*HEADER    PLANT PROTEIN                           30-JUL-19   6KLM              
*TITLE     NMR SOLUTION STRUCTURE OF ROSELTIDE RT7                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ROSELTIDE RT7;                                             
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HIBISCUS SABDARIFFA;                            
*SOURCE   3 ORGANISM_TAXID: 183260                                               
*KEYWDS    ROSELTIDE, PLANT PROTEIN                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    17                                                                    
*AUTHOR    J.S.FAN,A.KAM,S.LOO,D.YANG,P.J.TAM                                    
*REVDAT   1   20-NOV-19 6KLM    0                                                
# Restraints file 1: 2dnoe.tbl
assign (resid 13 and name HA )(resid 14 and name HN ) 2.9 1.1 0.0
assign (resid 1 and name HA )(resid 1 and name HB# ) 3.5 1.7 1.0
assign (resid 1 and name HA )(resid 1 and name HN ) 3.5 1.7 0.0
assign (resid 13 and name HA )(resid 2 and name HB ) 2.9 1.1 0.0
assign (resid 13 and name HA )(resid 2 and name HN ) 3.5 1.7 0.0
assign (resid 1 and name HA )(resid 2 and name HN ) 5.0 3.2 0.0
assign (resid 13 and name HB# )(resid 14 and name HN ) 3.5 1.7 1.0
assign (resid 13 and name HB# )(resid 15 and name HN ) 3.5 1.7 1.0
assign (resid 1 and name HB# )(resid 1 and name HN ) 2.9 1.1 0.6
assign (resid 2 and name HA )(resid 2 and name HG# ) 2.9 1.1 1.7
assign (resid 2 and name HA )(resid 2 and name HN ) 3.5 1.7 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 HG# ) 2.9 1.1 1.7
assign (resid 2 and name HB )(resid 2 and name HN ) 2.9 1.1 0.0
assign (resid 2 and name HG# )(resid 2 and name HN ) 2.9 1.1 1.7
!assign (resid 2 and name HG# )(resid 29 and name HD# ) 3.5 1.7 3.4
assign (resid 2 and name HG# )(resid 32 and name HB# ) 3.5 1.7 3.4
assign (resid 2 and name HG# )(resid 3 and name HN ) 2.9 1.1 2.4
assign (resid 2 and name HG# )(resid 4 and name HN ) 2.9 1.1 2.4
assign (resid 2 and name HG# )(resid 5 and name HA# ) 3.5 1.7 3.4
assign (resid 2 and name HG# )(resid 5 and name HN ) 5 3.2 2.4
!assign (resid 2 and name HN )(resid 29 and name HA ) 2.9 1.1 0.0
!assign (resid 2 and name HN )(resid 30 and name HB# ) 2.9 1.1 1.0
assign (resid 2 and name HN )(resid 3 and name HN ) 3.5 1.7 0.0
assign (resid 3 and name HA )(resid 14 and name HB# ) 3.5 1.7 1.0
assign (resid 3 and name HA )(resid 14 and name HN ) 5 3.2 0.0
assign (resid 3 and name HA )(resid 34 and name HG# ) 5 3.2 2.4
assign (resid 3 and name HA )(resid 3 and name HB# ) 2.9 1.1 1.0
assign (resid 3 and name HA )(resid 3 and name HN ) 3.5 1.7 0.0
assign (resid 3 and name HA )(resid 4 and name HN ) 5 3.2 0.0
assign (resid 3 and name HB# )(resid 34 and name HG# ) 3.5 1.7 3.4
assign (resid 3 and name HB# )(resid 3 and name HN ) 2.9 1.1 0.6
assign (resid 3 and name HB# )(resid 4 and name HN ) 2.9 1.1 1.0
assign (resid 3 and name HN )(resid 4 and name HN ) 2.9 1.1 0.0
assign (resid 4 and name HA )(resid 5 and name HN ) 5 3.2 0.0
assign (resid 4 and name HB# )(resid 31 and name HG# ) 5 3.2 3.4
assign (resid 4 and name HB# )(resid 34 and name HG# ) 5 3.2 3.4
assign (resid 4 and name HB# )(resid 4 and name HN ) 2.9 1.1 0.6
assign (resid 4 and name HB# )(resid 5 and name HN ) 3.5 1.7 1.0
assign (resid 5 and name HA# )(resid 31 and name HG# ) 3.5 1.7 3.4
assign (resid 5 and name HA# )(resid 5 and name HN ) 2.9 1.1 0.6
assign (resid 5 and name HA# )(resid 6 and name HN ) 2.9 1.1 1.0
assign (resid 5 and name HN )(resid 31 and name HG# ) 3.5 1.7 2.4
assign (resid 5 and name HN )(resid 32 and name HB# ) 3.5 1.7 1.0
assign (resid 5 and name HN )(resid 32 and name HN ) 5 3.2 0.0
assign (resid 6 and name HA )(resid 6 and name HB ) 3.5 1.7 0.0
assign (resid 6 and name HA )(resid 6 and name HD# ) 2.9 1.1 1.5
assign (resid 6 and name HA )(resid 6 and name HG12 ) 3.5 1.7 0.0
assign (resid 6 and name HA )(resid 6 and name HG2# ) 3.5 1.7 1.5
assign (resid 6 and name HA )(resid 6 and name HN ) 3.5 1.7 0.0
assign (resid 6 and name HA )(resid 7 and name HN ) 2.9 1.1 0.0
assign (resid 6 and name HB )(resid 6 and name HN ) 2.9 1.1 0.0
assign (resid 6 and name HD# )(resid 29 and name HA ) 5 3.2 1.5
assign (resid 6 and name HD# )(resid 29 and name HD# ) 5 3.2 1.5
assign (resid 6 and name HD# )(resid 30 and name HN ) 5 3.2 1.5
assign (resid 6 and name HD# )(resid 6 and name HN ) 3.5 1.7 1.5
assign (resid 6 and name HD# )(resid 7 and name HN ) 2.9 1.1 1.5
assign (resid 6 and name HG12 )(resid 6 and name HN ) 3.5 1.7 0.0
assign (resid 6 and name HG2# )(resid 6 and name HN ) 3.5 1.7 1.5
assign (resid 6 and name HG2# )(resid 9 and name HN ) 5 3.2 1.5
assign (resid 7 and name HA )(resid 7 and name HG# ) 2.9 1.1 1.7
assign (resid 7 and name HA )(resid 7 and name HN ) 3.5 1.7 0.0
assign (resid 7 and name HA )(resid 9 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 HG# )(resid 12 and name HN ) 5 3.2 2.4
assign (resid 7 and name HG# )(resid 12 and name HB# ) 3.5 1.7 3.4
assign (resid 7 and name HG# )(resid 15 and name HB# ) 3.5 1.7 3.4
assign (resid 7 and name HG# )(resid 30 and name HB# ) 3.5 1.7 3.4
assign (resid 7 and name HG# )(resid 30 and name HD# ) 3.5 1.7 4.4
assign (resid 7 and name HG# )(resid 30 and name HE# ) 3.5 1.7 4.4
assign (resid 7 and name HG# )(resid 30 and name HN ) 5 3.2 2.4
assign (resid 7 and name HG# )(resid 7 and name HN ) 2.9 1.1 1.7
assign (resid 7 and name HG# )(resid 8 and name HN ) 3.5 1.7 2.4
assign (resid 7 and name HG# )(resid 9 and name HN ) 2.9 1.1 2.4
assign (resid 7 and name HN )(resid 30 and name HN ) 3.5 1.7 0.0
assign (resid 8 and name HA )(resid 30 and name HD# ) 5 3.2 2.0
assign (resid 8 and name HA )(resid 8 and name HN ) 3.5 1.7 0.0
assign (resid 8 and name HA )(resid 9 and name HN ) 5 3.2 0.0
assign (resid 8 and name HB# )(resid 8 and name HN ) 3.5 1.7 0.6
assign (resid 8 and name HN )(resid 7 and name HB ) 2.9 1.1 0.0
assign (resid 30 and name HN )(resid 22 and name HA ) 3.5 1.7 0.0
assign (resid 8 and name HN )(resid 9 and name HN ) 2.9 1.1 0.0
assign (resid 9 and name HA )(resid 10 and name HN ) 2.9 1.1 0.0
assign (resid 9 and name HA )(resid 30 and name HD# ) 5 3.2 2.0
assign (resid 9 and name HA )(resid 9 and name HN ) 5 3.2 0.0
assign (resid 9 and name HB# )(resid 10 and name HN ) 3.5 1.7 1.5
assign (resid 9 and name HB# )(resid 11 and name HN ) 2.9 1.1 1.5
assign (resid 9 and name HB# )(resid 12 and name HN ) 5 3.2 1.5
assign (resid 9 and name HB# )(resid 9 and name HN ) 3.5 1.7 1.1
assign (resid 9 and name HN )(resid 7 and name HB ) 2.9 1.1 0.0
assign (resid 10 and name HA )(resid 10 and name HB# ) 3.5 1.7 1.0
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 HB# )(resid 11 and name HN ) 5 3.2 1.0
assign (resid 10 and name HN )(resid 13 and name HN ) 3.5 1.7 0.0
assign (resid 11 and name HA )(resid 11 and name HB# ) 2.9 1.1 1.0
assign (resid 11 and name HA )(resid 11 and name HN ) 2.9 1.1 0.0
assign (resid 11 and name HA )(resid 12 and name HN ) 5 3.2 0.0
assign (resid 11 and name HB# )(resid 11 and name HN ) 2.9 1.1 0.6
assign (resid 13 and name HN )(resid 14 and name HN ) 5 3.2 0.0
!assign (resid 11 and name HN )(resid 15 and name HB# ) 5 3.2 1.0
assign (resid 12 and name HA )(resid 12 and name HN ) 3.5 1.7 0.0
assign (resid 12 and name HA )(resid 13 and name HN ) 5 3.2 0.0
assign (resid 12 and name HN )(resid 13 and name HN ) 5 3.2 0.0
assign (resid 12 and name HB# )(resid 12 and name HN ) 2.9 1.1 0.6
assign (resid 12 and name HB# )(resid 13 and name HN ) 3.5 1.7 1.0
assign (resid 12 and name HG# )(resid 12 and name HN ) 2.9 1.1 1.0
assign (resid 13 and name HA )(resid 13 and name HN ) 5 3.2 0.0
assign (resid 13 and name HB# )(resid 13 and name HN ) 3.5 1.7 0.6
assign (resid 14 and name HA )(resid 14 and name HB# ) 2.9 1.1 1.0
assign (resid 14 and name HA )(resid 14 and name HN ) 3.5 1.7 0.0
assign (resid 14 and name HA )(resid 15 and name HN ) 5 3.2 0.0
assign (resid 14 and name HB# )(resid 14 and name HN ) 2.9 1.1 0.6
assign (resid 14 and name HB# )(resid 15 and name HN ) 5 3.2 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 ) 5 3.2 0.0
assign (resid 15 and name HA )(resid 16 and name HD# ) 2.9 1.1 1.0
assign (resid 15 and name HB# )(resid 15 and name HN ) 3.5 1.7 0.6
assign (resid 15 and name HG# )(resid 15 and name HN ) 3.5 1.7 1.0
assign (resid 16 and name HD# )(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 HN ) 3.5 1.7 0.0
assign (resid 17 and name HA )(resid 18 and name HN ) 5 3.2 0.0
assign (resid 17 and name HB# )(resid 17 and name HN ) 3.5 1.7 0.6
assign (resid 17 and name HN )(resid 18 and name HN ) 2.9 1.1 0.0
assign (resid 18 and name HA )(resid 18 and name HN ) 3.5 1.7 0.0
assign (resid 18 and name HA )(resid 19 and name HN ) 3.5 1.7 0.0
assign (resid 18 and name HB# )(resid 18 and name HN ) 3.5 1.7 0.6
assign (resid 18 and name HN )(resid 19 and name HN ) 3.5 1.7 0.0
assign (resid 19 and name HA )(resid 19 and name HN ) 5 3.2 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 ) 3.5 1.7 0.6
assign (resid 19 and name HN )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 20 and name HA )(resid 20 and name HG2# ) 3.5 1.7 1.5
assign (resid 20 and name HA )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 20 and name HA )(resid 21 and name HN ) 2.9 1.1 0.0
assign (resid 20 and name HB )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 20 and name HB )(resid 21 and name HN ) 3.5 1.7 0.0
assign (resid 20 and name HG12 )(resid 20 and name HN ) 5 3.2 0.0
assign (resid 20 and name HG12 )(resid 21 and name HN ) 5 3.2 0.0
assign (resid 20 and name HG2# )(resid 20 and name HN ) 5 3.2 1.5
assign (resid 20 and name HG2# )(resid 21 and name HN ) 5 3.2 1.5
assign (resid 20 and name HN )(resid 31 and name HG# ) 5 3.2 2.4
assign (resid 20 and name HN )(resid 31 and name HN ) 3.5 1.7 0.0
assign (resid 21 and name HA )(resid 21 and name HD# ) 3.5 1.7 1.5
assign (resid 21 and name HA )(resid 21 and name HN ) 3.5 1.7 0.0
assign (resid 21 and name HA )(resid 22 and name HN ) 2.9 1.1 0.0
assign (resid 30 and name HA )(resid 22 and name HN ) 3.5 1.7 0.0
assign (resid 21 and name HA )(resid 30 and name HA ) 3.5 1.7 0.0
assign (resid 21 and name HA )(resid 30 and name HD# ) 2.9 1.1 2.0
assign (resid 21 and name HB )(resid 21 and name HN ) 2.9 1.1 0.0
assign (resid 21 and name HD# )(resid 21 and name HN ) 2.9 1.1 1.5
assign (resid 21 and name HG13 )(resid 22 and name HN ) 5 3.2 0.0
assign (resid 22 and name HA )(resid 22 and name HN ) 3.5 1.7 0.0
assign (resid 22 and name HA )(resid 23 and name HB# ) 3.5 1.7 1.0
assign (resid 22 and name HA )(resid 23 and name HN ) 2.9 1.1 0.0
assign (resid 22 and name HB# )(resid 22 and name HN ) 5 3.2 0.6
assign (resid 22 and name HG# )(resid 22 and name HN ) 5 3.2 1.0
assign (resid 23 and name HA )(resid 23 and name HB# ) 5 3.2 1.0
assign (resid 23 and name HA )(resid 23 and name HD# ) 3.5 1.7 1.7
assign (resid 23 and name HA )(resid 23 and name HG ) 3.5 1.7 0.0
assign (resid 23 and name HA )(resid 23 and name HN ) 5 3.2 0.0
assign (resid 23 and name HB# )(resid 23 and name HN ) 2.9 1.1 0.6
assign (resid 23 and name HD# )(resid 24 and name HA ) 3.5 1.7 2.4
assign (resid 23 and name HG )(resid 23 and name HN ) 5 3.2 0.0
assign (resid 23 and name HG )(resid 24 and name HA ) 2.9 1.1 0.0
assign (resid 24 and name HA )(resid 25 and name HN ) 2.9 1.1 0.0
assign (resid 25 and name HA )(resid 25 and name HG2# ) 2.9 1.1 1.5
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 HB )(resid 25 and name HG2# ) 2.9 1.1 1.5
assign (resid 25 and name HB )(resid 25 and name HN ) 5 3.2 0.0
assign (resid 25 and name HB )(resid 26 and name HN ) 5 3.2 0.0
assign (resid 25 and name HN )(resid 26 and name HN ) 5 3.2 0.0
assign (resid 25 and name HG2# )(resid 25 and name HN ) 3.5 1.7 1.5
