HG22  VAL  34          HG22      VAL  34  -2.691  -7.599  -0.520
  210   HG23  VAL  34          HG23      VAL  34  -3.956  -6.752   0.404
  211    H    GLY  35           H        GLY  35  -1.917  -8.415   4.273
  212    HA2  GLY  35           HA2      GLY  35   0.174  -9.899   4.545
  213    HA3  GLY  35           HA3      GLY  35   1.062  -8.363   4.483
  214    H    ASN  36           H        ASN  36   1.916  -8.368   6.504
  215    HA   ASN  36           HA       ASN  36  -0.023  -7.964   8.718
  216    HB2  ASN  36           HB2      ASN  36   2.306  -9.910   8.749
  217    HB3  ASN  36           HB3      ASN  36   1.512  -9.319  10.222
  218   HD21  ASN  36          HD21      ASN  36  -0.630  -9.958  10.696
  219   HD22  ASN  36          HD22      ASN  36  -1.372 -11.330   9.904
  220    H    CYS  37           H        CYS  37   0.445  -5.765   8.458
  221    HA   CYS  37           HA       CYS  37   3.079  -4.980   9.620
  222    HB2  CYS  37           HB3      CYS  37   3.060  -2.966   8.203
  223    HB3  CYS  37           HB2      CYS  37   3.137  -4.459   7.253
  Start of MODEL    7
    1    H1   GLU   2           H        GLU   2  10.217  11.242   7.631
    2    HA   GLU   2           HA       GLU   2   8.155  11.840   5.556
    3    HB2  GLU   2           HB3      GLU   2  10.809  10.417   5.218
    4    HB3  GLU   2           HB2      GLU   2   9.466  10.225   4.078
    5    HG2  GLU   2           HG2      GLU   2   9.486  12.635   3.629
    6    HG3  GLU   2           HG3      GLU   2  10.825  12.844   4.774
    7    H    GLY   3           H        GLY   3   6.539  10.437   5.423
    8    HA2  GLY   3           HA2      GLY   3   6.256   7.827   5.425
    9    HA3  GLY   3           HA3      GLY   3   6.697   8.010   7.134
   10    H    GLU   4           H        GLU   4   4.283   8.624   4.661
   11    HA   GLU   4           HA       GLU   4   2.341   9.407   6.790
   12    HB2  GLU   4           HB3      GLU   4   0.978  10.374   4.918
   13    HB3  GLU   4           HB2      GLU   4   2.533  11.169   5.200
   14    HG2  GLU   4           HG3      GLU   4   3.495   9.943   3.270
   15    HG3  GLU   4           HG2      GLU   4   1.904   9.216   2.968
   16    H    CYS   5           H        CYS   5   3.189   6.669   6.144
   17    HA   CYS   5           HA       CYS   5   0.796   5.485   4.865
   18    HB2  CYS   5           HB2      CYS   5   2.022   3.359   5.079
   19    HB3  CYS   5           HB3      CYS   5   2.931   4.585   4.182
   20    H    SER   6           H        SER   6  -0.292   3.676   5.851
   21    HA   SER   6           HA       SER   6  -0.259   3.695   8.828
   22    HB2  SER   6           HB2      SER   6  -2.698   3.989   7.039
   23    HB3  SER   6           HB3      SER   6  -2.771   3.617   8.775
   24    HG   SER   6           HG       SER   6  -2.975   5.874   8.340
   25    HA   PRO   7           HA       PRO   7  -0.484  -0.756   8.503
   26    HB2  PRO   7           HB3      PRO   7  -2.747  -0.780  10.467
   27    HB3  PRO   7           HB2      PRO   7  -1.169  -1.616  10.547
   28    HG2  PRO   7           HG2      PRO   7  -1.699   0.515  12.072
   29    HG3  PRO   7           HG3      PRO   7  -0.081   0.255  11.364
   30    HD2  PRO   7           HD2      PRO   7  -2.251   2.157  10.511
   31    HD3  PRO   7           HD3      PRO   7  -0.475   2.380  10.540
   32    H    LEU   8           H        LEU   8  -1.246  -1.100   6.509
   33    HA   LEU   8           HA       LEU   8  -2.644  -1.465   4.741
   34    HB2  LEU   8           HB3      LEU   8  -3.767  -2.905   6.917
   35    HB3  LEU   8           HB2      LEU   8  -5.107  -2.171   6.024
   36    HG   LEU   8           HG       LEU   8  -3.993  -3.133   3.917
   37   HD11  LEU   8          HD11      LEU   8  -1.834  -3.700   4.964
   38   HD12  LEU   8          HD12      LEU   8  -2.658  -4.876   6.016
   39   HD13  LEU   8          HD13      LEU   8  -2.619  -5.131   4.255
   40   HD21  LEU   8          HD21      LEU   8  -5.112  -5.299   4.255
   41   HD22  LEU   8          HD22      LEU   8  -5.210  -4.966   6.000
   42   HD23  LEU   8          HD23      LEU   8  -6.095  -3.939   4.847
   43    H    GLY   9           H        GLY   9  -2.681   0.599   4.050
   44    HA2  GLY   9           HA2      GLY   9  -5.262   1.905   4.063
   45    HA3  GLY   9           HA3      GLY   9  -4.080   2.770   5.061
   46    H    GLU  10           H        GLU  10  -1.972   3.398   3.960
   47    HA   GLU  10           HA       GLU  10  -2.599   4.782   1.520
   48    HB2  GLU  10           HB2      GLU  10  -0.140   4.380   3.167
   49    HB3  GLU  10           HB3      GLU  10   0.057   4.971   1.508
   50    HG2  GLU  10           HG3      GLU  10  -1.801   6.272   3.520
   51    HG3  GLU  10           HG2      GLU  10  -0.098   6.727   3.338
   52    HA   PRO  11           HA       PRO  11  -2.160   1.393  -1.443
   53    HB2  PRO  11           HB2      PRO  11  -1.795   3.741  -3.308
   54    HB3  PRO  11           HB3      PRO  11  -2.865   2.316  -3.464
   55    HG2  PRO  11           HG3      PRO  11  -3.850   4.674  -2.771
   56    HG3  PRO  11           HG2      PRO  11  -4.442   3.175  -2.002
   57    HD2  PRO  11           HD2      PRO  11  -2.587   5.279  -0.921
   58    HD3  PRO  11           HD3      PRO  11  -3.853   4.329  -0.086
   59    H    CYS  12           H        CYS  12  -0.606   0.760  -3.225
   60    HA   CYS  12           HA       CYS  12   2.144   1.330  -2.329
   61    HB2  CYS  12           HB3      CYS  12   1.278  -0.989  -2.762
   62    HB3  CYS  12           HB2      CYS  12   1.195  -0.573  -4.482
   63    H    ALA  13           H        ALA  13   0.017   2.307  -4.881
   64    HA   ALA  13           HA       ALA  13   2.262   3.134  -6.628
   65    HB1  ALA  13           HB1      ALA  13   0.297   3.909  -8.108
   66    HB2  ALA  13           HB2      ALA  13   0.536   2.160  -7.884
   67    HB3  ALA  13           HB3      ALA  13  -0.734   3.008  -6.971
   68    H    GLY  14           H        GLY  14   3.130   5.072  -6.566
   69    HA2  GLY  14           HA2      GLY  14   2.111   7.535  -6.682
   70    HA3  GLY  14           HA3      GLY  14   1.805   7.179  -4.971
   71    H    ASN  15           H        ASN  15   3.870   6.079  -3.927
   72    HA   ASN  15           HA       ASN  15   5.847   6.613  -2.899
   73    HB2  ASN  15           HB2      ASN  15   7.854   6.460  -4.299
   74    HB3  ASN  15           HB3      ASN  15   6.678   5.188  -4.664
   75   HD21  ASN  15          HD21      ASN  15   5.604   5.172  -6.676
   76   HD22  ASN  15          HD22      ASN  15   6.167   6.133  -8.025
   77    HA   PRO  16           HA       PRO  16   6.722   7.345  -1.397
   78    HB2  PRO  16           HB2      PRO  16   6.785   9.504   0.527
   79    HB3  PRO  16           HB3      PRO  16   8.166   8.564  -0.103
   80    HG2  PRO  16           HG2      PRO  16   7.714  11.262  -0.573
   81    HG3  PRO  16           HG3      PRO  16   8.756  10.197  -1.556
   82    HD2  PRO  16           HD2      PRO  16   5.924  11.089  -2.067
   83    HD3  PRO  16           HD3      PRO  16   7.290  10.886  -3.210
   84    H    TRP  17           H        TRP  17   4.370   6.929  -2.037
   85    HA   TRP  17           HA       TRP  17   2.580   7.840   0.178
   86    HB2  TRP  17           HB2      TRP  17   1.921   7.577  -2.773
   87    HB3  TRP  17           HB3      TRP  17   0.689   7.713  -1.507
   88    HD1  TRP  17           HD1      TRP  17   3.656   9.783  -2.965
   89    HE1  TRP  17           HE1      TRP  17   3.144  12.292  -2.667
   90    HE3  TRP  17           HE3      TRP  17  -0.723   9.379  -0.340
   91    HZ2  TRP  17           HZ2      TRP  17   1.138  13.860  -1.485
   92    HZ3  TRP  17           HZ3      TRP  17  -1.885  11.442   0.334
   93    HH2  TRP  17           HH2      TRP  17  -0.964  13.652  -0.232
   94    H    GLY  18           H        GLY  18   4.286   5.407  -0.256
   95    HA2  GLY  18           HA3      GLY  18   2.423   3.229  -0.833
   96    HA3  GLY  18           HA2      GLY  18   4.112   3.084  -0.319
   97    H    CYS  19           H        CYS  19   2.658   1.268   0.716
   98    HA   CYS  19           HA       CYS  19   1.478   2.130   3.274