assign (resid 25 and name HN )(resid 31 and name HG# ) 5 3.2 2.4
assign (resid 26 and name HA )(resid 26 and name HE3 ) 5 3.2 0.0
assign (resid 26 and name HA )(resid 26 and name HN ) 5 3.2 0.0
assign (resid 26 and name HB# )(resid 26 and name HD1 ) 2.9 1.1 1.0
assign (resid 26 and name HB# )(resid 26 and name HE3 ) 2.9 1.1 1.0
assign (resid 26 and name HB# )(resid 26 and name HN ) 2.9 1.1 0.6
assign (resid 26 and name HD1 )(resid 26 and name HE1 ) 2.9 1.1 0.0
assign (resid 26 and name HE1 )(resid 26 and name HN ) 3.5 1.7 0.0
assign (resid 26 and name HE3 )(resid 26 and name HZ3 ) 2.9 1.1 0.0
assign (resid 26 and name HH2 )(resid 26 and name HZ2 ) 2.9 1.1 0.0
assign (resid 28 and name HA )(resid 29 and name HN ) 2.9 1.1 0.0
assign (resid 29 and name HA )(resid 29 and name HN ) 5 3.2 0.0
assign (resid 29 and name HA )(resid 30 and name HD# ) 5 3.2 2.0
assign (resid 29 and name HA )(resid 30 and name HN ) 2.9 1.1 0.0
assign (resid 29 and name HB# )(resid 29 and name HE ) 5 3.2 1.0
assign (resid 29 and name HB# )(resid 29 and name HN ) 5 3.2 0.6
assign (resid 29 and name HB# )(resid 30 and name HN ) 5 3.2 1.0
assign (resid 29 and name HD# )(resid 29 and name HE ) 3.5 1.7 1.0
assign (resid 29 and name HE )(resid 29 and name HG# ) 5 3.2 1.0
assign (resid 29 and name HG# )(resid 30 and name HN ) 3.5 1.7 1.0
assign (resid 30 and name HA )(resid 30 and name HD# ) 5 3.2 2.0
assign (resid 30 and name HA )(resid 30 and name HN ) 5 3.2 0.0
assign (resid 30 and name HA )(resid 31 and name HN ) 2.9 1.1 0.0
assign (resid 30 and name HB# )(resid 30 and name HD# ) 2.9 1.1 3.0
assign (resid 30 and name HB# )(resid 30 and name HN ) 3.5 1.7 0.6
assign (resid 30 and name HB# )(resid 31 and name HN ) 3.5 1.7 1.0
assign (resid 30 and name HD# )(resid 30 and name HN ) 3.5 1.7 2.0
assign (resid 30 and name HD# )(resid 21 and name HD# ) 3.5 1.7 4.4
assign (resid 31 and name HA )(resid 31 and name HG# ) 2.9 1.1 1.7
assign (resid 31 and name HA )(resid 31 and name HN ) 5 3.2 0.0
assign (resid 31 and name HA )(resid 32 and name HN ) 2.9 1.1 0.0
assign (resid 31 and name HB )(resid 31 and name HN ) 3.5 1.7 0.0
assign (resid 31 and name HG# )(resid 31 and name HN ) 3.5 1.7 1.7
assign (resid 31 and name HG# )(resid 32 and name HN ) 3.5 1.7 2.4
assign (resid 31 and name HG# )(resid 33 and name HB# ) 5 3.2 3.4
assign (resid 32 and name HA )(resid 32 and name HB# ) 3.5 1.7 1.0
assign (resid 32 and name HA )(resid 32 and name HN ) 5 3.2 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 HN ) 3.5 1.7 0.6
assign (resid 32 and name HB# )(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 ) 5 3.2 0.6
assign (resid 33 and name HB# )(resid 34 and name HN ) 2.9 1.1 1.0
assign (resid 33 and name HN )(resid 34 and name HN ) 2.9 1.1 0.0
assign (resid 34 and name HA )(resid 34 and name HG# ) 3.5 1.7 1.7
assign (resid 34 and name HA )(resid 34 and name HN ) 3.5 1.7 0.0
assign (resid 34 and name HB )(resid 34 and name HN ) 3.5 1.7 0.0
assign (resid 34 and name HG# )(resid 34 and name HN ) 2.9 1.1 1.7
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   CYS   1           H1       CYS   1 -10.146   5.721  -5.695
    2    H2   CYS   1           H2       CYS   1 -11.061   4.488  -6.298
    3    H3   CYS   1           H3       CYS   1 -11.611   5.375  -5.020
    4    HA   CYS   1           HA       CYS   1  -9.870   4.573  -3.609
    5    HB2  CYS   1           HB3      CYS   1 -12.100   3.329  -4.017
    6    HB3  CYS   1           HB2      CYS   1 -11.138   2.198  -4.982
    7    H    VAL   2           H        VAL   2  -8.197   2.946  -3.284
    8    HA   VAL   2           HA       VAL   2  -6.684   2.358  -5.792
    9    HB   VAL   2           HB       VAL   2  -5.345   2.889  -3.113
   10   HG11  VAL   2          HG11      VAL   2  -4.055   1.641  -4.813
   11   HG12  VAL   2          HG12      VAL   2  -4.277   2.988  -5.955
   12   HG13  VAL   2          HG13      VAL   2  -3.340   3.232  -4.461
   13   HG21  VAL   2          HG21      VAL   2  -6.582   4.928  -3.765
   14   HG22  VAL   2          HG22      VAL   2  -5.756   4.911  -5.341
   15   HG23  VAL   2          HG23      VAL   2  -4.819   5.155  -3.847
   16    H    SER   3           H        SER   3  -7.813   0.380  -5.832
   17    HA   SER   3           HA       SER   3  -7.798  -1.550  -3.728
   18    HB2  SER   3           HB2      SER   3  -8.376  -3.167  -5.549
   19    HB3  SER   3           HB3      SER   3  -9.400  -1.716  -5.513
   20    HG   SER   3           HG       SER   3  -8.681  -2.245  -7.642
   21    H    SER   4           H        SER   4  -5.600  -1.101  -6.523
   22    HA   SER   4           HA       SER   4  -3.605  -2.778  -5.090
   23    HB2  SER   4           HB3      SER   4  -2.979  -3.890  -7.227
   24    HB3  SER   4           HB2      SER   4  -4.614  -4.307  -6.671
   25    HG   SER   4           HG       SER   4  -4.542  -3.806  -8.922
   26    H    GLY   5           H        GLY   5  -1.450  -2.328  -5.522
   27    HA2  GLY   5           HA2      GLY   5   0.160  -1.112  -6.992
   28    HA3  GLY   5           HA3      GLY   5  -1.005   0.227  -7.017
   29    H    ILE   6           H        ILE   6   0.251   1.795  -6.120
   30    HA   ILE   6           HA       ILE   6   1.456   1.253  -3.452
   31    HB   ILE   6           HB       ILE   6   1.856   3.576  -5.385
   32   HG12  ILE   6          HG12      ILE   6   3.010   1.689  -6.236
   33   HG13  ILE   6          HG13      ILE   6   4.224   2.735  -5.491
   34   HG21  ILE   6          HG21      ILE   6   3.769   4.187  -3.772
   35   HG22  ILE   6          HG22      ILE   6   2.925   3.164  -2.585
   36   HG23  ILE   6          HG23      ILE   6   2.107   4.587  -3.274
   37   HD11  ILE   6          HD11      ILE   6   4.933   0.664  -4.766
   38   HD12  ILE   6          HD12      ILE   6   3.282   0.007  -4.677
   39   HD13  ILE   6          HD13      ILE   6   3.866   1.118  -3.415
   40    H    VAL   7           H        VAL   7   1.030   2.506  -1.663
   41    HA   VAL   7           HA       VAL   7  -1.085   4.550  -1.873
   42    HB   VAL   7           HB       VAL   7  -2.266   3.619   0.155
   43   HG11  VAL   7          HG11      VAL   7  -2.933   3.398  -2.349
   44   HG12  VAL   7          HG12      VAL   7  -2.537   1.678  -2.121
   45   HG13  VAL   7          HG13      VAL   7  -3.796   2.441  -1.122
   46   HG21  VAL   7          HG21      VAL   7  -0.339   1.937   0.636
   47   HG22  VAL   7          HG22      VAL   7  -2.023   1.425   0.901
   48   HG23  VAL   7          HG23      VAL   7  -1.156   0.911  -0.567
   49    H    ASP   8           H        ASP   8  -0.877   6.188  -0.529
   50    HA   ASP   8           HA       ASP   8   1.444   6.124   1.338
   51    HB2  ASP   8           HB3      ASP   8  -0.110   8.402   0.058
   52    HB3  ASP   8           HB2      ASP   8   1.104   8.641   1.329
   53    H    ALA   9           H        ALA   9  -1.569   5.241   1.484
   54    HA   ALA   9           HA       ALA   9  -1.979   6.215   4.256
   55    HB1  ALA   9           HB1      ALA   9  -3.316   7.478   2.319
   56    HB2  ALA   9           HB2      ALA   9  -4.058   7.119   3.896
   57    HB3  ALA   9           HB3      ALA   9  -4.395   6.074   2.495
   58    H    CYS  10           H        CYS  10  -4.608   5.026   4.457
   59    HA   CYS  10           HA       CYS  10  -4.350   2.163   3.865
   60    HB2  CYS  10           HB3      CYS  10  -2.999   2.339   5.917
   61    HB3  CYS  10           HB2      CYS  10  -4.328   3.181   6.730
   62    H    SER  11           H        SER  11  -5.998   4.833   5.517
   63    HA   SER  11           HA       SER  11  -8.588   3.479   5.597
   64    HB2  SER  11           HB2      SER  11  -7.841   6.389   6.067
   65    HB3  SER  11           HB3      SER  11  -9.421   5.655   6.418
   66    HG   SER  11           HG       SER  11  -8.050   5.744   8.272
   67    H    GLU  12           H        GLU  12  -6.782   5.303   3.311
   68    HA   GLU  12           HA       GLU  12  -9.144   6.136   1.747
   69    HB2  GLU  12           HB2      GLU  12  -6.162   6.469   1.325
   70    HB3  GLU  12           HB3      GLU  12  -7.375   6.986   0.141
   71    HG2  GLU  12           HG2      GLU  12  -8.345   8.517   1.792
   72    HG3  GLU  12           HG3      GLU  12  -7.162   7.981   3.000
   73    H    CYS  13           H        CYS  13  -6.688   3.616   1.823
   74    HA   CYS  13           HA       CYS  13  -7.125   2.636  -0.871
   75    HB2  CYS  13           HB3      CYS  13  -5.053   2.136   0.341
   76    HB3  CYS  13           HB2      CYS  13  -5.968   1.276   1.590
   77    H    CYS  14           H        CYS  14  -8.022   0.461  -1.371
   78    HA   CYS  14           HA       CYS  14 -10.708   0.216  -0.263
   79    HB2  CYS  14           HB3      CYS  14  -9.436  -1.786  -2.123
   80    HB3  CYS  14           HB2      CYS  14 -11.132  -1.296  -1.992
   81    H    GLU  15           H        GLU  15  -7.882  -0.682   1.038
   82    HA   GLU  15           HA       GLU  15  -8.661  -3.391   1.938
   83    HB2  GLU  15           HB2      GLU  15  -6.176  -1.694   2.131
   84    HB3  GLU  15           HB3      GLU  15  -6.389  -3.089   3.202
   85    HG2  GLU  15           HG3      GLU  15  -6.701  -4.516   1.169
   86    HG3  GLU  15           HG2      GLU  15  -6.316  -3.098   0.175
   87    HA   PRO  16           HA       PRO  16 -10.383  -1.122   5.534
   88    HB2  PRO  16           HB3      PRO  16 -12.014  -3.513   6.048
   89    HB3  PRO  16           HB2      PRO  16 -12.547  -1.875   5.578
   90    HG2  PRO  16           HG2      PRO  16 -12.738  -4.050   3.947
   91    HG3  PRO  16           HG3      PRO  16 -12.541  -2.379   3.349
   92    HD2  PRO  16           HD3      PRO  16 -10.472  -4.547   3.663
   93    HD3  PRO  16           HD2      PRO  16 -10.706  -3.389   2.316
   94    H    ASP  17           H        ASP  17  -8.945  -1.065   7.143
   95    HA   ASP  17           HA       ASP  17  -7.669  -1.623   8.963
   96    HB2  ASP  17           HB2      ASP  17  -9.770  -3.789   9.214
   97    HB3  ASP  17           HB3      ASP  17  -8.516  -3.503  10.436
   98    H    LYS  18           H        LYS  18  -7.315  -3.229   6.233
   99    HA   LYS  18           HA       LYS  18  -5.175  -4.972   7.353
  100    HB2  LYS  18           HB2      LYS  18  -7.409  -6.149   6.564
  101    HB3  LYS  18           HB3      LYS  18  -6.720  -5.911   4.950
  102    HG2  LYS  18           HG3      LYS  18  -4.698  -7.153   5.642
  103    HG3  LYS  18           HG2      LYS  18  -5.409  -7.395   7.252
  104    HD2  LYS  18           HD2      LYS  18  -7.280  -8.633   6.250
  105    HD3  LYS  18           HD3      LYS  18  -6.588  -8.385   4.633
  106    HE2  LYS  18           HE2      LYS  18  -4.572  -9.631   5.310
  107    HE3  LYS  18           HE3      LYS  18  -5.268  -9.884   6.923
  108    HZ1  LYS  18           HZ1      LYS  18  -5.599 -11.783   5.506
  109    HZ2  LYS  18           HZ2      LYS  18  -7.055 -11.108   5.886
  110    HZ3  LYS  18           HZ3      LYS  18  -6.403 -10.874   4.389
  111    H    CYS  19           H        CYS  19  -3.823  -3.175   6.831
  112    HA   CYS  19           HA       CYS  19  -3.277  -2.897   3.901
  113    HB2  CYS  19           HB3      CYS  19  -2.606  -0.961   6.144
  114    HB3  CYS  19           HB2      CYS  19  -2.288  -0.726   4.418
  115    H    ILE  20           H        ILE  20  -1.091  -2.797   3.209
  116    HA   ILE  20           HA       ILE  20   0.749  -4.288   5.016
  117    HB   ILE  20           HB       ILE  20   1.228  -3.796   2.053
  118   HG12  ILE  20          HG12      ILE  20   0.130  -6.428   2.894
  119   HG13  ILE  20          HG13      ILE  20  -1.023  -5.084   2.889
  120   HG21  ILE  20          HG21      ILE  20   3.130  -4.600   3.426
  121   HG22  ILE  20          HG22      ILE  20   2.156  -5.999   3.939
  122   HG23  ILE  20          HG23      ILE  20   2.616  -5.814   2.230
  123   HD11  ILE  20          HD11      ILE  20  -0.110  -6.650   0.694
  124   HD12  ILE  20          HD12      ILE  20   0.487  -4.991   0.455
  125   HD13  ILE  20          HD13      ILE  20  -1.253  -5.286   0.680
  126    H    ILE  21           H        ILE  21   2.967  -3.644   5.170
  127    HA   ILE  21           HA       ILE  21   3.222  -0.696   5.233
  128    HB   ILE  21           HB       ILE  21   5.311  -2.628   6.301
  129   HG12  ILE  21          HG12      ILE  21   3.947  -2.068   8.548
  130   HG13  ILE  21          HG13      ILE  21   2.591  -2.080   7.408
  131   HG21  ILE  21          HG21      ILE  21   5.264  -0.650   8.085
  132   HG22  ILE  21          HG22      ILE  21   4.575   0.248   6.711
  133   HG23  ILE  21          HG23      ILE  21   6.177  -0.512   6.564
  134   HD11  ILE  21          HD11      ILE  21   2.893  -4.271   8.450
  135   HD12  ILE  21          HD12      ILE  21   3.213  -4.355   6.702
  136   HD13  ILE  21          HD13      ILE  21   4.569  -4.336   7.855
  137    H    MET  22           H        MET  22   5.379   0.246   4.713
  138    HA   MET  22           HA       MET  22   5.994   0.123   1.999
  139    HB2  MET  22           HB3      MET  22   7.876   0.880   4.263
  140    HB3  MET  22           HB2      MET  22   8.066   1.321   2.559
  141    HG2  MET  22           HG2      MET  22   6.205   2.779   2.609
  142    HG3  MET  22           HG3      MET  22   5.638   2.137   4.163
  143    HE1  MET  22           HE1      MET  22   6.774   5.933   4.681
  144    HE2  MET  22           HE2      MET  22   5.691   5.022   3.602
  145    HE3  MET  22           HE3      MET  22   5.582   4.802   5.365
  146    H    LEU  23           H        LEU  23   6.938  -1.296   0.701
  147    HA   LEU  23           HA       LEU  23   9.273  -2.823   1.605
  148    HB2  LEU  23           HB3      LEU  23   7.887  -4.475   2.383
  149    HB3  LEU  23           HB2      LEU  23   6.586  -4.067   1.261
  150    HG   LEU  23           HG       LEU  23   8.206  -5.076  -0.550
  151   HD11  LEU  23          HD11      LEU  23  10.115  -5.375   0.983
  152   HD12  LEU  23          HD12      LEU  23   9.570  -6.922   0.293
  153   HD13  LEU  23          HD13      LEU  23   9.142  -6.495   1.966
  154   HD21  LEU  23          HD21      LEU  23   5.980  -5.934   0.067
  155   HD22  LEU  23          HD22      LEU  23   7.136  -7.251  -0.247
  156   HD23  LEU  23          HD23      LEU  23   6.707  -6.823   1.427
  157    HA   PRO  24           HA       PRO  24   8.717  -3.635  -3.131
  158    HB2  PRO  24           HB3      PRO  24   6.588  -1.787  -4.068
  159    HB3  PRO  24           HB2      PRO  24   6.794  -3.533  -4.388
  160    HG2  PRO  24           HG2      PRO  24   4.844  -2.597  -2.802
  161    HG3  PRO  24           HG3      PRO  24   5.675  -4.144  -2.471
  162    HD2  PRO  24           HD2      PRO  24   6.119  -1.439  -1.200
  163    HD3  PRO  24           HD3      PRO  24   5.994  -3.055  -0.435
  164    H    THR  25           H        THR  25   9.258  -2.407  -5.164
  165    HA   THR  25           HA       THR  25  10.625  -0.912  -6.229
  166    HB   THR  25           HB       THR  25  10.117   1.527  -5.995
  167    HG1  THR  25           HG1      THR  25   9.467   1.356  -3.723
  168   HG21  THR  25          HG21      THR  25   7.816   1.393  -6.866
  169   HG22  THR  25          HG22      THR  25   8.861   0.139  -7.576
  170   HG23  THR  25          HG23      THR  25   7.701  -0.290  -6.296
  171    H    TRP  26           H        TRP  26  12.230   0.977  -6.017
  172    HA   TRP  26           HA       TRP  26  14.231   0.264  -4.135
  173    HB2  TRP  26           HB2      TRP  26  14.202   3.052  -5.234
  174    HB3  TRP  26           HB3      TRP  26  15.553   1.919  -5.053
  175    HD1  TRP  26           HD1      TRP  26  12.434   2.457  -7.307
  176    HE1  TRP  26           HE1      TRP  26  12.867   1.424  -9.617
  177    HE3  TRP  26           HE3      TRP  26  17.054   0.449  -6.397
  178    HZ2  TRP  26           HZ2      TRP  26  14.938   0.013 -10.891
  179    HZ3  TRP  26           HZ3      TRP  26  18.210  -0.713  -8.235
  180    HH2  TRP  26           HH2      TRP  26  17.164  -0.926 -10.451
  181    HA   PRO  27           HA       PRO  27  12.939   3.833  -1.266
  182    HB2  PRO  27           HB2      PRO  27  10.487   5.165  -2.030
  183    HB3  PRO  27           HB3      PRO  27  12.148   5.815  -2.102
  184    HG2  PRO  27           HG3      PRO  27  10.544   5.281  -4.296
  185    HG3  PRO  27           HG2      PRO  27  12.323   5.422  -4.331
  186    HD2  PRO  27           HD2      PRO  27  10.602   2.948  -4.249
  187    HD3  PRO  27           HD3      PRO  27  12.112   3.266  -5.162
  188    HA   PRO  28           HA       PRO  28   9.804   1.597   1.034
  189    HB2  PRO  28           HB3      PRO  28   9.302   3.784   2.936
  190    HB3  PRO  28           HB2      PRO  28  10.211   2.268   3.190
  191    HG2  PRO  28           HG2      PRO  28  11.378   4.726   3.127
  192    HG3  PRO  28           HG3      PRO  28  12.210   3.227   2.629
  193    HD2  PRO  28           HD2      PRO  28  10.926   5.348   0.914
  194    HD3  PRO  28           HD3      PRO  28  12.474   4.475   0.690
  195    H    ARG  29           H        ARG  29   7.839   1.215   0.202
  196    HA   ARG  29           HA       ARG  29   5.750   3.324   0.377
  197    HB2  ARG  29           HB2      ARG  29   6.571   1.860  -2.144
  198    HB3  ARG  29           HB3      ARG  29   4.977   2.612  -1.957
  199    HG2  ARG  29           HG2      ARG  29   5.897   4.787  -1.853
  200    HG3  ARG  29           HG3      ARG  29   7.537   4.173  -1.555
  201    HD2  ARG  29           HD3      ARG  29   7.675   3.302  -3.812
  202    HD3  ARG  29           HD2      ARG  29   5.975   3.713  -4.115
  203    HE   ARG  29           HE       ARG  29   7.526   6.032  -3.357
  204   HH11  ARG  29          HH11      ARG  29   6.755   3.920  -6.098
  205   HH12  ARG  29          HH12      ARG  29   7.099   5.159  -7.284
  206   HH21  ARG  29          HH21      ARG  29   7.958   7.602  -4.919
  207   HH22  ARG  29          HH22      ARG  29   7.776   7.232  -6.619
  208    H    TYR  30           H        TYR  30   3.698   2.586   0.717
  209    HA   TYR  30           HA       TYR  30   3.386  -0.092   1.783
  210    HB2  TYR  30           HB3      TYR  30   1.311   2.039   1.132
  211    HB3  TYR  30           HB2      TYR  30   1.014   0.568   2.069
  212    HD1  TYR  30           HD1      TYR  30   1.485   0.487   4.398
  213    HD2  TYR  30           HD2      TYR  30   2.871   3.791   2.093
  214    HE1  TYR  30           HE1      TYR  30   2.065   1.683   6.463
  215    HE2  TYR  30           HE2      TYR  30   3.459   4.984   4.155
  216    HH   TYR  30           HH       TYR  30   3.767   3.567   7.084
  217    H    VAL  31           H        VAL  31   1.377  -1.452   1.097
  218    HA   VAL  31           HA       VAL  31   1.010  -1.404  -1.852
  219    HB   VAL  31           HB       VAL  31   1.158  -4.160  -0.925
  220   HG11  VAL  31          HG11      VAL  31   1.079  -3.403  -3.269
  221   HG12  VAL  31          HG12      VAL  31   2.690  -2.670  -3.074
  222   HG13  VAL  31          HG13      VAL  31   2.492  -4.434  -2.937
  223   HG21  VAL  31          HG21      VAL  31   2.899  -3.570   0.581
  224   HG22  VAL  31          HG22      VAL  31   3.688  -4.247  -0.863
  225   HG23  VAL  31          HG23      VAL  31   3.659  -2.486  -0.608
  226    H    CYS  32           H        CYS  32  -0.880  -2.153  -2.613
  227    HA   CYS  32           HA       CYS  32  -2.883  -3.139  -0.625
  228    HB2  CYS  32           HB2      CYS  32  -3.140  -0.987  -2.727
  229    HB3  CYS  32           HB3      CYS  32  -4.558  -1.901  -2.191
  230    H    SER  33           H        SER  33  -3.923  -4.963  -1.214
  231    HA   SER  33           HA       SER  33  -3.681  -5.811  -4.074
  232    HB2  SER  33           HB2      SER  33  -3.292  -7.476  -1.573
  233    HB3  SER  33           HB3      SER  33  -3.481  -8.163  -3.200
  234    HG   SER  33           HG       SER  33  -1.269  -7.873  -2.609
  235    H    VAL  34           H        VAL  34  -5.817  -4.622  -2.194
  236    HA   VAL  34           HA       VAL  34  -7.976  -6.521  -3.003
  237    HB   VAL  34           HB       VAL  34  -8.207  -4.826  -0.498
  238   HG11  VAL  34          HG11      VAL  34 -10.269  -5.747  -1.502
  239   HG12  VAL  34          HG12      VAL  34  -9.596  -7.387  -1.351
  240   HG13  VAL  34          HG13      VAL  34  -9.942  -6.429   0.109
  241   HG21  VAL  34          HG21      VAL  34  -6.233  -6.283  -0.194
  242   HG22  VAL  34          HG22      VAL  34  -7.234  -7.702  -0.585
  243   HG23  VAL  34          HG23      VAL  34  -7.580  -6.743   0.875
  Start of MODEL    2
    1    H1   CYS   1           H1       CYS   1 -12.242   1.820  -5.579
    2    H2   CYS   1           H2       CYS   1 -11.326   1.173  -4.370
    3    H3   CYS   1           H3       CYS   1 -12.666   2.062  -4.003
    4    HA   CYS   1           HA       CYS   1 -11.533   3.936  -5.259
    5    HB2  CYS   1           HB3      CYS   1 -10.421   4.678  -3.189
    6    HB3  CYS   1           HB2      CYS   1 -12.043   4.035  -2.895
    7    H    VAL   2           H        VAL   2  -9.180   1.850  -3.483
    8    HA   VAL   2           HA       VAL   2  -7.381   2.032  -5.851
    9    HB   VAL   2           HB       VAL   2  -6.313   2.202  -3.008
   10   HG11  VAL   2          HG11      VAL   2  -5.154   2.096  -5.710
   11   HG12  VAL   2          HG12      VAL   2  -4.426   1.715  -4.131
   12   HG13  VAL   2          HG13      VAL   2  -4.498   3.402  -4.693
   13   HG21  VAL   2          HG21      VAL   2  -7.698   4.206  -3.432
   14   HG22  VAL   2          HG22      VAL   2  -6.756   4.530  -4.907
   15   HG23  VAL   2          HG23      VAL   2  -5.966   4.599  -3.313
   16    H    SER   3           H        SER   3  -8.125  -0.001  -6.412
   17    HA   SER   3           HA       SER   3  -8.137  -2.288  -4.698
   18    HB2  SER   3           HB2      SER   3  -8.243  -3.574  -6.847
   19    HB3  SER   3           HB3      SER   3  -9.457  -2.284  -6.705
   20    HG   SER   3           HG       SER   3  -8.406  -2.295  -8.761
   21    H    SER   4           H        SER   4  -5.693  -1.145  -7.075
   22    HA   SER   4           HA       SER   4  -3.629  -2.668  -5.591
   23    HB2  SER   4           HB3      SER   4  -3.959  -2.939  -8.603
   24    HB3  SER   4           HB2      SER   4  -2.714  -3.704  -7.591
   25    HG   SER   4           HG       SER   4  -4.472  -5.123  -8.060
   26    H    GLY   5           H        GLY   5  -1.475  -1.991  -5.995
   27    HA2  GLY   5           HA3      GLY   5  -0.043  -0.465  -7.400
   28    HA3  GLY   5           HA2      GLY   5  -1.341   0.732  -7.222
   29    H    ILE   6           H        ILE   6   0.330   2.140  -6.406
   30    HA   ILE   6           HA       ILE   6   1.222   1.484  -3.643
   31    HB   ILE   6           HB       ILE   6   2.180   3.656  -5.558
   32   HG12  ILE   6          HG12      ILE   6   3.002   1.566  -6.331
   33   HG13  ILE   6          HG13      ILE   6   4.343   2.373  -5.509
   34   HG21  ILE   6          HG21      ILE   6   4.070   3.882  -3.815
   35   HG22  ILE   6          HG22      ILE   6   2.495   4.621  -3.439