   99    HB2  CYS  19           HB3      CYS  19   1.086  -0.360   3.533
  100    HB3  CYS  19           HB2      CYS  19   0.262   0.426   2.176
  101    H    CYS  20           H        CYS  20   2.213   1.556   5.279
  102    HA   CYS  20           HA       CYS  20   4.972   1.692   5.794
  103    HB2  CYS  20           HB3      CYS  20   2.699   0.596   7.467
  104    HB3  CYS  20           HB2      CYS  20   4.344   0.815   8.077
  105    HA   PRO  21           HA       PRO  21   6.908  -2.238   5.121
  106    HB2  PRO  21           HB3      PRO  21   8.236  -2.588   7.598
  107    HB3  PRO  21           HB2      PRO  21   8.877  -1.715   6.177
  108    HG2  PRO  21           HG3      PRO  21   7.498  -0.661   8.619
  109    HG3  PRO  21           HG2      PRO  21   8.881   0.014   7.712
  110    HD2  PRO  21           HD2      PRO  21   6.433   1.059   7.440
  111    HD3  PRO  21           HD3      PRO  21   7.505   0.864   6.017
  112    H    GLY  22           H        GLY  22   6.413  -4.347   5.282
  113    HA2  GLY  22           HA3      GLY  22   5.922  -6.256   6.824
  114    HA3  GLY  22           HA2      GLY  22   4.746  -5.192   7.616
  115    H    CYS  23           H        CYS  23   4.422  -4.329   4.512
  116    HA   CYS  23           HA       CYS  23   2.493  -6.517   3.856
  117    HB2  CYS  23           HB3      CYS  23   2.096  -3.517   3.714
  118    HB3  CYS  23           HB2      CYS  23   1.085  -4.664   2.820
  119    H    ILE  24           H        ILE  24   2.240  -7.048   1.713
  120    HA   ILE  24           HA       ILE  24   4.344  -5.951  -0.085
  121    HB   ILE  24           HB       ILE  24   3.862  -8.016  -1.503
  122   HG12  ILE  24          HG12      ILE  24   3.061  -9.929   0.233
  123   HG13  ILE  24          HG13      ILE  24   2.066  -8.579   0.804
  124   HG21  ILE  24          HG21      ILE  24   5.844  -7.748  -0.059
  125   HG22  ILE  24          HG22      ILE  24   5.307  -9.442  -0.162
  126   HG23  ILE  24          HG23      ILE  24   4.945  -8.480   1.292
  127   HD11  ILE  24          HD11      ILE  24   2.158  -9.677  -2.023
  128   HD12  ILE  24          HD12      ILE  24   0.849  -9.902  -0.838
  129   HD13  ILE  24          HD13      ILE  24   1.189  -8.282  -1.491
  130    H    CYS  25           H        CYS  25   3.859  -5.704  -2.366
  131    HA   CYS  25           HA       CYS  25   1.161  -4.503  -2.706
  132    HB2  CYS  25           HB2      CYS  25   3.580  -4.259  -4.512
  133    HB3  CYS  25           HB3      CYS  25   2.112  -3.269  -4.541
  134    H    ILE  26           H        ILE  26  -0.341  -5.332  -3.983
  135    HA   ILE  26           HA       ILE  26   0.376  -7.702  -5.612
  136    HB   ILE  26           HB       ILE  26  -2.206  -7.907  -5.791
  137   HG12  ILE  26          HG12      ILE  26  -2.778  -6.883  -3.206
  138   HG13  ILE  26          HG13      ILE  26  -2.039  -5.560  -4.124
  139   HG21  ILE  26          HG21      ILE  26  -0.717  -9.400  -4.530
  140   HG22  ILE  26          HG22      ILE  26  -0.853  -8.324  -3.119
  141   HG23  ILE  26          HG23      ILE  26  -2.291  -9.176  -3.730
  142   HD11  ILE  26          HD11      ILE  26  -4.474  -5.545  -4.351
  143   HD12  ILE  26          HD12      ILE  26  -3.696  -5.884  -5.915
  144   HD13  ILE  26          HD13      ILE  26  -4.435  -7.208  -4.984
  145    H    TRP  27           H        TRP  27  -1.996  -5.039  -5.933
  146    HA   TRP  27           HA       TRP  27  -2.671  -3.753  -7.697
  147    HB2  TRP  27           HB3      TRP  27  -0.174  -3.157  -7.580
  148    HB3  TRP  27           HB2      TRP  27   0.029  -4.211  -8.985
  149    HD1  TRP  27           HD1      TRP  27  -3.196  -2.348  -9.371
  150    HE1  TRP  27           HE1      TRP  27  -2.923  -0.354 -10.983
  151    HE3  TRP  27           HE3      TRP  27   1.923  -2.231  -9.617
  152    HZ2  TRP  27           HZ2      TRP  27  -0.815   1.054 -12.180
  153    HZ3  TRP  27           HZ3      TRP  27   2.991  -0.519 -11.028
  154    HH2  TRP  27           HH2      TRP  27   1.638   1.101 -12.290
  155    H    GLN  28           H        GLN  28  -2.877  -6.753  -7.793
  156    HA   GLN  28           HA       GLN  28  -3.085  -7.200 -10.723
  157    HB2  GLN  28           HB3      GLN  28  -3.282  -9.050  -8.329
  158    HB3  GLN  28           HB2      GLN  28  -3.714  -9.555  -9.972
  159    HG2  GLN  28           HG2      GLN  28  -1.440  -9.049 -10.738
  160    HG3  GLN  28           HG3      GLN  28  -0.995  -8.537  -9.098
  161   HE21  GLN  28          HE21      GLN  28  -1.763 -11.251 -11.204
  162   HE22  GLN  28          HE22      GLN  28  -1.206 -12.509 -10.124
  163    H    LEU  29           H        LEU  29  -4.769  -5.559  -8.729
  164    HA   LEU  29           HA       LEU  29  -7.372  -6.214  -9.943
  165    HB2  LEU  29           HB2      LEU  29  -6.909  -6.155  -6.946
  166    HB3  LEU  29           HB3      LEU  29  -8.507  -6.001  -7.688
  167    HG   LEU  29           HG       LEU  29  -6.805  -8.385  -8.356
  168   HD11  LEU  29          HD11      LEU  29  -6.703  -8.191  -5.900
  169   HD12  LEU  29          HD12      LEU  29  -8.480  -8.110  -5.838
  170   HD13  LEU  29          HD13      LEU  29  -7.676  -9.591  -6.412
  171   HD21  LEU  29          HD21      LEU  29  -8.943  -7.999  -9.531
  172   HD22  LEU  29          HD22      LEU  29  -8.990  -9.479  -8.543
  173   HD23  LEU  29          HD23      LEU  29  -9.795  -7.999  -7.968
  174    H    THR  30           H        THR  30  -5.644  -4.137  -7.571
  175    HA   THR  30           HA       THR  30  -6.663  -1.767  -9.002
  176    HB   THR  30           HB       THR  30  -6.967  -0.906  -6.416
  177    HG1  THR  30           HG1      THR  30  -8.139  -2.487  -5.315
  178   HG21  THR  30          HG21      THR  30  -9.386  -0.999  -6.863
  179   HG22  THR  30          HG22      THR  30  -8.474  -0.447  -8.288
  180   HG23  THR  30          HG23      THR  30  -9.090  -2.115  -8.217
  181    H    ASP  31           H        ASP  31  -4.806  -2.793  -6.110
  182    HA   ASP  31           HA       ASP  31  -2.283  -2.258  -6.323
  183    HB2  ASP  31           HB2      ASP  31  -2.956  -0.095  -7.667
  184    HB3  ASP  31           HB3      ASP  31  -3.149   0.626  -6.058
  185    H    ARG  32           H        ARG  32  -4.095  -3.249  -4.490
  186    HA   ARG  32           HA       ARG  32  -3.961  -1.539  -2.080
  187    HB2  ARG  32           HB2      ARG  32  -5.302  -4.179  -2.697
  188    HB3  ARG  32           HB3      ARG  32  -5.224  -3.517  -1.055
  189    HG2  ARG  32           HG3      ARG  32  -6.418  -1.492  -1.838
  190    HG3  ARG  32           HG2      ARG  32  -6.514  -2.197  -3.465
  191    HD2  ARG  32           HD2      ARG  32  -7.626  -3.583  -1.015
  192    HD3  ARG  32           HD3      ARG  32  -8.581  -2.445  -1.985
  193    HE   ARG  32           HE       ARG  32  -7.544  -4.307  -3.795
  194   HH11  ARG  32          HH11      ARG  32 -10.544  -5.812  -1.536
  195   HH12  ARG  32          HH12      ARG  32  -9.667  -4.413  -0.957
  196   HH21  ARG  32          HH21      ARG  32  -8.701  -6.109  -4.505
  197   HH22  ARG  32          HH22      ARG  32 -10.000  -6.765  -3.534
  198    H    CYS  33           H        CYS  33  -3.089  -2.240  -0.085
  199    HA   CYS  33           HA       CYS  33  -0.721  -4.003  -0.441
  200    HB2  CYS  33           HB3      CYS  33  -1.438  -1.839   1.540
  201    HB3  CYS  33           HB2      CYS  33  -0.135  -2.995   1.858
  202    H    VAL  34           H        VAL  34  -0.741  -5.992   0.288
  203    HA   VAL  34           HA       VAL  34  -2.591  -6.671   2.527
  204    HB   VAL  34           HB       VAL  34  -2.366  -9.073   1.436
  205   HG11  VAL  34          HG11      VAL  34  -4.446  -7.816   1.833
  206   HG12  VAL  34          HG12      VAL  34  -4.208  -6.957   0.293
  207   HG13  VAL  34          HG13      VAL  34  -4.482  -8.715   0.298
  208   HG21  VAL  34          HG21      VAL  34  -0.832  -8.386  -0.378
  209   HG22  VAL  34          HG22      VAL  34  -2.086  -7.292  -1.009
  210   HG23  VAL  34          HG23      VAL  34  -2.360  -9.050  -1.004
  211    H    GLY  35           H        GLY  35  -1.888  -8.045   4.122
  212    HA2  GLY  35           HA2      GLY  35   0.077  -9.764   4.466
  213    HA3  GLY  35           HA3      GLY  35   1.067  -8.304   4.276
  214    H    ASN  36           H        ASN  36   1.906  -8.037   6.257
  215    HA   ASN  36           HA       ASN  36  -0.009  -7.449   8.451
  216    HB2  ASN  36           HB2      ASN  36   2.349  -9.352   8.633
  217    HB3  ASN  36           HB3      ASN  36   1.563  -8.637  10.053
  218   HD21  ASN  36          HD21      ASN  36  -0.567  -9.258  10.611
  219   HD22  ASN  36          HD22      ASN  36  -1.295 -10.710   9.960
  220    H    CYS  37           H        CYS  37   0.421  -5.279   7.989
  221    HA   CYS  37           HA       CYS  37   3.072  -4.353   9.002
  222    HB2  CYS  37           HB3      CYS  37   2.900  -2.432   7.437
  223    HB3  CYS  37           HB2      CYS  37   3.070  -3.996   6.624
  Start of MODEL    8
    1    H1   GLU   2           H        GLU   2   9.303  12.869   3.683
    2    HA   GLU   2           HA       GLU   2   7.082  12.377   3.374
    3    HB2  GLU   2           HB2      GLU   2   8.173  10.840   1.006
    4    HB3  GLU   2           HB3      GLU   2   6.441  10.968   1.354
    5    HG2  GLU   2           HG2      GLU   2   6.593  13.418   1.181
    6    HG3  GLU   2           HG3      GLU   2   8.328  13.286   0.831
    7    H    GLY   3           H        GLY   3   5.804  11.204   4.598
    8    HA2  GLY   3           HA3      GLY   3   6.020   8.279   4.632
    9    HA3  GLY   3           HA2      GLY   3   6.478   9.080   6.148
   10    H    GLU   4           H        GLU   4   3.875   8.347   3.914
   11    HA   GLU   4           HA       GLU   4   1.926   8.940   6.086
   12    HB2  GLU   4           HB3      GLU   4   2.119  10.702   4.111
   13    HB3  GLU   4           HB2      GLU   4   1.165   9.495   3.233
   14    HG2  GLU   4           HG2      GLU   4  -0.574   9.594   4.959
   15    HG3  GLU   4           HG3      GLU   4   0.373  10.800   5.852
   16    H    CYS   5           H        CYS   5   2.059   6.693   6.495
   17    HA   CYS   5           HA       CYS   5   0.390   5.089   4.619
   18    HB2  CYS   5           HB3      CYS   5   1.785   3.130   4.971
   19    HB3  CYS   5           HB2      CYS   5   2.732   4.451   4.269
   20    H    SER   6           H        SER   6  -0.251   2.964   5.713
   21    HA   SER   6           HA       SER   6  -0.596   3.076   8.625
   22    HB2  SER   6           HB2      SER   6  -2.417   4.562   7.626
   23    HB3  SER   6           HB3      SER   6  -3.070   3.100   6.858
   24    HG   SER   6           HG       SER   6  -3.964   3.711   8.987
   25    HA   PRO   7           HA       PRO   7  -0.549  -1.366   8.096
   26    HB2  PRO   7           HB2      PRO   7  -2.848  -1.512  10.037
   27    HB3  PRO   7           HB3      PRO   7  -1.273  -2.358  10.069
   28    HG2  PRO   7           HG2      PRO   7  -1.761  -0.312  11.702
   29    HG3  PRO   7           HG3      PRO   7  -0.158  -0.537  10.946
   30    HD2  PRO   7           HD3      PRO   7  -2.341   1.405  10.251
   31    HD3  PRO   7           HD2      PRO   7  -0.566   1.634  10.235
   32    H    LEU   8           H        LEU   8  -1.264  -1.895   6.132
   33    HA   LEU   8           HA       LEU   8  -2.610  -2.341   4.335
   34    HB2  LEU   8           HB2      LEU   8  -4.601  -3.207   6.452
   35    HB3  LEU   8           HB3      LEU   8  -4.629  -3.671   4.751
   36    HG   LEU   8           HG       LEU   8  -3.816  -5.567   5.802
   37   HD11  LEU   8          HD11      LEU   8  -1.638  -5.943   5.043
   38   HD12  LEU   8          HD12      LEU   8  -1.141  -4.260   5.336
   39   HD13  LEU   8          HD13      LEU   8  -2.241  -4.641   3.990
   40   HD21  LEU   8          HD21      LEU   8  -3.578  -4.555   8.036
   41   HD22  LEU   8          HD22      LEU   8  -2.007  -3.875   7.546
   42   HD23  LEU   8          HD23      LEU   8  -2.225  -5.639   7.633
   43    H    GLY   9           H        GLY   9  -2.523   0.207   4.551
   44    HA2  GLY   9           HA3      GLY   9  -5.350   1.134   4.285
   45    HA3  GLY   9           HA2      GLY   9  -4.134   2.089   5.150
   46    H    GLU  10           H        GLU  10  -2.109   2.670   3.814
   47    HA   GLU  10           HA       GLU  10  -3.128   3.843   1.312
   48    HB2  GLU  10           HB2      GLU  10  -0.522   4.147   2.816
   49    HB3  GLU  10           HB3      GLU  10  -0.833   4.925   1.257
   50    HG2  GLU  10           HG3      GLU  10  -2.666   5.324   3.627
   51    HG3  GLU  10           HG2      GLU  10  -1.195   6.291   3.408
   52    HA   PRO  11           HA       PRO  11  -1.246   0.892  -1.432
   53    HB2  PRO  11           HB2      PRO  11  -0.807   2.918  -3.520
   54    HB3  PRO  11           HB3      PRO  11  -2.040   1.628  -3.450
   55    HG2  PRO  11           HG3      PRO  11  -2.625   4.275  -3.241
   56    HG3  PRO  11           HG2      PRO  11  -3.597   2.988  -2.475
   57    HD2  PRO  11           HD3      PRO  11  -1.497   4.780  -1.262
   58    HD3  PRO  11           HD2      PRO  11  -3.091   4.298  -0.602
   59    H    CYS  12           H        CYS  12   0.687   0.416  -2.792
   60    HA   CYS  12           HA       CYS  12   3.072   1.878  -1.747
   61    HB2  CYS  12           HB3      CYS  12   4.327  -0.155  -2.022
   62    HB3  CYS  12           HB2      CYS  12   2.860  -0.500  -1.093
   63    H    ALA  13           H        ALA  13   1.260   1.240  -4.594
   64    HA   ALA  13           HA       ALA  13   3.603   1.791  -6.340
   65    HB1  ALA  13           HB1      ALA  13   2.154   1.107  -8.198
   66    HB2  ALA  13           HB2      ALA  13   0.793   0.905  -7.069
   67    HB3  ALA  13           HB3      ALA  13   2.221  -0.148  -6.937
   68    H    GLY  14           H        GLY  14   4.041   3.832  -6.685
   69    HA2  GLY  14           HA2      GLY  14   3.676   5.912  -7.698
   70    HA3  GLY  14           HA3      GLY  14   1.936   5.585  -7.745
   71    H    ASN  15           H        ASN  15   4.629   6.441  -5.582
   72    HA   ASN  15           HA       ASN  15   2.860   8.344  -4.188
   73    HB2  ASN  15           HB2      ASN  15   4.246   6.059  -2.774
   74    HB3  ASN  15           HB3      ASN  15   3.745   7.540  -1.936
   75   HD21  ASN  15          HD21      ASN  15   2.684   4.612  -3.581
   76   HD22  ASN  15          HD22      ASN  15   1.015   4.681  -3.060
   77    HA   PRO  16           HA       PRO  16   5.694   6.219  -5.182
   78    HB2  PRO  16           HB2      PRO  16   8.548   5.983  -4.751
   79    HB3  PRO  16           HB3      PRO  16   7.690   6.277  -6.290
   80    HG2  PRO  16           HG2      PRO  16   9.351   8.095  -5.017
   81    HG3  PRO  16           HG3      PRO  16   8.104   8.504  -6.226
   82    HD2  PRO  16           HD3      PRO  16   7.977   8.669  -3.224
   83    HD3  PRO  16           HD2      PRO  16   7.334   9.803  -4.453
   84    H    TRP  17           H        TRP  17   5.170   4.466  -4.066
   85    HA   TRP  17           HA       TRP  17   4.956   2.906  -2.403
   86    HB2  TRP  17           HB3      TRP  17   7.820   3.553  -2.402
   87    HB3  TRP  17           HB2      TRP  17   7.237   2.934  -0.847
   88    HD1  TRP  17           HD1      TRP  17   7.687   1.868  -4.518
   89    HE1  TRP  17           HE1      TRP  17   7.526  -0.701  -4.688
   90    HE3  TRP  17           HE3      TRP  17   6.238   0.862   0.290
   91    HZ2  TRP  17           HZ2      TRP  17   6.869  -2.841  -2.991
   92    HZ3  TRP  17           HZ3      TRP  17   5.862  -1.484   0.939
   93    HH2  TRP  17           HH2      TRP  17   6.175  -3.308  -0.682
   94    H    GLY  18           H        GLY  18   3.345   3.579  -1.143
   95    HA2  GLY  18           HA2      GLY  18   4.111   5.289   1.186
   96    HA3  GLY  18           HA3      GLY  18   2.569   5.476   0.335
   97    H    CYS  19           H        CYS  19   4.131   2.390   1.188
   98    HA   CYS  19           HA       CYS  19   1.878   1.893   3.097
   99    HB2  CYS  19           HB2      CYS  19   2.164   0.533   0.853
  100    HB3  CYS  19           HB3      CYS  19   3.421  -0.319   1.764
  101    H    CYS  20           H        CYS  20   2.392   1.340   5.142
  102    HA   CYS  20           HA       CYS  20   4.978   1.830   6.174