   36   HG23  ILE   6          HG23      ILE   6   2.951   3.070  -2.694
   37   HD11  ILE   6          HD11      ILE   6   4.592   0.218  -4.725
   38   HD12  ILE   6          HD12      ILE   6   2.843  -0.112  -4.752
   39   HD13  ILE   6          HD13      ILE   6   3.540   0.889  -3.455
   40    H    VAL   7           H        VAL   7   0.873   2.838  -1.928
   41    HA   VAL   7           HA       VAL   7  -0.949   5.136  -2.338
   42    HB   VAL   7           HB       VAL   7  -2.304   4.412  -0.316
   43   HG11  VAL   7          HG11      VAL   7  -3.140   4.315  -2.632
   44   HG12  VAL   7          HG12      VAL   7  -2.519   2.653  -2.773
   45   HG13  VAL   7          HG13      VAL   7  -3.817   3.022  -1.612
   46   HG21  VAL   7          HG21      VAL   7  -0.790   2.643   0.525
   47   HG22  VAL   7          HG22      VAL   7  -2.439   2.039   0.240
   48   HG23  VAL   7          HG23      VAL   7  -1.143   1.669  -0.922
   49    H    ASP   8           H        ASP   8  -0.731   6.788  -0.928
   50    HA   ASP   8           HA       ASP   8   1.641   6.679   0.839
   51    HB2  ASP   8           HB2      ASP   8  -0.159   8.934  -0.101
   52    HB3  ASP   8           HB3      ASP   8   1.138   9.162   1.087
   53    H    ALA   9           H        ALA   9  -1.281   5.563   1.190
   54    HA   ALA   9           HA       ALA   9  -1.481   6.279   4.062
   55    HB1  ALA   9           HB1      ALA   9  -3.088   7.585   2.366
   56    HB2  ALA   9           HB2      ALA   9  -4.046   6.094   2.534
   57    HB3  ALA   9           HB3      ALA   9  -3.637   7.057   3.975
   58    H    CYS  10           H        CYS  10  -3.968   4.874   4.429
   59    HA   CYS  10           HA       CYS  10  -3.673   2.122   3.492
   60    HB2  CYS  10           HB2      CYS  10  -1.978   2.108   5.253
   61    HB3  CYS  10           HB3      CYS  10  -3.128   2.798   6.409
   62    H    SER  11           H        SER  11  -5.108   4.522   5.648
   63    HA   SER  11           HA       SER  11  -7.589   2.995   6.020
   64    HB2  SER  11           HB3      SER  11  -6.860   5.847   6.784
   65    HB3  SER  11           HB2      SER  11  -8.332   4.984   7.279
   66    HG   SER  11           HG       SER  11  -6.668   4.885   8.873
   67    H    GLU  12           H        GLU  12  -6.285   5.331   3.814
   68    HA   GLU  12           HA       GLU  12  -8.883   6.260   2.812
   69    HB2  GLU  12           HB2      GLU  12  -6.025   6.667   1.896
   70    HB3  GLU  12           HB3      GLU  12  -7.417   7.296   0.999
   71    HG2  GLU  12           HG2      GLU  12  -8.087   8.608   2.969
   72    HG3  GLU  12           HG3      GLU  12  -6.691   7.978   3.865
   73    H    CYS  13           H        CYS  13  -6.505   3.782   2.082
   74    HA   CYS  13           HA       CYS  13  -7.549   3.114  -0.558
   75    HB2  CYS  13           HB2      CYS  13  -5.211   2.658   0.148
   76    HB3  CYS  13           HB3      CYS  13  -5.808   1.490   1.338
   77    H    CYS  14           H        CYS  14  -8.430   0.914  -1.045
   78    HA   CYS  14           HA       CYS  14 -10.679   0.381   0.777
   79    HB2  CYS  14           HB3      CYS  14  -9.975  -0.576  -2.009
   80    HB3  CYS  14           HB2      CYS  14 -11.381  -1.166  -1.106
   81    H    GLU  15           H        GLU  15  -7.929  -0.354   1.546
   82    HA   GLU  15           HA       GLU  15  -8.327  -3.292   1.916
   83    HB2  GLU  15           HB3      GLU  15  -5.830  -1.673   1.402
   84    HB3  GLU  15           HB2      GLU  15  -5.743  -3.214   2.272
   85    HG2  GLU  15           HG2      GLU  15  -7.141  -3.043  -0.385
   86    HG3  GLU  15           HG3      GLU  15  -5.374  -3.173  -0.303
   87    HA   PRO  16           HA       PRO  16  -8.437  -1.400   6.124
   88    HB2  PRO  16           HB2      PRO  16 -10.500  -3.353   6.822
   89    HB3  PRO  16           HB3      PRO  16 -10.644  -1.579   6.683
   90    HG2  PRO  16           HG3      PRO  16 -11.840  -3.361   4.981
   91    HG3  PRO  16           HG2      PRO  16 -11.412  -1.685   4.542
   92    HD2  PRO  16           HD3      PRO  16  -9.957  -4.253   3.942
   93    HD3  PRO  16           HD2      PRO  16 -10.234  -2.832   2.885
   94    H    ASP  17           H        ASP  17  -8.575  -4.873   5.273
   95    HA   ASP  17           HA       ASP  17  -7.011  -5.482   7.743
   96    HB2  ASP  17           HB2      ASP  17  -7.774  -7.851   7.384
   97    HB3  ASP  17           HB3      ASP  17  -9.059  -6.701   7.793
   98    H    LYS  18           H        LYS  18  -7.182  -6.041   4.232
   99    HA   LYS  18           HA       LYS  18  -4.622  -7.509   4.276
  100    HB2  LYS  18           HB2      LYS  18  -6.778  -7.948   2.817
  101    HB3  LYS  18           HB3      LYS  18  -6.060  -6.726   1.755
  102    HG2  LYS  18           HG2      LYS  18  -4.012  -8.086   1.581
  103    HG3  LYS  18           HG3      LYS  18  -4.735  -9.310   2.646
  104    HD2  LYS  18           HD2      LYS  18  -6.545  -9.659   1.009
  105    HD3  LYS  18           HD3      LYS  18  -5.820  -8.436  -0.056
  106    HE2  LYS  18           HE3      LYS  18  -3.776  -9.810  -0.230
  107    HE3  LYS  18           HE2      LYS  18  -4.510 -11.029   0.831
  108    HZ1  LYS  18           HZ1      LYS  18  -4.733 -11.613  -1.478
  109    HZ2  LYS  18           HZ2      LYS  18  -6.220 -11.349  -0.817
  110    HZ3  LYS  18           HZ3      LYS  18  -5.543 -10.215  -1.805
  111    H    CYS  19           H        CYS  19  -4.538  -4.781   5.162
  112    HA   CYS  19           HA       CYS  19  -3.243  -3.277   2.961
  113    HB2  CYS  19           HB3      CYS  19  -4.838  -2.143   4.493
  114    HB3  CYS  19           HB2      CYS  19  -3.773  -2.522   5.855
  115    H    ILE  20           H        ILE  20  -1.106  -3.228   2.654
  116    HA   ILE  20           HA       ILE  20   0.616  -4.347   4.824
  117    HB   ILE  20           HB       ILE  20   1.498  -4.113   1.930
  118   HG12  ILE  20          HG13      ILE  20   0.922  -6.747   2.099
  119   HG13  ILE  20          HG12      ILE  20  -0.375  -6.101   3.118
  120   HG21  ILE  20          HG21      ILE  20   3.204  -4.552   3.669
  121   HG22  ILE  20          HG22      ILE  20   2.309  -6.008   4.164
  122   HG23  ILE  20          HG23      ILE  20   3.031  -5.917   2.540
  123   HD11  ILE  20          HD11      ILE  20  -0.829  -6.431   0.594
  124   HD12  ILE  20          HD12      ILE  20   0.140  -4.953   0.382
  125   HD13  ILE  20          HD13      ILE  20  -1.346  -4.910   1.361
  126    H    ILE  21           H        ILE  21   2.662  -3.400   5.207
  127    HA   ILE  21           HA       ILE  21   2.586  -0.461   4.953
  128    HB   ILE  21           HB       ILE  21   4.829  -1.927   6.343
  129   HG12  ILE  21          HG12      ILE  21   2.922  -3.151   7.178
  130   HG13  ILE  21          HG13      ILE  21   3.543  -2.090   8.447
  131   HG21  ILE  21          HG21      ILE  21   4.125   0.092   8.003
  132   HG22  ILE  21          HG22      ILE  21   3.581   0.762   6.446
  133   HG23  ILE  21          HG23      ILE  21   5.278   0.268   6.658
  134   HD11  ILE  21          HD11      ILE  21   1.094  -2.150   8.463
  135   HD12  ILE  21          HD12      ILE  21   1.053  -1.606   6.769
  136   HD13  ILE  21          HD13      ILE  21   1.671  -0.521   8.038
  137    H    MET  22           H        MET  22   4.721   0.668   4.572
  138    HA   MET  22           HA       MET  22   5.603   0.327   1.936
  139    HB2  MET  22           HB3      MET  22   6.986   1.634   4.301
  140    HB3  MET  22           HB2      MET  22   7.536   1.782   2.624
  141    HG2  MET  22           HG2      MET  22   5.362   2.795   2.019
  142    HG3  MET  22           HG3      MET  22   4.866   2.710   3.720
  143    HE1  MET  22           HE1      MET  22   5.763   6.538   2.573
  144    HE2  MET  22           HE2      MET  22   5.376   5.237   1.422
  145    HE3  MET  22           HE3      MET  22   4.403   5.437   2.898
  146    H    LEU  23           H        LEU  23   6.610  -1.301   1.013
  147    HA   LEU  23           HA       LEU  23   9.069  -2.363   2.247
  148    HB2  LEU  23           HB3      LEU  23   7.792  -4.015   3.182
  149    HB3  LEU  23           HB2      LEU  23   6.533  -3.894   1.949
  150    HG   LEU  23           HG       LEU  23   8.341  -5.001   0.390
  151   HD11  LEU  23          HD11      LEU  23  10.170  -4.898   2.042
  152   HD12  LEU  23          HD12      LEU  23   9.235  -5.950   3.132
  153   HD13  LEU  23          HD13      LEU  23   9.801  -6.573   1.564
  154   HD21  LEU  23          HD21      LEU  23   6.161  -5.963   1.020
  155   HD22  LEU  23          HD22      LEU  23   6.875  -6.576   2.530
  156   HD23  LEU  23          HD23      LEU  23   7.440  -7.199   0.962
  157    HA   PRO  24           HA       PRO  24   8.849  -3.955  -2.376
  158    HB2  PRO  24           HB2      PRO  24   6.757  -2.160  -3.559
  159    HB3  PRO  24           HB3      PRO  24   7.083  -3.891  -3.862
  160    HG2  PRO  24           HG3      PRO  24   4.978  -3.130  -2.440
  161    HG3  PRO  24           HG2      PRO  24   5.925  -4.575  -1.980
  162    HD2  PRO  24           HD2      PRO  24   5.979  -1.795  -0.798
  163    HD3  PRO  24           HD3      PRO  24   5.992  -3.386   0.026
  164    H    THR  25           H        THR  25   9.599  -2.949  -4.463
  165    HA   THR  25           HA       THR  25  11.089  -1.579  -5.534
  166    HB   THR  25           HB       THR  25  10.597   0.878  -5.597
  167    HG1  THR  25           HG1      THR  25   9.708   0.947  -3.407
  168   HG21  THR  25          HG21      THR  25   8.400   0.660  -6.694
  169   HG22  THR  25          HG22      THR  25   9.499  -0.660  -7.160
  170   HG23  THR  25          HG23      THR  25   8.204  -0.956  -5.975
  171    H    TRP  26           H        TRP  26  12.683   0.339  -5.345
  172    HA   TRP  26           HA       TRP  26  14.473  -0.199  -3.204
  173    HB2  TRP  26           HB2      TRP  26  14.607   2.464  -4.570
  174    HB3  TRP  26           HB3      TRP  26  15.911   1.341  -4.144
  175    HD1  TRP  26           HD1      TRP  26  13.037   1.669  -6.743
  176    HE1  TRP  26           HE1      TRP  26  13.687   0.417  -8.889
  177    HE3  TRP  26           HE3      TRP  26  17.525  -0.244  -5.189
  178    HZ2  TRP  26           HZ2      TRP  26  15.860  -1.108  -9.810
  179    HZ3  TRP  26           HZ3      TRP  26  18.847  -1.576  -6.784
  180    HH2  TRP  26           HH2      TRP  26  18.024  -2.000  -9.064
  181    HA   PRO  27           HA       PRO  27  12.947   3.638  -0.848
  182    HB2  PRO  27           HB2      PRO  27  10.666   4.972  -2.006
  183    HB3  PRO  27           HB3      PRO  27  12.358   5.542  -1.985
  184    HG2  PRO  27           HG3      PRO  27  10.924   4.810  -4.253
  185    HG3  PRO  27           HG2      PRO  27  12.702   4.923  -4.139
  186    HD2  PRO  27           HD2      PRO  27  10.925   2.495  -3.969
  187    HD3  PRO  27           HD3      PRO  27  12.529   2.693  -4.745
  188    HA   PRO  28           HA       PRO  28   9.475   1.751   1.285
  189    HB2  PRO  28           HB3      PRO  28   8.783   4.186   2.797
  190    HB3  PRO  28           HB2      PRO  28   9.574   2.693   3.377
  191    HG2  PRO  28           HG2      PRO  28  10.857   5.078   3.184
  192    HG3  PRO  28           HG3      PRO  28  11.678   3.506   2.979
  193    HD2  PRO  28           HD3      PRO  28  10.708   5.436   0.877
  194    HD3  PRO  28           HD2      PRO  28  12.253   4.531   0.958
  195    H    ARG  29           H        ARG  29   7.586   1.277   0.334