  103    HB2  CYS  20           HB3      CYS  20   2.700   0.222   7.359
  104    HB3  CYS  20           HB2      CYS  20   4.123   0.784   8.250
  105    HA   PRO  21           HA       PRO  21   7.564  -1.692   5.493
  106    HB2  PRO  21           HB2      PRO  21   8.648  -2.031   8.082
  107    HB3  PRO  21           HB3      PRO  21   9.273  -0.937   6.815
  108    HG2  PRO  21           HG3      PRO  21   7.468  -0.345   9.131
  109    HG3  PRO  21           HG2      PRO  21   8.816   0.617   8.461
  110    HD2  PRO  21           HD2      PRO  21   6.273   1.279   7.946
  111    HD3  PRO  21           HD3      PRO  21   7.525   1.395   6.669
  112    H    GLY  22           H        GLY  22   7.205  -3.796   5.329
  113    HA2  GLY  22           HA2      GLY  22   6.792  -5.979   6.205
  114    HA3  GLY  22           HA3      GLY  22   5.930  -5.258   7.579
  115    H    CYS  23           H        CYS  23   5.317  -4.100   4.346
  116    HA   CYS  23           HA       CYS  23   2.754  -5.634   4.271
  117    HB2  CYS  23           HB2      CYS  23   3.223  -2.737   4.328
  118    HB3  CYS  23           HB3      CYS  23   2.221  -3.249   2.960
  119    H    ILE  24           H        ILE  24   2.404  -6.713   2.469
  120    HA   ILE  24           HA       ILE  24   4.104  -6.095   0.106
  121    HB   ILE  24           HB       ILE  24   3.245  -8.378  -0.732
  122   HG12  ILE  24          HG13      ILE  24   2.937  -9.312   2.052
  123   HG13  ILE  24          HG12      ILE  24   1.611  -8.285   1.481
  124   HG21  ILE  24          HG21      ILE  24   5.536  -7.920   0.062
  125   HG22  ILE  24          HG22      ILE  24   5.025  -8.297   1.725
  126   HG23  ILE  24          HG23      ILE  24   5.000  -9.566   0.477
  127   HD11  ILE  24          HD11      ILE  24   1.126 -10.651   1.095
  128   HD12  ILE  24          HD12      ILE  24   2.607 -10.804   0.119
  129   HD13  ILE  24          HD13      ILE  24   1.272  -9.769  -0.444
  130    H    CYS  25           H        CYS  25   3.099  -6.393  -2.062
  131    HA   CYS  25           HA       CYS  25   0.252  -5.479  -2.031
  132    HB2  CYS  25           HB2      CYS  25   2.447  -4.497  -3.873
  133    HB3  CYS  25           HB3      CYS  25   0.754  -3.981  -3.892
  134    H    ILE  26           H        ILE  26  -1.046  -6.040  -3.737
  135    HA   ILE  26           HA       ILE  26  -0.120  -8.398  -5.287
  136    HB   ILE  26           HB       ILE  26  -2.700  -8.459  -5.846
  137   HG12  ILE  26          HG13      ILE  26  -3.238  -7.466  -3.128
  138   HG13  ILE  26          HG12      ILE  26  -2.732  -6.192  -4.251
  139   HG21  ILE  26          HG21      ILE  26  -3.067  -9.859  -3.861
  140   HG22  ILE  26          HG22      ILE  26  -1.584  -9.197  -3.133
  141   HG23  ILE  26          HG23      ILE  26  -1.488 -10.168  -4.622
  142   HD11  ILE  26          HD11      ILE  26  -5.167  -6.414  -4.204
  143   HD12  ILE  26          HD12      ILE  26  -5.029  -8.121  -4.687
  144   HD13  ILE  26          HD13      ILE  26  -4.517  -6.835  -5.806
  145    H    TRP  27           H        TRP  27  -2.243  -5.583  -5.743
  146    HA   TRP  27           HA       TRP  27  -2.704  -4.219  -7.508
  147    HB2  TRP  27           HB3      TRP  27  -0.288  -3.641  -7.081
  148    HB3  TRP  27           HB2      TRP  27   0.144  -4.732  -8.403
  149    HD1  TRP  27           HD1      TRP  27  -2.902  -2.390  -8.882
  150    HE1  TRP  27           HE1      TRP  27  -2.330  -0.616 -10.663
  151    HE3  TRP  27           HE3      TRP  27   2.091  -3.417  -9.440
  152    HZ2  TRP  27           HZ2      TRP  27  -0.062   0.216 -12.089
  153    HZ3  TRP  27           HZ3      TRP  27   3.392  -2.075 -11.043
  154    HH2  TRP  27           HH2      TRP  27   2.329  -0.281 -12.344
  155    H    GLN  28           H        GLN  28  -4.241  -5.553  -8.367
  156    HA   GLN  28           HA       GLN  28  -3.493  -6.659 -11.031
  157    HB2  GLN  28           HB2      GLN  28  -5.297  -7.910  -8.941
  158    HB3  GLN  28           HB3      GLN  28  -5.361  -8.363 -10.651
  159    HG2  GLN  28           HG3      GLN  28  -2.786  -8.490  -9.073
  160    HG3  GLN  28           HG2      GLN  28  -3.967  -9.812  -9.039
  161   HE21  GLN  28          HE21      GLN  28  -3.235 -11.051 -12.257
  162   HE22  GLN  28          HE22      GLN  28  -4.344 -11.064 -10.905
  163    H    LEU  29           H        LEU  29  -4.819  -4.250  -9.536
  164    HA   LEU  29           HA       LEU  29  -6.481  -3.346 -11.658
  165    HB2  LEU  29           HB3      LEU  29  -7.936  -5.180 -10.424
  166    HB3  LEU  29           HB2      LEU  29  -8.171  -3.898  -9.231
  167    HG   LEU  29           HG       LEU  29  -8.711  -3.224 -12.089
  168   HD11  LEU  29          HD11      LEU  29  -9.746  -5.446 -11.817
  169   HD12  LEU  29          HD12      LEU  29 -10.969  -4.162 -11.967
  170   HD13  LEU  29          HD13      LEU  29 -10.606  -4.863 -10.372
  171   HD21  LEU  29          HD21      LEU  29  -8.920  -1.545 -10.291
  172   HD22  LEU  29          HD22      LEU  29 -10.121  -2.575  -9.476
  173   HD23  LEU  29          HD23      LEU  29 -10.485  -1.874 -11.071
  174    H    THR  30           H        THR  30  -5.436  -3.149  -8.274
  175    HA   THR  30           HA       THR  30  -5.674  -0.190  -8.484
  176    HB   THR  30           HB       THR  30  -6.215  -0.702  -5.793
  177    HG1  THR  30           HG1      THR  30  -7.990  -2.126  -5.862
  178   HG21  THR  30          HG21      THR  30  -8.426   0.233  -6.320
  179   HG22  THR  30          HG22      THR  30  -8.125  -0.038  -8.053
  180   HG23  THR  30          HG23      THR  30  -7.123   1.121  -7.146
  181    H    ASP  31           H        ASP  31  -4.359  -2.892  -6.559
  182    HA   ASP  31           HA       ASP  31  -2.160  -3.166  -5.788
  183    HB2  ASP  31           HB3      ASP  31  -1.374  -1.227  -7.279
  184    HB3  ASP  31           HB2      ASP  31  -1.658  -0.177  -5.878
  185    H    ARG  32           H        ARG  32  -3.786  -3.693  -4.159
  186    HA   ARG  32           HA       ARG  32  -3.984  -1.790  -1.900
  187    HB2  ARG  32           HB2      ARG  32  -5.231  -4.481  -2.496
  188    HB3  ARG  32           HB3      ARG  32  -5.367  -3.712  -0.906
  189    HG2  ARG  32           HG3      ARG  32  -6.497  -1.787  -1.909
  190    HG3  ARG  32           HG2      ARG  32  -6.294  -2.493  -3.526
  191    HD2  ARG  32           HD3      ARG  32  -7.766  -3.935  -1.310
  192    HD3  ARG  32           HD2      ARG  32  -8.574  -2.786  -2.395
  193    HE   ARG  32           HE       ARG  32  -7.284  -4.524  -4.109
  194   HH11  ARG  32          HH11      ARG  32  -9.624  -4.938  -1.480
  195   HH12  ARG  32          HH12      ARG  32 -10.330  -6.371  -2.193
  196   HH21  ARG  32          HH21      ARG  32  -8.221  -6.374  -4.996
  197   HH22  ARG  32          HH22      ARG  32  -9.539  -7.179  -4.174
  198    H    CYS  33           H        CYS  33  -3.244  -2.231   0.196
  199    HA   CYS  33           HA       CYS  33  -0.797  -3.866   0.246
  200    HB2  CYS  33           HB2      CYS  33  -2.062  -1.876   2.122
  201    HB3  CYS  33           HB3      CYS  33  -0.726  -2.910   2.656
  202    H    VAL  34           H        VAL  34  -0.616  -5.820   0.996
  203    HA   VAL  34           HA       VAL  34  -2.691  -6.853   2.872
  204    HB   VAL  34           HB       VAL  34  -1.892  -9.153   1.794
  205   HG11  VAL  34          HG11      VAL  34  -4.196  -8.297   1.940
  206   HG12  VAL  34          HG12      VAL  34  -3.877  -9.121   0.396
  207   HG13  VAL  34          HG13      VAL  34  -3.923  -7.343   0.462
  208   HG21  VAL  34          HG21      VAL  34  -1.399  -9.115  -0.516
  209   HG22  VAL  34          HG22      VAL  34  -0.316  -7.903   0.209
  210   HG23  VAL  34          HG23      VAL  34  -1.782  -7.382  -0.656
  211    H    GLY  35           H        GLY  35  -2.022  -8.165   4.547
  212    HA2  GLY  35           HA2      GLY  35  -0.106  -9.577   5.395
  213    HA3  GLY  35           HA3      GLY  35   0.944  -8.216   4.955
  214    H    ASN  36           H        ASN  36   1.743  -7.699   6.926
  215    HA   ASN  36           HA       ASN  36  -0.129  -6.406   8.797
  216    HB2  ASN  36           HB2      ASN  36   0.925  -7.584  10.761
  217    HB3  ASN  36           HB3      ASN  36  -0.140  -8.587   9.762
  218   HD21  ASN  36          HD21      ASN  36   2.368 -10.859   8.739
  219   HD22  ASN  36          HD22      ASN  36   0.751 -10.252   8.464
  220    H    CYS  37           H        CYS  37   0.787  -4.473   8.210
  221    HA   CYS  37           HA       CYS  37   3.616  -4.082   9.093
  222    HB2  CYS  37           HB2      CYS  37   3.710  -2.187   7.522
  223    HB3  CYS  37           HB3      CYS  37   3.432  -3.735   6.708
  Start of MODEL    9
    1    H1   GLU   2           H        GLU   2   1.283  16.782   7.340
    2    HA   GLU   2           HA       GLU   2   2.678  14.354   8.335
    3    HB2  GLU   2           HB3      GLU   2   0.202  15.849   9.237
    4    HB3  GLU   2           HB2      GLU   2   0.612  14.237   9.845
    5    HG2  GLU   2           HG2      GLU   2   1.475  15.650  11.472
    6    HG3  GLU   2           HG3      GLU   2   2.894  15.267  10.480
    7    H    GLY   3           H        GLY   3   2.182  12.362   7.712
    8    HA2  GLY   3           HA3      GLY   3   0.143  10.887   7.207
    9    HA3  GLY   3           HA2      GLY   3  -0.176  12.051   5.906
   10    H    GLU   4           H        GLU   4   1.729   9.355   6.987
   11    HA   GLU   4           HA       GLU   4   2.673   8.931   4.220
   12    HB2  GLU   4           HB3      GLU   4   4.469   9.360   6.592
   13    HB3  GLU   4           HB2      GLU   4   4.948   8.212   5.329
   14    HG2  GLU   4           HG2      GLU   4   4.809   9.942   3.640
   15    HG3  GLU   4           HG3      GLU   4   4.209  11.107   4.835
   16    H    CYS   5           H        CYS   5   1.282   7.298   4.044
   17    HA   CYS   5           HA       CYS   5   0.364   5.212   4.202
   18    HB2  CYS   5           HB3      CYS   5   1.911   3.315   4.404
   19    HB3  CYS   5           HB2      CYS   5   2.467   4.553   3.270
   20    H    SER   6           H        SER   6   0.174   3.099   5.503
   21    HA   SER   6           HA       SER   6   0.437   3.410   8.405
   22    HB2  SER   6           HB2      SER   6  -2.303   3.330   7.083
   23    HB3  SER   6           HB3      SER   6  -2.008   3.077   8.817
   24    HG   SER   6           HG       SER   6  -2.522   5.235   8.490
   25    HA   PRO   7           HA       PRO   7   0.640  -1.048   8.167
   26    HB2  PRO   7           HB2      PRO   7  -1.078  -1.277  10.603
   27    HB3  PRO   7           HB3      PRO   7   0.585  -1.869  10.323
   28    HG2  PRO   7           HG2      PRO   7   0.088   0.231  11.912
   29    HG3  PRO   7           HG3      PRO   7   1.543   0.146  10.881
   30    HD2  PRO   7           HD3      PRO   7  -0.999   1.701  10.470
   31    HD3  PRO   7           HD2      PRO   7   0.694   2.181  10.137
   32    H    LEU   8           H        LEU   8  -0.525  -1.532   6.410
   33    HA   LEU   8           HA       LEU   8  -2.247  -2.135   5.036
   34    HB2  LEU   8           HB2      LEU   8  -2.786  -3.462   7.517
   35    HB3  LEU   8           HB3      LEU   8  -4.323  -2.954   6.801
   36    HG   LEU   8           HG       LEU   8  -3.397  -4.027   4.626
   37   HD11  LEU   8          HD11      LEU   8  -1.934  -6.061   5.282
   38   HD12  LEU   8          HD12      LEU   8  -1.151  -4.473   5.103
   39   HD13  LEU   8          HD13      LEU   8  -1.519  -5.106   6.725
   40   HD21  LEU   8          HD21      LEU   8  -4.288  -6.217   5.311
   41   HD22  LEU   8          HD22      LEU   8  -4.201  -5.710   7.015
   42   HD23  LEU   8          HD23      LEU   8  -5.299  -4.873   5.892
   43    H    GLY   9           H        GLY   9  -2.670  -0.177   4.232
   44    HA2  GLY   9           HA2      GLY   9  -5.263   0.939   4.743
   45    HA3  GLY   9           HA3      GLY   9  -4.008   1.944   5.490
   46    H    GLU  10           H        GLU  10  -2.218   2.741   4.022
   47    HA   GLU  10           HA       GLU  10  -3.461   3.796   1.597
   48    HB2  GLU  10           HB3      GLU  10  -0.756   4.126   2.893
   49    HB3  GLU  10           HB2      GLU  10  -1.092   4.769   1.278
   50    HG2  GLU  10           HG2      GLU  10  -1.470   6.579   2.700
   51    HG3  GLU  10           HG3      GLU  10  -3.094   5.966   2.344
   52    HA   PRO  11           HA       PRO  11  -1.879   0.748  -1.259
   53    HB2  PRO  11           HB2      PRO  11  -1.934   2.664  -3.488
   54    HB3  PRO  11           HB3      PRO  11  -3.059   1.321  -3.140
   55    HG2  PRO  11           HG3      PRO  11  -3.746   3.952  -2.972
   56    HG3  PRO  11           HG2      PRO  11  -4.514   2.663  -2.004
   57    HD2  PRO  11           HD3      PRO  11  -2.357   4.619  -1.221
   58    HD3  PRO  11           HD2      PRO  11  -3.795   4.088  -0.294
   59    H    CYS  12           H        CYS  12  -0.165   0.396  -2.988
   60    HA   CYS  12           HA       CYS  12   2.336   1.679  -2.112
   61    HB2  CYS  12           HB3      CYS  12   1.704  -0.638  -3.950
   62    HB3  CYS  12           HB2      CYS  12   3.341   0.013  -3.762
   63    H    ALA  13           H        ALA  13   0.073   2.002  -4.701
   64    HA   ALA  13           HA       ALA  13   2.059   3.347  -6.446
   65    HB1  ALA  13           HB1      ALA  13   0.255   3.369  -8.118
   66    HB2  ALA  13           HB2      ALA  13  -0.860   2.660  -6.925
   67    HB3  ALA  13           HB3      ALA  13   0.546   1.728  -7.494
   68    H    GLY  14           H        GLY  14   2.388   5.438  -6.312
   69    HA2  GLY  14           HA3      GLY  14   0.713   7.530  -6.554
   70    HA3  GLY  14           HA2      GLY  14   0.465   7.120  -4.846
   71    H    ASN  15           H        ASN  15   2.744   6.599  -3.762
   72    HA   ASN  15           HA       ASN  15   4.480   7.621  -2.683
   73    HB2  ASN  15           HB2      ASN  15   6.460   8.132  -4.020
   74    HB3  ASN  15           HB3      ASN  15   5.713   6.599  -4.495
   75   HD21  ASN  15          HD21      ASN  15   4.740   6.392  -6.546
   76   HD22  ASN  15          HD22      ASN  15   5.024   7.558  -7.819
   77    HA   PRO  16           HA       PRO  16   5.771   8.645  -1.372
   78    HB2  PRO  16           HB2      PRO  16   5.010  10.552   0.746
   79    HB3  PRO  16           HB3      PRO  16   6.634  10.175   0.103
   80    HG2  PRO  16           HG2      PRO  16   5.404  12.560  -0.297
   81    HG3  PRO  16           HG3      PRO  16   6.544  11.837  -1.467
   82    HD2  PRO  16           HD3      PRO  16   3.527  11.818  -1.494
   83    HD3  PRO  16           HD2      PRO  16   4.668  12.166  -2.833
   84    H    TRP  17           H        TRP  17   2.682   8.743  -1.988
   85    HA   TRP  17           HA       TRP  17   1.583   7.885   0.618
   86    HB2  TRP  17           HB2      TRP  17   0.329   8.320  -2.111
   87    HB3  TRP  17           HB3      TRP  17  -0.567   7.708  -0.709
   88    HD1  TRP  17           HD1      TRP  17   1.316  10.896  -1.882
   89    HE1  TRP  17           HE1      TRP  17   0.386  12.938  -0.610
   90    HE3  TRP  17           HE3      TRP  17  -1.836   8.444   1.325
   91    HZ2  TRP  17           HZ2      TRP  17  -1.440  13.412   1.471
   92    HZ3  TRP  17           HZ3      TRP  17  -3.144   9.773   2.933
   93    HH2  TRP  17           HH2      TRP  17  -2.949  12.224   3.000
   94    H    GLY  18           H        GLY  18   3.373   6.131   0.333
   95    HA2  GLY  18           HA3      GLY  18   2.364   3.826  -1.242
   96    HA3  GLY  18           HA2      GLY  18   3.968   3.976  -0.501
   97    H    CYS  19           H        CYS  19   3.865   1.985   0.474
   98    HA   CYS  19           HA       CYS  19   1.909   1.759   2.725
   99    HB2  CYS  19           HB3      CYS  19   3.313  -0.379   1.091
  100    HB3  CYS  19           HB2      CYS  19   2.444  -0.703   2.599
  101    H    CYS  20           H        CYS  20   2.663   1.536   4.734
  102    HA   CYS  20           HA       CYS  20   5.417   2.143   5.312
  103    HB2  CYS  20           HB2      CYS  20   3.075   1.241   6.994
  104    HB3  CYS  20           HB3      CYS  20   4.671   1.561   7.690
  105    HA   PRO  21           HA       PRO  21   7.661  -1.694   5.470
  106    HB2  PRO  21           HB2      PRO  21   8.153  -1.169   8.408