  196    HA   ARG  29           HA       ARG  29   5.576   3.421  -0.096
  197    HB2  ARG  29           HB2      ARG  29   6.673   1.593  -2.245
  198    HB3  ARG  29           HB3      ARG  29   5.084   2.363  -2.383
  199    HG2  ARG  29           HG2      ARG  29   6.054   4.550  -2.397
  200    HG3  ARG  29           HG3      ARG  29   7.648   3.916  -1.937
  201    HD2  ARG  29           HD2      ARG  29   7.787   2.711  -4.079
  202    HD3  ARG  29           HD3      ARG  29   6.190   3.337  -4.539
  203    HE   ARG  29           HE       ARG  29   7.930   5.510  -3.880
  204   HH11  ARG  29          HH11      ARG  29   7.401   3.105  -6.430
  205   HH12  ARG  29          HH12      ARG  29   8.092   4.120  -7.676
  206   HH21  ARG  29          HH21      ARG  29   8.813   6.788  -5.516
  207   HH22  ARG  29          HH22      ARG  29   8.887   6.195  -7.160
  208    H    TYR  30           H        TYR  30   3.545   2.816   0.348
  209    HA   TYR  30           HA       TYR  30   2.992   0.206   1.500
  210    HB2  TYR  30           HB2      TYR  30   1.325   2.633   0.817
  211    HB3  TYR  30           HB3      TYR  30   0.572   1.141   1.400
  212    HD1  TYR  30           HD1      TYR  30   0.862   0.433   3.716
  213    HD2  TYR  30           HD2      TYR  30   2.683   4.017   2.308
  214    HE1  TYR  30           HE1      TYR  30   1.261   1.137   6.033
  215    HE2  TYR  30           HE2      TYR  30   3.089   4.721   4.627
  216    HH   TYR  30           HH       TYR  30   3.366   3.481   6.908
  217    H    VAL  31           H        VAL  31   1.090  -1.169   0.771
  218    HA   VAL  31           HA       VAL  31   0.592  -1.050  -2.148
  219    HB   VAL  31           HB       VAL  31   0.914  -3.824  -1.544
  220   HG11  VAL  31          HG11      VAL  31   1.005  -2.739  -3.755
  221   HG12  VAL  31          HG12      VAL  31   2.562  -1.998  -3.315
  222   HG13  VAL  31          HG13      VAL  31   2.424  -3.768  -3.448
  223   HG21  VAL  31          HG21      VAL  31   3.327  -3.987  -1.142
  224   HG22  VAL  31          HG22      VAL  31   2.497  -3.198   0.220
  225   HG23  VAL  31          HG23      VAL  31   3.420  -2.221  -0.946
  226    H    CYS  32           H        CYS  32  -1.355  -1.722  -2.781
  227    HA   CYS  32           HA       CYS  32  -3.163  -2.807  -0.662
  228    HB2  CYS  32           HB3      CYS  32  -3.716  -0.997  -3.033
  229    HB3  CYS  32           HB2      CYS  32  -4.994  -1.823  -2.126
  230    H    SER  33           H        SER  33  -3.810  -4.821  -0.918
  231    HA   SER  33           HA       SER  33  -3.507  -6.093  -3.594
  232    HB2  SER  33           HB3      SER  33  -3.713  -7.238  -0.795
  233    HB3  SER  33           HB2      SER  33  -3.696  -8.226  -2.271
  234    HG   SER  33           HG       SER  33  -1.597  -7.970  -1.351
  235    H    VAL  34           H        VAL  34  -5.783  -4.399  -2.470
  236    HA   VAL  34           HA       VAL  34  -8.052  -4.285  -2.420
  237    HB   VAL  34           HB       VAL  34  -7.563  -4.502  -4.860
  238   HG11  VAL  34          HG11      VAL  34  -8.594  -6.639  -5.932
  239   HG12  VAL  34          HG12      VAL  34  -6.908  -6.657  -5.362
  240   HG13  VAL  34          HG13      VAL  34  -8.190  -7.396  -4.373
  241   HG21  VAL  34          HG21      VAL  34  -9.771  -3.845  -3.980
  242   HG22  VAL  34          HG22      VAL  34 -10.284  -5.548  -4.045
  243   HG23  VAL  34          HG23      VAL  34  -9.871  -4.684  -5.546
  Start of MODEL    3
    1    H1   CYS   1           H1       CYS   1 -12.684   2.149  -5.184
    2    H2   CYS   1           H2       CYS   1 -11.456   1.069  -4.970
    3    H3   CYS   1           H3       CYS   1 -12.420   1.484  -3.698
    4    HA   CYS   1           HA       CYS   1 -11.497   3.861  -4.574
    5    HB2  CYS   1           HB3      CYS   1  -9.863   3.350  -2.459
    6    HB3  CYS   1           HB2      CYS   1 -11.553   3.859  -2.331
    7    H    VAL   2           H        VAL   2  -9.059   1.537  -3.405
    8    HA   VAL   2           HA       VAL   2  -7.489   1.900  -5.899
    9    HB   VAL   2           HB       VAL   2  -6.231   2.213  -3.136
   10   HG11  VAL   2          HG11      VAL   2  -5.192   2.032  -5.903
   11   HG12  VAL   2          HG12      VAL   2  -4.488   3.328  -4.907
   12   HG13  VAL   2          HG13      VAL   2  -4.412   1.638  -4.352
   13   HG21  VAL   2          HG21      VAL   2  -7.678   4.158  -3.626
   14   HG22  VAL   2          HG22      VAL   2  -5.952   4.590  -3.609
   15   HG23  VAL   2          HG23      VAL   2  -6.808   4.404  -5.158
   16    H    SER   3           H        SER   3  -8.053  -0.184  -6.436
   17    HA   SER   3           HA       SER   3  -7.663  -2.425  -4.631
   18    HB2  SER   3           HB2      SER   3  -8.145  -2.339  -7.627
   19    HB3  SER   3           HB3      SER   3  -8.199  -3.801  -6.618
   20    HG   SER   3           HG       SER   3 -10.286  -2.870  -6.949
   21    H    SER   4           H        SER   4  -5.833  -1.111  -7.424
   22    HA   SER   4           HA       SER   4  -3.506  -2.738  -6.509
   23    HB2  SER   4           HB2      SER   4  -2.915  -3.136  -8.915
   24    HB3  SER   4           HB3      SER   4  -4.384  -3.978  -8.376
   25    HG   SER   4           HG       SER   4  -4.658  -2.929 -10.414
   26    H    GLY   5           H        GLY   5  -1.665  -1.663  -6.332
   27    HA2  GLY   5           HA2      GLY   5  -0.208  -0.019  -7.672
   28    HA3  GLY   5           HA3      GLY   5  -1.575   1.095  -7.480
   29    H    ILE   6           H        ILE   6   0.409   2.304  -6.605
   30    HA   ILE   6           HA       ILE   6   1.037   1.603  -3.799
   31    HB   ILE   6           HB       ILE   6   2.110   3.827  -5.590
   32   HG12  ILE   6          HG12      ILE   6   2.880   1.673  -6.354
   33   HG13  ILE   6          HG13      ILE   6   4.222   2.540  -5.598
   34   HG21  ILE   6          HG21      ILE   6   3.929   3.966  -3.765
   35   HG22  ILE   6          HG22      ILE   6   2.756   3.131  -2.718
   36   HG23  ILE   6          HG23      ILE   6   2.350   4.714  -3.425
   37   HD11  ILE   6          HD11      ILE   6   4.291   0.171  -5.016
   38   HD12  ILE   6          HD12      ILE   6   3.951   1.141  -3.563
   39   HD13  ILE   6          HD13      ILE   6   2.635   0.255  -4.370
   40    H    VAL   7           H        VAL   7   0.604   2.880  -2.050
   41    HA   VAL   7           HA       VAL   7  -1.250   5.165  -2.484
   42    HB   VAL   7           HB       VAL   7  -2.522   4.427  -0.412
   43   HG11  VAL   7          HG11      VAL   7  -3.407   4.250  -2.703
   44   HG12  VAL   7          HG12      VAL   7  -4.001   2.948  -1.644
   45   HG13  VAL   7          HG13      VAL   7  -2.717   2.614  -2.831
   46   HG21  VAL   7          HG21      VAL   7  -0.909   2.745   0.424
   47   HG22  VAL   7          HG22      VAL   7  -1.252   1.728  -0.997
   48   HG23  VAL   7          HG23      VAL   7  -2.536   2.062   0.190
   49    H    ASP   8           H        ASP   8  -1.078   6.859  -1.132
   50    HA   ASP   8           HA       ASP   8   1.293   6.880   0.648
   51    HB2  ASP   8           HB2      ASP   8  -0.520   9.062  -0.436
   52    HB3  ASP   8           HB3      ASP   8   0.754   9.367   0.761
   53    H    ALA   9           H        ALA   9  -1.587   5.715   1.015
   54    HA   ALA   9           HA       ALA   9  -1.919   6.671   3.812
   55    HB1  ALA   9           HB1      ALA   9  -3.559   7.725   2.103
   56    HB2  ALA   9           HB2      ALA   9  -4.311   6.113   2.053
   57    HB3  ALA   9           HB3      ALA   9  -4.232   7.010   3.588
   58    H    CYS  10           H        CYS  10  -4.202   5.069   4.372
   59    HA   CYS  10           HA       CYS  10  -3.579   2.277   3.718
   60    HB2  CYS  10           HB3      CYS  10  -1.974   2.766   5.556
   61    HB3  CYS  10           HB2      CYS  10  -3.329   3.263   6.582
   62    H    SER  11           H        SER  11  -5.364   4.630   5.697
   63    HA   SER  11           HA       SER  11  -7.670   2.820   5.995
   64    HB2  SER  11           HB3      SER  11  -7.269   5.711   6.851
   65    HB3  SER  11           HB2      SER  11  -8.656   4.685   7.276
   66    HG   SER  11           HG       SER  11  -7.038   4.718   8.921
   67    H    GLU  12           H        GLU  12  -6.524   5.166   3.778
   68    HA   GLU  12           HA       GLU  12  -9.190   5.913   2.767
   69    HB2  GLU  12           HB2      GLU  12  -6.366   6.623   1.950
   70    HB3  GLU  12           HB3      GLU  12  -7.778   7.105   0.995
   71    HG2  GLU  12           HG3      GLU  12  -8.668   8.323   2.948
   72    HG3  GLU  12           HG2      GLU  12  -7.244   7.839   3.888
   73    H    CYS  13           H        CYS  13  -6.584   3.666   2.051
   74    HA   CYS  13           HA       CYS  13  -7.514   2.993  -0.632
   75    HB2  CYS  13           HB3      CYS  13  -5.137   2.730   0.364
   76    HB3  CYS  13           HB2      CYS  13  -5.766   1.254   1.116
   77    H    CYS  14           H        CYS  14  -7.984   0.554  -1.106
   78    HA   CYS  14           HA       CYS  14 -10.422  -0.107   0.348
   79    HB2  CYS  14           HB2      CYS  14  -9.017  -1.722  -1.791
   80    HB3  CYS  14           HB3      CYS  14 -10.711  -1.847  -1.294
   81    H    GLU  15           H        GLU  15  -7.276  -0.653   1.170
   82    HA   GLU  15           HA       GLU  15  -7.855  -3.326   2.365
   83    HB2  GLU  15           HB2      GLU  15  -5.317  -1.972   1.482
   84    HB3  GLU  15           HB3      GLU  15  -5.258  -3.227   2.731
   85    HG2  GLU  15           HG2      GLU  15  -6.674  -3.737   0.127
   86    HG3  GLU  15           HG3      GLU  15  -4.906  -3.857   0.221
   87    HA   PRO  16           HA       PRO  16  -7.886  -0.488   6.015
   88    HB2  PRO  16           HB2      PRO  16 -10.101  -2.078   7.078
   89    HB3  PRO  16           HB3      PRO  16 -10.108  -0.374   6.544
   90    HG2  PRO  16           HG2      PRO  16 -11.430  -2.391   5.248
   91    HG3  PRO  16           HG3      PRO  16 -10.852  -0.897   4.459
   92    HD2  PRO  16           HD3      PRO  16  -9.609  -3.640   4.492
   93    HD3  PRO  16           HD2      PRO  16  -9.765  -2.480   3.135
   94    H    ASP  17           H        ASP  17  -6.628  -0.838   7.737
   95    HA   ASP  17           HA       ASP  17  -5.430  -1.841   9.417
   96    HB2  ASP  17           HB2      ASP  17  -7.679  -3.869   9.304
   97    HB3  ASP  17           HB3      ASP  17  -6.379  -3.918  10.510
   98    H    LYS  18           H        LYS  18  -5.456  -2.993   6.385
   99    HA   LYS  18           HA       LYS  18  -3.249  -4.895   6.963
  100    HB2  LYS  18           HB2      LYS  18  -5.662  -5.447   5.218
  101    HB3  LYS  18           HB3      LYS  18  -4.134  -6.322   5.023
  102    HG2  LYS  18           HG2      LYS  18  -4.295  -7.100   7.361
  103    HG3  LYS  18           HG3      LYS  18  -5.839  -6.239   7.534
  104    HD2  LYS  18           HD2      LYS  18  -6.810  -7.620   5.742
  105    HD3  LYS  18           HD3      LYS  18  -5.265  -8.476   5.558
  106    HE2  LYS  18           HE3      LYS  18  -5.435  -9.266   7.892
  107    HE3  LYS  18           HE2      LYS  18  -6.985  -8.415   8.060
  108    HZ1  LYS  18           HZ1      LYS  18  -7.296 -10.737   7.571
  109    HZ2  LYS  18           HZ2      LYS  18  -7.875  -9.817   6.331
  110    HZ3  LYS  18           HZ3      LYS  18  -6.437 -10.608   6.169
  111    H    CYS  19           H        CYS  19  -1.882  -3.190   6.409
  112    HA   CYS  19           HA       CYS  19  -1.773  -2.636   3.472