  107    HB3  PRO  21           HB3      PRO  21   9.311  -1.614   7.120
  108    HG2  PRO  21           HG3      PRO  21   9.163   0.882   7.968
  109    HG3  PRO  21           HG2      PRO  21   9.342   0.530   6.226
  110    HD2  PRO  21           HD2      PRO  21   6.912   1.414   7.764
  111    HD3  PRO  21           HD3      PRO  21   7.442   1.847   6.109
  112    H    GLY  22           H        GLY  22   7.211  -3.806   5.714
  113    HA2  GLY  22           HA3      GLY  22   6.461  -5.746   6.876
  114    HA3  GLY  22           HA2      GLY  22   5.574  -4.711   8.011
  115    H    CYS  23           H        CYS  23   5.130  -3.749   4.788
  116    HA   CYS  23           HA       CYS  23   2.562  -5.276   4.595
  117    HB2  CYS  23           HB2      CYS  23   3.018  -2.443   3.629
  118    HB3  CYS  23           HB3      CYS  23   1.482  -3.316   3.736
  119    H    ILE  24           H        ILE  24   1.801  -5.745   2.498
  120    HA   ILE  24           HA       ILE  24   3.776  -5.368   0.296
  121    HB   ILE  24           HB       ILE  24   3.014  -7.666  -0.567
  122   HG12  ILE  24          HG12      ILE  24   2.621  -9.132   1.683
  123   HG13  ILE  24          HG13      ILE  24   1.742  -7.656   2.120
  124   HG21  ILE  24          HG21      ILE  24   5.257  -7.180   0.335
  125   HG22  ILE  24          HG22      ILE  24   4.725  -8.836   0.714
  126   HG23  ILE  24          HG23      ILE  24   4.675  -7.575   1.970
  127   HD11  ILE  24          HD11      ILE  24   0.254  -9.303   1.091
  128   HD12  ILE  24          HD12      ILE  24   0.398  -7.855   0.066
  129   HD13  ILE  24          HD13      ILE  24   1.282  -9.339  -0.362
  130    H    CYS  25           H        CYS  25   2.842  -5.600  -1.888
  131    HA   CYS  25           HA       CYS  25  -0.074  -4.963  -1.946
  132    HB2  CYS  25           HB2      CYS  25   2.165  -3.471  -3.331
  133    HB3  CYS  25           HB3      CYS  25   0.460  -3.311  -3.787
  134    H    ILE  26           H        ILE  26  -1.200  -5.528  -3.778
  135    HA   ILE  26           HA       ILE  26   0.098  -7.649  -5.386
  136    HB   ILE  26           HB       ILE  26  -2.404  -7.939  -6.173
  137   HG12  ILE  26          HG12      ILE  26  -3.214  -7.147  -3.447
  138   HG13  ILE  26          HG13      ILE  26  -2.832  -5.782  -4.511
  139   HG21  ILE  26          HG21      ILE  26  -2.764  -9.495  -4.302
  140   HG22  ILE  26          HG22      ILE  26  -1.423  -8.727  -3.419
  141   HG23  ILE  26          HG23      ILE  26  -1.108  -9.586  -4.946
  142   HD11  ILE  26          HD11      ILE  26  -5.217  -6.327  -4.590
  143   HD12  ILE  26          HD12      ILE  26  -4.449  -6.626  -6.167
  144   HD13  ILE  26          HD13      ILE  26  -4.830  -7.991  -5.090
  145    H    TRP  27           H        TRP  27  -2.372  -5.145  -6.035
  146    HA   TRP  27           HA       TRP  27  -2.744  -3.736  -7.798
  147    HB2  TRP  27           HB2      TRP  27  -0.438  -2.958  -7.186
  148    HB3  TRP  27           HB3      TRP  27   0.214  -4.018  -8.441
  149    HD1  TRP  27           HD1      TRP  27  -2.965  -1.944  -9.201
  150    HE1  TRP  27           HE1      TRP  27  -2.405  -0.142 -10.957
  151    HE3  TRP  27           HE3      TRP  27   2.122  -2.546  -9.350
  152    HZ2  TRP  27           HZ2      TRP  27  -0.110   0.871 -12.211
  153    HZ3  TRP  27           HZ3      TRP  27   3.430  -1.111 -10.862
  154    HH2  TRP  27           HH2      TRP  27   2.326   0.575 -12.271
  155    H    GLN  28           H        GLN  28  -2.964  -6.660  -8.116
  156    HA   GLN  28           HA       GLN  28  -2.425  -7.039 -11.003
  157    HB2  GLN  28           HB3      GLN  28  -3.417  -8.884  -8.813
  158    HB3  GLN  28           HB2      GLN  28  -3.424  -9.341 -10.525
  159    HG2  GLN  28           HG3      GLN  28  -0.990  -9.017 -10.630
  160    HG3  GLN  28           HG2      GLN  28  -0.980  -8.555  -8.917
  161   HE21  GLN  28          HE21      GLN  28  -1.320 -10.123  -7.304
  162   HE22  GLN  28          HE22      GLN  28  -1.188 -11.833  -7.646
  163    H    LEU  29           H        LEU  29  -4.505  -5.282  -9.525
  164    HA   LEU  29           HA       LEU  29  -6.587  -5.535 -11.530
  165    HB2  LEU  29           HB3      LEU  29  -8.472  -5.728  -9.861
  166    HB3  LEU  29           HB2      LEU  29  -7.544  -7.202 -10.158
  167    HG   LEU  29           HG       LEU  29  -6.737  -5.537  -7.815
  168   HD11  LEU  29          HD11      LEU  29  -9.200  -5.539  -7.684
  169   HD12  LEU  29          HD12      LEU  29  -9.201  -7.313  -7.823
  170   HD13  LEU  29          HD13      LEU  29  -8.470  -6.533  -6.400
  171   HD21  LEU  29          HD21      LEU  29  -6.755  -8.423  -8.641
  172   HD22  LEU  29          HD22      LEU  29  -6.725  -8.017  -6.908
  173   HD23  LEU  29          HD23      LEU  29  -5.430  -7.434  -7.982
  174    H    THR  30           H        THR  30  -5.672  -4.111  -8.366
  175    HA   THR  30           HA       THR  30  -6.483  -1.475  -9.467
  176    HB   THR  30           HB       THR  30  -7.154  -1.077  -6.890
  177    HG1  THR  30           HG1      THR  30  -8.165  -2.885  -6.055
  178   HG21  THR  30          HG21      THR  30  -9.500  -1.377  -7.572
  179   HG22  THR  30          HG22      THR  30  -8.548  -0.561  -8.835
  180   HG23  THR  30          HG23      THR  30  -8.964  -2.282  -9.008
  181    H    ASP  31           H        ASP  31  -5.059  -2.873  -6.482
  182    HA   ASP  31           HA       ASP  31  -2.568  -2.450  -6.167
  183    HB2  ASP  31           HB2      ASP  31  -2.750  -0.279  -7.594
  184    HB3  ASP  31           HB3      ASP  31  -3.295   0.490  -6.092
  185    H    ARG  32           H        ARG  32  -4.216  -3.560  -4.599
  186    HA   ARG  32           HA       ARG  32  -4.852  -1.846  -2.270
  187    HB2  ARG  32           HB3      ARG  32  -5.473  -4.729  -2.963
  188    HB3  ARG  32           HB2      ARG  32  -5.806  -4.032  -1.369
  189    HG2  ARG  32           HG2      ARG  32  -7.264  -2.341  -2.413
  190    HG3  ARG  32           HG3      ARG  32  -6.952  -3.063  -4.005
  191    HD2  ARG  32           HD2      ARG  32  -7.933  -5.182  -3.238
  192    HD3  ARG  32           HD3      ARG  32  -8.233  -4.472  -1.639
  193    HE   ARG  32           HE       ARG  32  -9.450  -2.871  -3.685
  194   HH11  ARG  32          HH11      ARG  32  -9.880  -5.944  -1.971
  195   HH12  ARG  32          HH12      ARG  32 -11.613  -5.952  -2.204
  196   HH21  ARG  32          HH21      ARG  32 -11.688  -2.919  -3.965
  197   HH22  ARG  32          HH22      ARG  32 -12.630  -4.248  -3.328
  198    H    CYS  33           H        CYS  33  -3.921  -1.973  -0.291
  199    HA   CYS  33           HA       CYS  33  -1.319  -3.389  -0.185
  200    HB2  CYS  33           HB2      CYS  33  -1.773  -0.884   0.404
  201    HB3  CYS  33           HB3      CYS  33  -2.365  -1.531   1.943
  202    H    VAL  34           H        VAL  34  -1.185  -5.308   0.695
  203    HA   VAL  34           HA       VAL  34  -2.920  -5.966   3.036
  204    HB   VAL  34           HB       VAL  34  -2.164  -8.210   1.197
  205   HG11  VAL  34          HG11      VAL  34  -3.346  -8.586   3.333
  206   HG12  VAL  34          HG12      VAL  34  -4.705  -7.602   2.740
  207   HG13  VAL  34          HG13      VAL  34  -4.294  -9.133   1.930
  208   HG21  VAL  34          HG21      VAL  34  -4.353  -7.858  -0.075
  209   HG22  VAL  34          HG22      VAL  34  -4.292  -6.176   0.505
  210   HG23  VAL  34          HG23      VAL  34  -2.983  -6.812  -0.521
  211    H    GLY  35           H        GLY  35  -2.020  -8.081   4.124
  212    HA2  GLY  35           HA2      GLY  35   0.397  -9.192   4.042
  213    HA3  GLY  35           HA3      GLY  35   0.862  -7.561   4.561
  214    H    ASN  36           H        ASN  36   1.600  -8.021   6.562
  215    HA   ASN  36           HA       ASN  36  -0.444  -8.960   8.518
  216    HB2  ASN  36           HB2      ASN  36   1.390 -10.154   9.755
  217    HB3  ASN  36           HB3      ASN  36   0.948 -10.879   8.200
  218   HD21  ASN  36          HD21      ASN  36   3.414  -9.136  10.016
  219   HD22  ASN  36          HD22      ASN  36   4.720  -9.388   8.879
  220    H    CYS  37           H        CYS  37   0.519  -6.291   7.697
  221    HA   CYS  37           HA       CYS  37   1.915  -5.359  10.148
  222    HB2  CYS  37           HB2      CYS  37   2.085  -3.202   8.879
  223    HB3  CYS  37           HB3      CYS  37   2.932  -4.570   8.137
  Start of MODEL   10
    1    H1   GLU   2           H        GLU   2   6.843  15.002   1.380
    2    HA   GLU   2           HA       GLU   2   4.001  14.267   1.863
    3    HB2  GLU   2           HB2      GLU   2   5.796  14.103  -0.567
    4    HB3  GLU   2           HB3      GLU   2   4.218  13.303  -0.496
    5    HG2  GLU   2           HG2      GLU   2   3.145  15.490  -0.100
    6    HG3  GLU   2           HG3      GLU   2   4.730  16.280  -0.206
    7    H    GLY   3           H        GLY   3   3.288  12.149   1.934
    8    HA2  GLY   3           HA2      GLY   3   3.803   9.754   1.652
    9    HA3  GLY   3           HA3      GLY   3   5.438  10.093   2.252
   10    H    GLU   4           H        GLU   4   2.240   9.193   3.031
   11    HA   GLU   4           HA       GLU   4   2.977   8.873   5.862
   12    HB2  GLU   4           HB3      GLU   4   0.791  10.708   4.915
   13    HB3  GLU   4           HB2      GLU   4   0.585   9.803   6.426
   14    HG2  GLU   4           HG3      GLU   4   2.614  10.780   7.334
   15    HG3  GLU   4           HG2      GLU   4   2.924  11.618   5.801
   16    H    CYS   5           H        CYS   5   2.949   6.738   5.618
   17    HA   CYS   5           HA       CYS   5   0.525   5.398   4.574
   18    HB2  CYS   5           HB2      CYS   5   1.842   3.335   4.808
   19    HB3  CYS   5           HB3      CYS   5   2.647   4.544   3.795
   20    H    SER   6           H        SER   6  -0.176   3.398   5.761
   21    HA   SER   6           HA       SER   6  -0.008   3.571   8.705
   22    HB2  SER   6           HB2      SER   6  -1.910   5.079   7.930
   23    HB3  SER   6           HB3      SER   6  -2.705   3.621   7.302
   24    HG   SER   6           HG       SER   6  -3.286   4.305   9.510
   25    HA   PRO   7           HA       PRO   7  -0.174  -0.897   8.358
   26    HB2  PRO   7           HB2      PRO   7  -2.159  -0.893  10.619
   27    HB3  PRO   7           HB3      PRO   7  -0.620  -1.788  10.454
   28    HG2  PRO   7           HG3      PRO   7  -0.827   0.335  12.055
   29    HG3  PRO   7           HG2      PRO   7   0.657   0.018  11.114
   30    HD2  PRO   7           HD3      PRO   7  -1.524   2.028  10.640
   31    HD3  PRO   7           HD2      PRO   7   0.238   2.173  10.356
   32    H    LEU   8           H        LEU   8  -1.188  -1.263   6.486
   33    HA   LEU   8           HA       LEU   8  -2.802  -1.668   4.919
   34    HB2  LEU   8           HB3      LEU   8  -3.728  -2.974   7.304
   35    HB3  LEU   8           HB2      LEU   8  -5.117  -2.312   6.430
   36    HG   LEU   8           HG       LEU   8  -4.094  -3.440   4.346
   37   HD11  LEU   8          HD11      LEU   8  -1.905  -3.962   5.353
   38   HD12  LEU   8          HD12      LEU   8  -2.738  -5.428   4.786
   39   HD13  LEU   8          HD13      LEU   8  -2.705  -5.039   6.522
   40   HD21  LEU   8          HD21      LEU   8  -5.230  -5.554   4.895
   41   HD22  LEU   8          HD22      LEU   8  -6.170  -4.134   5.412
   42   HD23  LEU   8          HD23      LEU   8  -5.259  -5.083   6.611
   43    H    GLY   9           H        GLY   9  -3.018   0.302   4.070
   44    HA2  GLY   9           HA2      GLY   9  -5.523   1.629   4.296
   45    HA3  GLY   9           HA3      GLY   9  -4.337   2.502   5.282
   46    H    GLU  10           H        GLU  10  -2.254   3.166   4.127
   47    HA   GLU  10           HA       GLU  10  -2.999   4.565   1.702
   48    HB2  GLU  10           HB2      GLU  10  -1.329   5.253   3.546
   49    HB3  GLU  10           HB3      GLU  10  -0.171   4.208   2.711
   50    HG2  GLU  10           HG2      GLU  10   0.285   6.331   1.862
   51    HG3  GLU  10           HG3      GLU  10  -0.730   5.600   0.606
   52    HA   PRO  11           HA       PRO  11  -2.302   1.271  -1.301
   53    HB2  PRO  11           HB3      PRO  11  -1.713   3.653  -3.063
   54    HB3  PRO  11           HB2      PRO  11  -2.771   2.246  -3.378
   55    HG2  PRO  11           HG3      PRO  11  -3.798   4.599  -2.719
   56    HG3  PRO  11           HG2      PRO  11  -4.485   3.090  -2.055
   57    HD2  PRO  11           HD2      PRO  11  -2.747   5.150  -0.731
   58    HD3  PRO  11           HD3      PRO  11  -4.080   4.166  -0.053
   59    H    CYS  12           H        CYS  12  -0.611   0.432  -2.685
   60    HA   CYS  12           HA       CYS  12   2.071   1.173  -1.698
   61    HB2  CYS  12           HB2      CYS  12   2.719  -0.902  -3.041
   62    HB3  CYS  12           HB3      CYS  12   1.722  -1.130  -1.596
   63    H    ALA  13           H        ALA  13   0.126   1.693  -4.509
   64    HA   ALA  13           HA       ALA  13   2.483   2.173  -6.236
   65    HB1  ALA  13           HB1      ALA  13   0.884   2.476  -8.035
   66    HB2  ALA  13           HB2      ALA  13  -0.469   2.451  -6.880
   67    HB3  ALA  13           HB3      ALA  13   0.502   0.983  -7.144
   68    H    GLY  14           H        GLY  14   3.415   4.063  -6.461
   69    HA2  GLY  14           HA2      GLY  14   2.518   6.507  -7.014
   70    HA3  GLY  14           HA3      GLY  14   2.102   6.443  -5.290
   71    H    ASN  15           H        ASN  15   4.085   5.368  -4.008
   72    HA   ASN  15           HA       ASN  15   6.031   5.947  -2.951
   73    HB2  ASN  15           HB3      ASN  15   8.099   5.598  -4.217
   74    HB3  ASN  15           HB2      ASN  15   6.895   4.338  -4.529
   75   HD21  ASN  15          HD21      ASN  15   5.939   4.140  -6.577
   76   HD22  ASN  15          HD22      ASN  15   6.594   4.949  -7.982
   77    HA   PRO  16           HA       PRO  16   7.365   6.768  -1.581
   78    HB2  PRO  16           HB2      PRO  16   6.984   9.158   0.114
   79    HB3  PRO  16           HB3      PRO  16   8.466   8.200  -0.167
   80    HG2  PRO  16           HG3      PRO  16   8.150  10.726  -1.085
   81    HG3  PRO  16           HG2      PRO  16   9.131   9.500  -1.935
   82    HD2  PRO  16           HD2      PRO  16   6.305  10.411  -2.499
   83    HD3  PRO  16           HD3      PRO  16   7.659  10.121  -3.636
   84    H    TRP  17           H        TRP  17   4.552   7.760  -2.692
   85    HA   TRP  17           HA       TRP  17   2.919   7.735  -0.248
   86    HB2  TRP  17           HB3      TRP  17   2.213   7.874  -3.199
   87    HB3  TRP  17           HB2      TRP  17   1.016   7.875  -1.893
   88    HD1  TRP  17           HD1      TRP  17   3.949  10.063  -3.209
   89    HE1  TRP  17           HE1      TRP  17   3.528  12.515  -2.531
   90    HE3  TRP  17           HE3      TRP  17  -0.250   9.371  -0.361
   91    HZ2  TRP  17           HZ2      TRP  17   1.655  13.934  -0.994
   92    HZ3  TRP  17           HZ3      TRP  17  -1.303  11.338   0.679
   93    HH2  TRP  17           HH2      TRP  17  -0.361  13.589   0.365
   94    H    GLY  18           H        GLY  18   4.185   5.508   0.016
   95    HA2  GLY  18           HA2      GLY  18   2.435   3.361  -1.105
   96    HA3  GLY  18           HA3      GLY  18   4.122   3.130  -0.609
   97    H    CYS  19           H        CYS  19   2.883   1.291   0.455
   98    HA   CYS  19           HA       CYS  19   1.592   2.073   2.999
   99    HB2  CYS  19           HB2      CYS  19   1.370  -0.463   3.223
  100    HB3  CYS  19           HB3      CYS  19   0.436   0.319   1.937
  101    H    CYS  20           H        CYS  20   2.397   1.628   4.999
  102    HA   CYS  20           HA       CYS  20   5.152   1.843   5.475
  103    HB2  CYS  20           HB2      CYS  20   2.995   0.642   7.228
  104    HB3  CYS  20           HB3      CYS  20   4.614   1.080   7.791
  105    HA   PRO  21           HA       PRO  21   7.205  -2.061   4.928
  106    HB2  PRO  21           HB2      PRO  21   8.201  -1.855   7.768
  107    HB3  PRO  21           HB3      PRO  21   9.116  -2.111   6.253
  108    HG2  PRO  21           HG2      PRO  21   9.138   0.254   7.446
  109    HG3  PRO  21           HG3      PRO  21   9.032   0.129   5.667