  113    HB2  CYS  19           HB2      CYS  19  -1.030  -0.783   5.757
  114    HB3  CYS  19           HB3      CYS  19  -0.763  -0.442   4.040
  115    H    ILE  20           H        ILE  20   0.075  -3.067   2.465
  116    HA   ILE  20           HA       ILE  20   2.333  -4.097   4.103
  117    HB   ILE  20           HB       ILE  20   2.183  -4.251   1.071
  118   HG12  ILE  20          HG12      ILE  20   1.391  -6.730   1.761
  119   HG13  ILE  20          HG13      ILE  20   0.625  -5.824   3.076
  120   HG21  ILE  20          HG21      ILE  20   4.324  -4.806   2.184
  121   HG22  ILE  20          HG22      ILE  20   3.489  -6.052   3.143
  122   HG23  ILE  20          HG23      ILE  20   3.604  -6.219   1.374
  123   HD11  ILE  20          HD11      ILE  20  -0.915  -6.140   1.201
  124   HD12  ILE  20          HD12      ILE  20  -0.536  -4.415   1.421
  125   HD13  ILE  20          HD13      ILE  20   0.235  -5.336   0.106
  126    H    ILE  21           H        ILE  21   4.513  -3.464   3.641
  127    HA   ILE  21           HA       ILE  21   4.660  -0.614   2.794
  128    HB   ILE  21           HB       ILE  21   6.926  -2.038   4.211
  129   HG12  ILE  21          HG12      ILE  21   5.758  -0.804   6.296
  130   HG13  ILE  21          HG13      ILE  21   4.299  -1.241   5.390
  131   HG21  ILE  21          HG21      ILE  21   6.198   0.738   4.904
  132   HG22  ILE  21          HG22      ILE  21   7.781   0.032   4.500
  133   HG23  ILE  21          HG23      ILE  21   6.656   0.499   3.201
  134   HD11  ILE  21          HD11      ILE  21   4.858  -2.949   7.050
  135   HD12  ILE  21          HD12      ILE  21   6.466  -3.153   6.316
  136   HD13  ILE  21          HD13      ILE  21   5.007  -3.601   5.401
  137    H    MET  22           H        MET  22   5.079  -0.404   0.748
  138    HA   MET  22           HA       MET  22   5.921  -0.632  -1.357
  139    HB2  MET  22           HB2      MET  22   8.286  -0.448  -1.622
  140    HB3  MET  22           HB3      MET  22   7.795   0.497  -0.211
  141    HG2  MET  22           HG3      MET  22   8.778  -2.294   0.245
  142    HG3  MET  22           HG2      MET  22   9.959  -1.057  -0.225
  143    HE1  MET  22           HE1      MET  22  10.518  -1.408   3.656
  144    HE2  MET  22           HE2      MET  22  10.079  -2.707   2.521
  145    HE3  MET  22           HE3      MET  22  11.280  -1.480   2.049
  146    H    LEU  23           H        LEU  23   6.568  -1.902  -3.094
  147    HA   LEU  23           HA       LEU  23   7.352  -4.692  -2.556
  148    HB2  LEU  23           HB2      LEU  23   5.180  -5.336  -2.622
  149    HB3  LEU  23           HB3      LEU  23   4.656  -3.921  -3.542
  150    HG   LEU  23           HG       LEU  23   6.012  -5.176  -5.488
  151   HD11  LEU  23          HD11      LEU  23   6.720  -7.034  -4.030
  152   HD12  LEU  23          HD12      LEU  23   5.014  -7.440  -3.729
  153   HD13  LEU  23          HD13      LEU  23   5.690  -7.597  -5.368
  154   HD21  LEU  23          HD21      LEU  23   3.650  -4.479  -5.541
  155   HD22  LEU  23          HD22      LEU  23   3.205  -5.935  -4.619
  156   HD23  LEU  23          HD23      LEU  23   3.881  -6.091  -6.258
  157    HA   PRO  24           HA       PRO  24   8.305  -3.918  -7.064
  158    HB2  PRO  24           HB2      PRO  24   7.060  -1.792  -8.454
  159    HB3  PRO  24           HB3      PRO  24   6.501  -3.487  -8.404
  160    HG2  PRO  24           HG2      PRO  24   5.215  -1.203  -7.297
  161    HG3  PRO  24           HG3      PRO  24   4.741  -2.914  -7.128
  162    HD2  PRO  24           HD3      PRO  24   6.254  -1.163  -5.243
  163    HD3  PRO  24           HD2      PRO  24   5.184  -2.557  -4.897
  164    H    THR  25           H        THR  25   9.004  -1.944  -4.789
  165    HA   THR  25           HA       THR  25  11.065  -0.459  -6.303
  166    HB   THR  25           HB       THR  25  10.567   1.628  -4.913
  167    HG1  THR  25           HG1      THR  25   8.913   1.551  -3.617
  168   HG21  THR  25          HG21      THR  25   9.706   0.889  -7.419
  169   HG22  THR  25          HG22      THR  25   9.544   2.516  -6.716
  170   HG23  THR  25          HG23      THR  25   8.185   1.370  -6.629
  171    H    TRP  26           H        TRP  26  12.677   0.588  -4.832
  172    HA   TRP  26           HA       TRP  26  13.322  -1.310  -2.683
  173    HB2  TRP  26           HB2      TRP  26  15.444   0.252  -2.574
  174    HB3  TRP  26           HB3      TRP  26  15.252  -0.965  -3.845
  175    HD1  TRP  26           HD1      TRP  26  14.046   0.162  -6.219
  176    HE1  TRP  26           HE1      TRP  26  14.621   2.379  -7.381
  177    HE3  TRP  26           HE3      TRP  26  16.460   2.464  -2.335
  178    HZ2  TRP  26           HZ2      TRP  26  15.995   4.746  -6.744
  179    HZ3  TRP  26           HZ3      TRP  26  17.406   4.707  -2.707
  180    HH2  TRP  26           HH2      TRP  26  17.175   5.831  -4.883
  181    HA   PRO  27           HA       PRO  27  13.180   2.688   0.044
  182    HB2  PRO  27           HB2      PRO  27  11.321   4.574  -1.296
  183    HB3  PRO  27           HB3      PRO  27  12.972   4.861  -0.676
  184    HG2  PRO  27           HG2      PRO  27  12.433   4.832  -3.306
  185    HG3  PRO  27           HG3      PRO  27  13.972   4.210  -2.643
  186    HD2  PRO  27           HD3      PRO  27  11.500   2.673  -3.457
  187    HD3  PRO  27           HD2      PRO  27  13.212   2.359  -3.886
  188    HA   PRO  28           HA       PRO  28   9.324   1.557   1.994
  189    HB2  PRO  28           HB2      PRO  28   9.027   4.198   3.344
  190    HB3  PRO  28           HB3      PRO  28   9.292   2.580   4.053
  191    HG2  PRO  28           HG2      PRO  28  11.215   4.445   4.044
  192    HG3  PRO  28           HG3      PRO  28  11.578   2.708   3.834
  193    HD2  PRO  28           HD3      PRO  28  11.383   4.878   1.750
  194    HD3  PRO  28           HD2      PRO  28  12.610   3.584   1.926
  195    H    ARG  29           H        ARG  29   7.389   1.363   1.127
  196    HA   ARG  29           HA       ARG  29   5.782   3.755   0.444
  197    HB2  ARG  29           HB3      ARG  29   6.499   1.562  -1.538
  198    HB3  ARG  29           HB2      ARG  29   5.111   2.642  -1.747
  199    HG2  ARG  29           HG2      ARG  29   6.624   4.588  -1.745
  200    HG3  ARG  29           HG3      ARG  29   8.015   3.498  -1.570
  201    HD2  ARG  29           HD3      ARG  29   7.436   2.420  -3.710
  202    HD3  ARG  29           HD2      ARG  29   6.041   3.506  -3.877
  203    HE   ARG  29           HE       ARG  29   8.494   4.986  -3.536
  204   HH11  ARG  29          HH11      ARG  29   6.599   3.206  -5.947
  205   HH12  ARG  29          HH12      ARG  29   7.276   4.098  -7.290
  206   HH21  ARG  29          HH21      ARG  29   9.342   6.112  -5.296
  207   HH22  ARG  29          HH22      ARG  29   8.821   5.735  -6.923
  208    H    TYR  30           H        TYR  30   3.718   2.199  -0.891
  209    HA   TYR  30           HA       TYR  30   2.872   0.221   1.156
  210    HB2  TYR  30           HB2      TYR  30   1.279   2.688   0.392
  211    HB3  TYR  30           HB3      TYR  30   0.597   1.293   1.245
  212    HD1  TYR  30           HD1      TYR  30   2.753   4.248   1.527
  213    HD2  TYR  30           HD2      TYR  30   1.228   0.843   3.584
  214    HE1  TYR  30           HE1      TYR  30   3.456   5.227   3.666
  215    HE2  TYR  30           HE2      TYR  30   1.929   1.820   5.725
  216    HH   TYR  30           HH       TYR  30   4.078   4.268   6.014
  217    H    VAL  31           H        VAL  31   1.308  -1.246   0.460
  218    HA   VAL  31           HA       VAL  31   0.618  -1.113  -2.444
  219    HB   VAL  31           HB       VAL  31   1.149  -3.793  -1.169
  220   HG11  VAL  31          HG11      VAL  31   0.076  -3.637  -3.390
  221   HG12  VAL  31          HG12      VAL  31   1.503  -2.769  -4.005
  222   HG13  VAL  31          HG13      VAL  31   1.655  -4.456  -3.460
  223   HG21  VAL  31          HG21      VAL  31   3.498  -3.639  -2.222
  224   HG22  VAL  31          HG22      VAL  31   3.231  -2.851  -0.649
  225   HG23  VAL  31          HG23      VAL  31   3.269  -1.876  -2.138
  226    H    CYS  32           H        CYS  32  -1.318  -2.062  -3.060
  227    HA   CYS  32           HA       CYS  32  -3.139  -2.877  -0.837
  228    HB2  CYS  32           HB2      CYS  32  -3.624  -0.930  -3.093
  229    HB3  CYS  32           HB3      CYS  32  -4.961  -1.761  -2.281
  230    H    SER  33           H        SER  33  -4.221  -4.711  -1.150
  231    HA   SER  33           HA       SER  33  -4.285  -5.844  -3.919
  232    HB2  SER  33           HB2      SER  33  -3.671  -7.245  -1.303
  233    HB3  SER  33           HB3      SER  33  -4.030  -8.096  -2.820
  234    HG   SER  33           HG       SER  33  -1.768  -7.799  -2.481
  235    H    VAL  34           H        VAL  34  -6.198  -4.384  -2.044
  236    HA   VAL  34           HA       VAL  34  -8.363  -4.401  -1.351
  237    HB   VAL  34           HB       VAL  34  -8.582  -4.341  -3.832
  238   HG11  VAL  34          HG11      VAL  34  -9.785  -6.409  -4.836
  239   HG12  VAL  34          HG12      VAL  34  -8.009  -6.393  -4.732
  240   HG13  VAL  34          HG13      VAL  34  -8.962  -7.306  -3.538
  241   HG21  VAL  34          HG21      VAL  34 -10.478  -3.929  -2.307
  242   HG22  VAL  34          HG22      VAL  34 -10.982  -4.605  -3.875
  243   HG23  VAL  34          HG23      VAL  34 -10.928  -5.647  -2.432
  Start of MODEL    4
    1    H1   CYS   1           H1       CYS   1 -11.771   4.142  -6.394
    2    H2   CYS   1           H2       CYS   1 -12.344   2.597  -6.455
    3    H3   CYS   1           H3       CYS   1 -13.011   3.683  -5.408
    4    HA   CYS   1           HA       CYS   1 -11.000   3.827  -4.147
    5    HB2  CYS   1           HB3      CYS   1 -12.748   2.095  -3.641
    6    HB3  CYS   1           HB2      CYS   1 -11.815   0.942  -4.610
    7    H    VAL   2           H        VAL   2  -8.953   2.625  -3.614
    8    HA   VAL   2           HA       VAL   2  -7.436   2.163  -6.134
    9    HB   VAL   2           HB       VAL   2  -6.215   2.705  -3.399
   10   HG11  VAL   2          HG11      VAL   2  -5.210   2.487  -6.198
   11   HG12  VAL   2          HG12      VAL   2  -4.445   2.016  -4.662
   12   HG13  VAL   2          HG13      VAL   2  -4.464   3.725  -5.159
   13   HG21  VAL   2          HG21      VAL   2  -7.706   4.590  -3.975
   14   HG22  VAL   2          HG22      VAL   2  -6.861   4.769  -5.531
   15   HG23  VAL   2          HG23      VAL   2  -5.989   5.058  -4.006
   16    H    SER   3           H        SER   3  -8.500   0.056  -6.162
   17    HA   SER   3           HA       SER   3  -7.944  -1.967  -4.194
   18    HB2  SER   3           HB2      SER   3  -8.732  -2.225  -7.115
   19    HB3  SER   3           HB3      SER   3  -8.767  -3.537  -5.918
   20    HG   SER   3           HG       SER   3 -10.819  -2.513  -6.175
   21    H    SER   4           H        SER   4  -6.292  -0.978  -7.189
   22    HA   SER   4           HA       SER   4  -4.036  -2.774  -6.419
   23    HB2  SER   4           HB2      SER   4  -3.639  -3.178  -8.866
   24    HB3  SER   4           HB3      SER   4  -5.125  -3.917  -8.234
   25    HG   SER   4           HG       SER   4  -5.459  -2.823 -10.238
   26    H    GLY   5           H        GLY   5  -2.077  -1.885  -6.441
   27    HA2  GLY   5           HA3      GLY   5  -0.602  -0.306  -7.811
   28    HA3  GLY   5           HA2      GLY   5  -1.874   0.894  -7.518
   29    H    ILE   6           H        ILE   6   0.226   1.963  -6.730