  110    HD2  PRO  21           HD2      PRO  21   6.869   0.751   7.667
  111    HD3  PRO  21           HD3      PRO  21   7.166   1.448   6.044
  112    H    GLY  22           H        GLY  22   6.998  -4.257   5.285
  113    HA2  GLY  22           HA2      GLY  22   6.433  -6.129   6.740
  114    HA3  GLY  22           HA3      GLY  22   5.260  -5.087   7.567
  115    H    CYS  23           H        CYS  23   4.280  -3.946   5.017
  116    HA   CYS  23           HA       CYS  23   2.493  -6.202   4.280
  117    HB2  CYS  23           HB2      CYS  23   2.278  -3.210   4.229
  118    HB3  CYS  23           HB3      CYS  23   1.276  -4.166   3.124
  119    H    ILE  24           H        ILE  24   1.933  -6.627   2.110
  120    HA   ILE  24           HA       ILE  24   4.104  -5.916   0.191
  121    HB   ILE  24           HB       ILE  24   3.254  -7.991  -1.089
  122   HG12  ILE  24          HG13      ILE  24   2.464  -9.734   0.791
  123   HG13  ILE  24          HG12      ILE  24   1.744  -8.269   1.478
  124   HG21  ILE  24          HG21      ILE  24   5.403  -7.833   0.110
  125   HG22  ILE  24          HG22      ILE  24   4.601  -8.387   1.599
  126   HG23  ILE  24          HG23      ILE  24   4.705  -9.468   0.189
  127   HD11  ILE  24          HD11      ILE  24   0.139  -9.469   0.076
  128   HD12  ILE  24          HD12      ILE  24   1.244  -9.339  -1.313
  129   HD13  ILE  24          HD13      ILE  24   0.521  -7.872  -0.611
  130    H    CYS  25           H        CYS  25   3.491  -5.883  -2.122
  131    HA   CYS  25           HA       CYS  25   0.897  -4.432  -2.447
  132    HB2  CYS  25           HB2      CYS  25   3.033  -3.208  -2.910
  133    HB3  CYS  25           HB3      CYS  25   3.370  -4.365  -4.207
  134    H    ILE  26           H        ILE  26  -0.631  -5.171  -3.803
  135    HA   ILE  26           HA       ILE  26  -0.055  -7.703  -5.217
  136    HB   ILE  26           HB       ILE  26  -2.590  -7.728  -5.586
  137   HG12  ILE  26          HG12      ILE  26  -3.352  -6.297  -3.263
  138   HG13  ILE  26          HG13      ILE  26  -2.394  -5.177  -4.248
  139   HG21  ILE  26          HG21      ILE  26  -1.377  -9.118  -3.961
  140   HG22  ILE  26          HG22      ILE  26  -3.003  -8.667  -3.394
  141   HG23  ILE  26          HG23      ILE  26  -1.571  -7.836  -2.740
  142   HD11  ILE  26          HD11      ILE  26  -4.778  -5.017  -4.787
  143   HD12  ILE  26          HD12      ILE  26  -3.856  -5.633  -6.179
  144   HD13  ILE  26          HD13      ILE  26  -4.815  -6.752  -5.182
  145    H    TRP  27           H        TRP  27  -2.093  -4.855  -5.976
  146    HA   TRP  27           HA       TRP  27  -2.475  -3.682  -7.900
  147    HB2  TRP  27           HB2      TRP  27   0.081  -3.400  -7.625
  148    HB3  TRP  27           HB3      TRP  27   0.220  -4.541  -8.968
  149    HD1  TRP  27           HD1      TRP  27  -2.716  -2.603  -9.927
  150    HE1  TRP  27           HE1      TRP  27  -2.138  -0.613 -11.461
  151    HE3  TRP  27           HE3      TRP  27   2.344  -2.432  -9.121
  152    HZ2  TRP  27           HZ2      TRP  27   0.157   0.806 -12.217
  153    HZ3  TRP  27           HZ3      TRP  27   3.662  -0.720 -10.301
  154    HH2  TRP  27           HH2      TRP  27   2.580   0.880 -11.824
  155    H    GLN  28           H        GLN  28  -2.956  -6.667  -7.725
  156    HA   GLN  28           HA       GLN  28  -3.035  -7.375 -10.608
  157    HB2  GLN  28           HB3      GLN  28  -3.532  -8.958  -8.071
  158    HB3  GLN  28           HB2      GLN  28  -3.921  -9.583  -9.682
  159    HG2  GLN  28           HG2      GLN  28  -1.568  -9.340 -10.350
  160    HG3  GLN  28           HG3      GLN  28  -1.171  -8.731  -8.731
  161   HE21  GLN  28          HE21      GLN  28  -2.073 -11.538 -10.657
  162   HE22  GLN  28          HE22      GLN  28  -1.698 -12.742  -9.444
  163    H    LEU  29           H        LEU  29  -4.671  -5.440  -8.840
  164    HA   LEU  29           HA       LEU  29  -7.245  -5.934 -10.182
  165    HB2  LEU  29           HB2      LEU  29  -6.958  -5.691  -7.171
  166    HB3  LEU  29           HB3      LEU  29  -8.485  -5.451  -8.028
  167    HG   LEU  29           HG       LEU  29  -6.983  -8.023  -8.406
  168   HD11  LEU  29          HD11      LEU  29  -7.007  -7.647  -5.970
  169   HD12  LEU  29          HD12      LEU  29  -8.075  -8.990  -6.442
  170   HD13  LEU  29          HD13      LEU  29  -8.769  -7.403  -6.031
  171   HD21  LEU  29          HD21      LEU  29  -9.000  -7.540  -9.745
  172   HD22  LEU  29          HD22      LEU  29  -9.246  -8.928  -8.658
  173   HD23  LEU  29          HD23      LEU  29  -9.940  -7.341  -8.246
  174    H    THR  30           H        THR  30  -5.457  -3.878  -7.841
  175    HA   THR  30           HA       THR  30  -6.093  -1.532  -9.503
  176    HB   THR  30           HB       THR  30  -6.516  -0.443  -7.022
  177    HG1  THR  30           HG1      THR  30  -7.950  -1.797  -5.931
  178   HG21  THR  30          HG21      THR  30  -8.882  -0.311  -7.687
  179   HG22  THR  30          HG22      THR  30  -7.795   0.027  -9.055
  180   HG23  THR  30          HG23      THR  30  -8.600  -1.555  -8.928
  181    H    ASP  31           H        ASP  31  -4.700  -2.324  -6.277
  182    HA   ASP  31           HA       ASP  31  -2.036  -2.030  -6.516
  183    HB2  ASP  31           HB3      ASP  31  -1.407   0.357  -6.171
  184    HB3  ASP  31           HB2      ASP  31  -2.132   0.061  -7.760
  185    H    ARG  32           H        ARG  32  -4.033  -3.018  -4.768
  186    HA   ARG  32           HA       ARG  32  -3.957  -1.462  -2.283
  187    HB2  ARG  32           HB3      ARG  32  -5.046  -4.220  -2.926
  188    HB3  ARG  32           HB2      ARG  32  -5.147  -3.459  -1.330
  189    HG2  ARG  32           HG2      ARG  32  -6.475  -1.626  -2.261
  190    HG3  ARG  32           HG3      ARG  32  -6.360  -2.350  -3.879
  191    HD2  ARG  32           HD2      ARG  32  -7.519  -4.366  -3.047
  192    HD3  ARG  32           HD3      ARG  32  -7.654  -3.621  -1.441
  193    HE   ARG  32           HE       ARG  32  -8.793  -1.847  -3.337
  194   HH11  ARG  32          HH11      ARG  32 -11.183  -4.894  -2.168
  195   HH12  ARG  32          HH12      ARG  32  -9.454  -5.039  -1.944
  196   HH21  ARG  32          HH21      ARG  32 -11.026  -1.699  -3.608
  197   HH22  ARG  32          HH22      ARG  32 -12.067  -3.013  -3.106
  198    H    CYS  33           H        CYS  33  -3.164  -2.245  -0.254
  199    HA   CYS  33           HA       CYS  33  -0.757  -3.991  -0.567
  200    HB2  CYS  33           HB3      CYS  33  -0.509  -1.466   0.007
  201    HB3  CYS  33           HB2      CYS  33  -1.112  -1.930   1.606
  202    H    VAL  34           H        VAL  34  -1.000  -5.912   0.318
  203    HA   VAL  34           HA       VAL  34  -2.718  -6.151   2.759
  204    HB   VAL  34           HB       VAL  34  -2.253  -8.607   1.132
  205   HG11  VAL  34          HG11      VAL  34  -3.578  -8.591   3.214
  206   HG12  VAL  34          HG12      VAL  34  -4.730  -7.464   2.458
  207   HG13  VAL  34          HG13      VAL  34  -4.537  -9.110   1.808
  208   HG21  VAL  34          HG21      VAL  34  -4.269  -8.048  -0.318
  209   HG22  VAL  34          HG22      VAL  34  -4.010  -6.349   0.145
  210   HG23  VAL  34          HG23      VAL  34  -2.743  -7.234  -0.739
  211    H    GLY  35           H        GLY  35  -2.178  -8.180   4.063
  212    HA2  GLY  35           HA2      GLY  35  -0.217  -9.780   4.404
  213    HA3  GLY  35           HA3      GLY  35   0.799  -8.330   4.292
  214    H    ASN  36           H        ASN  36   1.667  -8.381   6.308
  215    HA   ASN  36           HA       ASN  36  -0.194  -7.716   8.525
  216    HB2  ASN  36           HB2      ASN  36   0.520 -10.232   8.448
  217    HB3  ASN  36           HB3      ASN  36   2.088  -9.634   9.022
  218   HD21  ASN  36          HD21      ASN  36   2.262  -8.711  11.105
  219   HD22  ASN  36          HD22      ASN  36   1.023  -8.946  12.317
  220    H    CYS  37           H        CYS  37   0.508  -5.589   8.230
  221    HA   CYS  37           HA       CYS  37   3.286  -5.083   9.206
  222    HB2  CYS  37           HB3      CYS  37   3.295  -3.019   7.877
  223    HB3  CYS  37           HB2      CYS  37   3.111  -4.461   6.865