   30    HA   ILE   6           HA       ILE   6   0.891   1.163  -3.949
   31    HB   ILE   6           HB       ILE   6   2.175   3.253  -5.763
   32   HG12  ILE   6          HG12      ILE   6   2.669   1.036  -6.568
   33   HG13  ILE   6          HG13      ILE   6   4.120   1.720  -5.826
   34   HG21  ILE   6          HG21      ILE   6   4.040   3.151  -3.979
   35   HG22  ILE   6          HG22      ILE   6   2.572   4.083  -3.600
   36   HG23  ILE   6          HG23      ILE   6   2.796   2.456  -2.912
   37   HD11  ILE   6          HD11      ILE   6   3.870  -0.666  -5.294
   38   HD12  ILE   6          HD12      ILE   6   3.754   0.327  -3.822
   39   HD13  ILE   6          HD13      ILE   6   2.280  -0.346  -4.561
   40    H    VAL   7           H        VAL   7   0.650   2.463  -2.199
   41    HA   VAL   7           HA       VAL   7  -0.789   5.029  -2.542
   42    HB   VAL   7           HB       VAL   7  -2.319   4.416  -0.609
   43   HG11  VAL   7          HG11      VAL   7  -2.717   4.286  -3.252
   44   HG12  VAL   7          HG12      VAL   7  -3.035   2.584  -2.837
   45   HG13  VAL   7          HG13      VAL   7  -3.976   3.881  -2.061
   46   HG21  VAL   7          HG21      VAL   7  -0.941   2.301  -0.032
   47   HG22  VAL   7          HG22      VAL   7  -2.717   2.198   0.041
   48   HG23  VAL   7          HG23      VAL   7  -1.843   1.528  -1.357
   49    H    ASP   8           H        ASP   8  -0.418   6.546  -0.999
   50    HA   ASP   8           HA       ASP   8   1.857   5.998   0.812
   51    HB2  ASP   8           HB3      ASP   8   0.413   8.544  -0.006
   52    HB3  ASP   8           HB2      ASP   8   1.696   8.499   1.218
   53    H    ALA   9           H        ALA   9  -1.172   5.228   1.047
   54    HA   ALA   9           HA       ALA   9  -1.366   5.822   3.948
   55    HB1  ALA   9           HB1      ALA   9  -2.733   7.461   2.437
   56    HB2  ALA   9           HB2      ALA   9  -3.516   6.727   3.857
   57    HB3  ALA   9           HB3      ALA   9  -3.833   6.077   2.231
   58    H    CYS  10           H        CYS  10  -3.792   4.674   4.498
   59    HA   CYS  10           HA       CYS  10  -3.849   1.958   3.331
   60    HB2  CYS  10           HB2      CYS  10  -2.997   2.601   6.132
   61    HB3  CYS  10           HB3      CYS  10  -4.013   1.173   5.874
   62    H    SER  11           H        SER  11  -5.137   4.300   5.687
   63    HA   SER  11           HA       SER  11  -7.743   3.017   5.887
   64    HB2  SER  11           HB3      SER  11  -6.835   5.806   6.690
   65    HB3  SER  11           HB2      SER  11  -8.377   5.047   7.140
   66    HG   SER  11           HG       SER  11  -6.765   4.819   8.775
   67    H    GLU  12           H        GLU  12  -6.231   5.310   3.764
   68    HA   GLU  12           HA       GLU  12  -8.784   6.287   2.652
   69    HB2  GLU  12           HB2      GLU  12  -5.874   6.859   2.048
   70    HB3  GLU  12           HB3      GLU  12  -7.192   7.477   1.037
   71    HG2  GLU  12           HG2      GLU  12  -8.129   8.652   2.987
   72    HG3  GLU  12           HG3      GLU  12  -6.807   8.033   3.996
   73    H    CYS  13           H        CYS  13  -6.303   3.902   2.022
   74    HA   CYS  13           HA       CYS  13  -7.173   3.396  -0.743
   75    HB2  CYS  13           HB3      CYS  13  -4.783   3.166   0.128
   76    HB3  CYS  13           HB2      CYS  13  -5.330   1.707   0.971
   77    H    CYS  14           H        CYS  14  -7.496   0.912  -1.269
   78    HA   CYS  14           HA       CYS  14  -9.983   0.130  -0.040
   79    HB2  CYS  14           HB3      CYS  14  -8.253  -0.785  -2.236
   80    HB3  CYS  14           HB2      CYS  14  -9.120  -2.091  -1.413
   81    H    GLU  15           H        GLU  15  -6.715  -0.457   0.836
   82    HA   GLU  15           HA       GLU  15  -7.542  -2.757   2.556
   83    HB2  GLU  15           HB2      GLU  15  -4.865  -2.023   1.341
   84    HB3  GLU  15           HB3      GLU  15  -5.018  -3.191   2.664
   85    HG2  GLU  15           HG2      GLU  15  -6.564  -3.494   0.087
   86    HG3  GLU  15           HG3      GLU  15  -4.897  -4.078   0.245
   87    HA   PRO  16           HA       PRO  16  -6.809   0.650   5.567
   88    HB2  PRO  16           HB3      PRO  16  -8.763  -0.720   7.288
   89    HB3  PRO  16           HB2      PRO  16  -8.867   0.900   6.544
   90    HG2  PRO  16           HG2      PRO  16 -10.433  -1.198   5.801
   91    HG3  PRO  16           HG3      PRO  16  -9.951   0.114   4.690
   92    HD2  PRO  16           HD3      PRO  16  -8.803  -2.656   4.979
   93    HD3  PRO  16           HD2      PRO  16  -9.170  -1.730   3.490
   94    H    ASP  17           H        ASP  17  -7.212  -2.826   6.349
   95    HA   ASP  17           HA       ASP  17  -5.044  -2.532   8.393
   96    HB2  ASP  17           HB2      ASP  17  -7.497  -4.309   8.403
   97    HB3  ASP  17           HB3      ASP  17  -6.113  -4.567   9.482
   98    H    LYS  18           H        LYS  18  -6.318  -4.326   5.664
   99    HA   LYS  18           HA       LYS  18  -4.263  -6.432   5.900
  100    HB2  LYS  18           HB2      LYS  18  -6.576  -5.939   4.017
  101    HB3  LYS  18           HB3      LYS  18  -5.372  -7.202   3.708
  102    HG2  LYS  18           HG2      LYS  18  -5.927  -8.245   5.876
  103    HG3  LYS  18           HG3      LYS  18  -7.146  -6.985   6.163
  104    HD2  LYS  18           HD3      LYS  18  -8.358  -7.702   4.139
  105    HD3  LYS  18           HD2      LYS  18  -7.134  -8.958   3.854
  106    HE2  LYS  18           HE2      LYS  18  -7.703 -10.007   6.004
  107    HE3  LYS  18           HE3      LYS  18  -8.928  -8.756   6.296
  108    HZ1  LYS  18           HZ1      LYS  18  -9.895 -10.757   5.411
  109    HZ2  LYS  18           HZ2      LYS  18 -10.079  -9.522   4.333
  110    HZ3  LYS  18           HZ3      LYS  18  -8.940 -10.685   4.068
  111    H    CYS  19           H        CYS  19  -3.599  -3.522   5.355
  112    HA   CYS  19           HA       CYS  19  -2.463  -3.650   2.625
  113    HB2  CYS  19           HB2      CYS  19  -1.810  -1.325   3.011
  114    HB3  CYS  19           HB3      CYS  19  -3.537  -1.570   3.317
  115    H    ILE  20           H        ILE  20  -0.372  -3.900   2.129
  116    HA   ILE  20           HA       ILE  20   1.458  -4.657   4.337
  117    HB   ILE  20           HB       ILE  20   2.173  -4.832   1.394
  118   HG12  ILE  20          HG12      ILE  20   1.381  -7.362   1.881
  119   HG13  ILE  20          HG13      ILE  20   0.199  -6.502   2.883
  120   HG21  ILE  20          HG21      ILE  20   3.928  -5.237   3.092
  121   HG22  ILE  20          HG22      ILE  20   2.937  -6.540   3.790
  122   HG23  ILE  20          HG23      ILE  20   3.573  -6.695   2.135
  123   HD11  ILE  20          HD11      ILE  20  -0.683  -6.934   0.642
  124   HD12  ILE  20          HD12      ILE  20   0.689  -6.060  -0.079
  125   HD13  ILE  20          HD13      ILE  20  -0.497  -5.186   0.920
  126    H    ILE  21           H        ILE  21   3.611  -3.831   4.473
  127    HA   ILE  21           HA       ILE  21   3.727  -0.973   3.691
  128    HB   ILE  21           HB       ILE  21   5.684  -2.380   5.552
  129   HG12  ILE  21          HG13      ILE  21   4.101  -1.051   7.290
  130   HG13  ILE  21          HG12      ILE  21   2.888  -1.491   6.076
  131   HG21  ILE  21          HG21      ILE  21   6.322  -0.151   4.686
  132   HG22  ILE  21          HG22      ILE  21   6.049  -0.134   6.445
  133   HG23  ILE  21          HG23      ILE  21   4.813   0.525   5.347
  134   HD11  ILE  21          HD11      ILE  21   2.997  -3.159   7.862
  135   HD12  ILE  21          HD12      ILE  21   4.723  -3.424   7.520
  136   HD13  ILE  21          HD13      ILE  21   3.498  -3.857   6.304
  137    H    MET  22           H        MET  22   4.255  -1.073   1.571
  138    HA   MET  22           HA       MET  22   5.465  -1.331  -0.352
  139    HB2  MET  22           HB3      MET  22   7.736  -0.474  -0.307
  140    HB3  MET  22           HB2      MET  22   6.655   0.497   0.699
  141    HG2  MET  22           HG3      MET  22   8.587   0.400   1.973
  142    HG3  MET  22           HG2      MET  22   7.583  -0.880   2.681
  143    HE1  MET  22           HE1      MET  22  11.221  -2.338   3.004
  144    HE2  MET  22           HE2      MET  22  10.735  -0.633   3.156
  145    HE3  MET  22           HE3      MET  22   9.724  -1.912   3.868
  146    H    LEU  23           H        LEU  23   6.251  -2.796  -1.713
  147    HA   LEU  23           HA       LEU  23   7.915  -4.984  -0.584
  148    HB2  LEU  23           HB3      LEU  23   6.083  -6.300  -0.646
  149    HB3  LEU  23           HB2      LEU  23   5.224  -5.229  -1.758
  150    HG   LEU  23           HG       LEU  23   6.992  -6.262  -3.493
  151   HD11  LEU  23          HD11      LEU  23   8.087  -7.667  -1.790
  152   HD12  LEU  23          HD12      LEU  23   7.327  -8.647  -3.067
  153   HD13  LEU  23          HD13      LEU  23   6.538  -8.488  -1.479
  154   HD21  LEU  23          HD21      LEU  23   4.536  -6.252  -3.695
  155   HD22  LEU  23          HD22      LEU  23   5.235  -7.812  -4.189
  156   HD23  LEU  23          HD23      LEU  23   4.446  -7.654  -2.602
  157    HA   PRO  24           HA       PRO  24   9.088  -4.794  -5.129
  158    HB2  PRO  24           HB2      PRO  24   7.454  -3.223  -6.883
  159    HB3  PRO  24           HB3      PRO  24   7.456  -5.000  -6.713
  160    HG2  PRO  24           HG3      PRO  24   5.367  -3.263  -6.021
  161    HG3  PRO  24           HG2      PRO  24   5.524  -4.976  -5.544
  162    HD2  PRO  24           HD2      PRO  24   6.165  -2.491  -3.986
  163    HD3  PRO  24           HD3      PRO  24   5.526  -4.068  -3.426
  164    H    THR  25           H        THR  25   9.125  -2.452  -3.162
  165    HA   THR  25           HA       THR  25  10.844  -0.680  -4.787
  166    HB   THR  25           HB       THR  25   9.738   1.348  -3.648
  167    HG1  THR  25           HG1      THR  25   8.115   0.875  -2.393
  168   HG21  THR  25          HG21      THR  25   8.027   1.567  -5.408
  169   HG22  THR  25          HG22      THR  25   9.552   0.917  -6.058
  170   HG23  THR  25          HG23      THR  25   8.174  -0.171  -5.765
  171    H    TRP  26           H        TRP  26  12.479   0.281  -3.670
  172    HA   TRP  26           HA       TRP  26  13.165  -0.864  -1.099
  173    HB2  TRP  26           HB3      TRP  26  14.666   1.519  -2.096
  174    HB3  TRP  26           HB2      TRP  26  15.257   0.002  -1.397
  175    HD1  TRP  26           HD1      TRP  26  13.741   1.280  -4.744
  176    HE1  TRP  26           HE1      TRP  26  14.620  -0.164  -6.672
  177    HE3  TRP  26           HE3      TRP  26  16.520  -2.043  -2.013
  178    HZ2  TRP  26           HZ2      TRP  26  16.337  -2.368  -6.985
  179    HZ3  TRP  26           HZ3      TRP  26  17.778  -3.785  -3.216
  180    HH2  TRP  26           HH2      TRP  26  17.687  -3.941  -5.669
  181    HA   PRO  27           HA       PRO  27  12.479   3.589   0.712
  182    HB2  PRO  27           HB3      PRO  27  10.630   4.966  -1.166
  183    HB3  PRO  27           HB2      PRO  27  12.157   5.556  -0.451
  184    HG2  PRO  27           HG2      PRO  27  11.958   4.948  -3.054
  185    HG3  PRO  27           HG3      PRO  27  13.446   4.618  -2.120
  186    HD2  PRO  27           HD3      PRO  27  11.220   2.722  -2.876
  187    HD3  PRO  27           HD2      PRO  27  12.991   2.493  -3.015
  188    HA   PRO  28           HA       PRO  28   8.580   2.610   2.668
  189    HB2  PRO  28           HB3      PRO  28   7.923   5.522   2.993
  190    HB3  PRO  28           HB2      PRO  28   8.054   4.242   4.233
  191    HG2  PRO  28           HG2      PRO  28   9.947   6.091   3.972
  192    HG3  PRO  28           HG3      PRO  28  10.366   4.389   4.315
  193    HD2  PRO  28           HD3      PRO  28  10.503   5.900   1.714
  194    HD3  PRO  28           HD2      PRO  28  11.669   4.733   2.412
  195    H    ARG  29           H        ARG  29   6.926   1.805   1.589
  196    HA   ARG  29           HA       ARG  29   5.036   3.582   0.190
  197    HB2  ARG  29           HB3      ARG  29   6.776   1.574  -1.197
  198    HB3  ARG  29           HB2      ARG  29   5.088   1.715  -1.721
  199    HG2  ARG  29           HG2      ARG  29   5.375   4.069  -2.201
  200    HG3  ARG  29           HG3      ARG  29   7.026   4.040  -1.547
  201    HD2  ARG  29           HD3      ARG  29   7.757   2.559  -3.318
  202    HD3  ARG  29           HD2      ARG  29   6.092   2.386  -3.912
  203    HE   ARG  29           HE       ARG  29   6.191   4.845  -4.450
  204   HH11  ARG  29          HH11      ARG  29   9.203   2.984  -4.217
  205   HH12  ARG  29          HH12      ARG  29  10.076   4.074  -5.272
  206   HH21  ARG  29          HH21      ARG  29   7.354   6.220  -5.803
  207   HH22  ARG  29          HH22      ARG  29   9.035   5.893  -6.163
  208    H    TYR  30           H        TYR  30   3.435   1.649  -1.019
  209    HA   TYR  30           HA       TYR  30   2.751  -0.424   0.961
  210    HB2  TYR  30           HB3      TYR  30   0.901   1.924   0.393
  211    HB3  TYR  30           HB2      TYR  30   0.373   0.400   1.123
  212    HD1  TYR  30           HD1      TYR  30   2.030   3.584   1.704
  213    HD2  TYR  30           HD2      TYR  30   1.202  -0.239   3.395
  214    HE1  TYR  30           HE1      TYR  30   2.605   4.446   3.931
  215    HE2  TYR  30           HE2      TYR  30   1.780   0.621   5.622
  216    HH   TYR  30           HH       TYR  30   3.458   3.376   6.156
  217    H    VAL  31           H        VAL  31   1.148  -1.910   0.196
  218    HA   VAL  31           HA       VAL  31   0.497  -1.652  -2.707
  219    HB   VAL  31           HB       VAL  31   1.256  -4.311  -1.438
  220   HG11  VAL  31          HG11      VAL  31  -0.160  -4.390  -3.465
  221   HG12  VAL  31          HG12      VAL  31   1.455  -5.086  -3.743
  222   HG13  VAL  31          HG13      VAL  31   1.072  -3.456  -4.347
  223   HG21  VAL  31          HG21      VAL  31   3.227  -2.824  -1.381
  224   HG22  VAL  31          HG22      VAL  31   3.431  -4.172  -2.526
  225   HG23  VAL  31          HG23      VAL  31   3.049  -2.541  -3.130
  226    H    CYS  32           H        CYS  32  -1.600  -1.688  -3.018
  227    HA   CYS  32           HA       CYS  32  -3.347  -2.949  -0.963
  228    HB2  CYS  32           HB2      CYS  32  -3.797  -0.843  -3.078
  229    HB3  CYS  32           HB3      CYS  32  -5.153  -1.680  -2.306
  230    H    SER  33           H        SER  33  -4.544  -4.693  -1.368
  231    HA   SER  33           HA       SER  33  -4.787  -5.619  -4.200
  232    HB2  SER  33           HB3      SER  33  -2.973  -6.821  -2.894
  233    HB3  SER  33           HB2      SER  33  -4.260  -7.456  -1.847
  234    HG   SER  33           HG       SER  33  -3.734  -8.889  -3.577
  235    H    VAL  34           H        VAL  34  -6.449  -4.335  -1.942
  236    HA   VAL  34           HA       VAL  34  -8.523  -4.417  -1.002
  237    HB   VAL  34           HB       VAL  34  -9.008  -3.854  -3.358
  238   HG11  VAL  34          HG11      VAL  34 -10.288  -5.622  -4.712
  239   HG12  VAL  34          HG12      VAL  34  -8.511  -5.708  -4.686
  240   HG13  VAL  34          HG13      VAL  34  -9.470  -6.815  -3.674
  241   HG21  VAL  34          HG21      VAL  34 -10.755  -3.790  -1.618
  242   HG22  VAL  34          HG22      VAL  34 -11.404  -4.117  -3.243
  243   HG23  VAL  34          HG23      VAL  34 -11.237  -5.444  -2.068
  Start of MODEL    5
    1    H1   CYS   1           H1       CYS   1 -12.278   3.250  -6.417
    2    H2   CYS   1           H2       CYS   1 -13.222   3.311  -5.067
    3    H3   CYS   1           H3       CYS   1 -12.498   1.895  -5.503
    4    HA   CYS   1           HA       CYS   1 -11.135   4.343  -4.617
    5    HB2  CYS   1           HB3      CYS   1 -10.518   3.025  -2.638
    6    HB3  CYS   1           HB2      CYS   1 -12.274   3.185  -2.802
    7    H    VAL   2           H        VAL   2  -8.820   3.416  -3.743
    8    HA   VAL   2           HA       VAL   2  -7.447   2.584  -6.197
    9    HB   VAL   2           HB       VAL   2  -6.171   3.067  -3.473
   10   HG11  VAL   2          HG11      VAL   2  -4.749   1.994  -5.189
   11   HG12  VAL   2          HG12      VAL   2  -5.059   3.362  -6.285
   12   HG13  VAL   2          HG13      VAL   2  -4.174   3.623  -4.762
   13   HG21  VAL   2          HG21      VAL   2  -7.554   5.024  -4.079
   14   HG22  VAL   2          HG22      VAL   2  -5.813   5.394  -4.113
   15   HG23  VAL   2          HG23      VAL   2  -6.697   5.133  -5.636
   16    H    SER   3           H        SER   3  -8.816   0.549  -5.995
   17    HA   SER   3           HA       SER   3  -8.318  -1.515  -4.138
   18    HB2  SER   3           HB3      SER   3  -9.027  -1.731  -7.084
   19    HB3  SER   3           HB2      SER   3  -9.180  -3.033  -5.885
   20    HG   SER   3           HG       SER   3 -11.156  -1.885  -6.205
   21    H    SER   4           H        SER   4  -6.532  -0.694  -7.117
   22    HA   SER   4           HA       SER   4  -4.402  -2.585  -6.232
   23    HB2  SER   4           HB2      SER   4  -3.983  -3.129  -8.644
   24    HB3  SER   4           HB3      SER   4  -5.528  -3.743  -8.016
   25    HG   SER   4           HG       SER   4  -5.747  -2.724 -10.076
   26    H    GLY   5           H        GLY   5  -2.314  -1.964  -6.561
   27    HA2  GLY   5           HA2      GLY   5  -0.791  -0.478  -7.900
   28    HA3  GLY   5           HA3      GLY   5  -1.960   0.822  -7.598
   29    H    ILE   6           H        ILE   6   0.087   1.858  -6.831
   30    HA   ILE   6           HA       ILE   6   0.877   0.987  -4.102
   31    HB   ILE   6           HB       ILE   6   2.125   3.027  -5.991
   32   HG12  ILE   6          HG12      ILE   6   2.513   0.707  -6.664
   33   HG13  ILE   6          HG13      ILE   6   4.012   1.493  -6.154
   34   HG21  ILE   6          HG21      ILE   6   4.036   3.018  -4.283
   35   HG22  ILE   6          HG22      ILE   6   2.863   2.316  -3.143
   36   HG23  ILE   6          HG23      ILE   6   2.566   3.922  -3.851
   37   HD11  ILE   6          HD11      ILE   6   4.015  -0.775  -5.338
   38   HD12  ILE   6          HD12      ILE   6   2.402  -0.573  -4.615
   39   HD13  ILE   6          HD13      ILE   6   3.795   0.306  -3.941
   40    H    VAL   7           H        VAL   7   0.688   2.238  -2.319
   41    HA   VAL   7           HA       VAL   7  -0.653   4.866  -2.567
   42    HB   VAL   7           HB       VAL   7  -2.152   4.276  -0.611
   43   HG11  VAL   7          HG11      VAL   7  -2.959   4.473  -2.931
   44   HG12  VAL   7          HG12      VAL   7  -2.652   2.736  -3.172
   45   HG13  VAL   7          HG13      VAL   7  -3.876   3.268  -1.995
   46   HG21  VAL   7          HG21      VAL   7  -0.996   2.216   0.129
   47   HG22  VAL   7          HG22      VAL   7  -2.724   1.940  -0.196
   48   HG23  VAL   7          HG23      VAL   7  -1.501   1.407  -1.374
   49    H    ASP   8           H        ASP   8  -0.129   6.339  -1.035
   50    HA   ASP   8           HA       ASP   8   2.158   5.628   0.707
   51    HB2  ASP   8           HB3      ASP   8   1.932   7.722  -0.862
   52    HB3  ASP   8           HB2      ASP   8   0.952   8.383   0.460
   53    H    ALA   9           H        ALA   9  -0.875   5.016   1.050
   54    HA   ALA   9           HA       ALA   9  -0.970   5.697   3.937
   55    HB1  ALA   9           HB1      ALA   9  -2.301   7.354   2.441
   56    HB2  ALA   9           HB2      ALA   9  -3.450   6.010   2.242
   57    HB3  ALA   9           HB3      ALA   9  -3.108   6.656   3.865
   58    H    CYS  10           H        CYS  10  -3.544   4.687   4.433
   59    HA   CYS  10           HA       CYS  10  -3.685   1.926   3.420
   60    HB2  CYS  10           HB3      CYS  10  -2.072   1.689   5.256
   61    HB3  CYS  10           HB2      CYS  10  -3.173   2.538   6.353
   62    H    SER  11           H        SER  11  -4.838   4.471   5.609
   63    HA   SER  11           HA       SER  11  -7.510   3.331   5.899
   64    HB2  SER  11           HB3      SER  11  -6.441   6.098   6.567
   65    HB3  SER  11           HB2      SER  11  -8.022   5.449   7.055
   66    HG   SER  11           HG       SER  11  -6.420   5.213   8.697
   67    H    GLU  12           H        GLU  12  -5.864   5.370   3.641
   68    HA   GLU  12           HA       GLU  12  -8.332   6.505   2.498
   69    HB2  GLU  12           HB2      GLU  12  -5.401   6.725   1.775
   70    HB3  GLU  12           HB3      GLU  12  -6.686   7.415   0.770
   71    HG2  GLU  12           HG2      GLU  12  -7.415   8.804   2.668
   72    HG3  GLU  12           HG3      GLU  12  -6.123   8.114   3.670
   73    H    CYS  13           H        CYS  13  -6.052   3.882   1.938
   74    HA   CYS  13           HA       CYS  13  -7.094   3.251  -0.733
   75    HB2  CYS  13           HB3      CYS  13  -4.704   2.815   0.133
   76    HB3  CYS  13           HB2      CYS  13  -5.403   1.448   1.017
   77    H    CYS  14           H        CYS  14  -7.838   0.894  -1.136
   78    HA   CYS  14           HA       CYS  14 -10.248   0.458   0.414
   79    HB2  CYS  14           HB2      CYS  14  -9.157  -1.641  -1.421
   80    HB3  CYS  14           HB3      CYS  14 -10.828  -1.108  -1.181
   81    H    GLU  15           H        GLU  15  -7.022  -0.466   0.890
   82    HA   GLU  15           HA       GLU  15  -7.793  -2.808   2.572
   83    HB2  GLU  15           HB2      GLU  15  -5.915  -2.673   0.607
   84    HB3  GLU  15           HB3      GLU  15  -4.929  -2.236   2.013
   85    HG2  GLU  15           HG3      GLU  15  -5.459  -4.304   3.112
   86    HG3  GLU  15           HG2      GLU  15  -6.672  -4.705   1.881
   87    HA   PRO  16           HA       PRO  16  -6.742   0.509   5.622
   88    HB2  PRO  16           HB2      PRO  16  -8.947  -0.424   7.287
   89    HB3  PRO  16           HB3      PRO  16  -8.795   1.118   6.401
   90    HG2  PRO  16           HG3      PRO  16 -10.597  -0.861   5.784
   91    HG3  PRO  16           HG2      PRO  16  -9.994   0.355   4.624
   92    HD2  PRO  16           HD3      PRO  16  -9.135  -2.504   5.022
   93    HD3  PRO  16           HD2      PRO  16  -9.374  -1.592   3.498
   94    H    ASP  17           H        ASP  17  -7.380  -2.942   6.131
   95    HA   ASP  17           HA       ASP  17  -5.674  -2.823   8.589
   96    HB2  ASP  17           HB2      ASP  17  -8.003  -4.633   7.915
   97    HB3  ASP  17           HB3      ASP  17  -6.860  -4.982   9.225
   98    H    LYS  18           H        LYS  18  -6.447  -4.672   5.643
   99    HA   LYS  18           HA       LYS  18  -4.243  -6.561   6.148
  100    HB2  LYS  18           HB3      LYS  18  -6.316  -6.284   3.958
  101    HB3  LYS  18           HB2      LYS  18  -4.981  -7.443   3.857
  102    HG2  LYS  18           HG2      LYS  18  -6.746  -7.433   6.289
  103    HG3  LYS  18           HG3      LYS  18  -7.319  -8.191   4.789
  104    HD2  LYS  18           HD2      LYS  18  -5.324  -9.632   4.750
  105    HD3  LYS  18           HD3      LYS  18  -4.730  -8.863   6.237
  106    HE2  LYS  18           HE3      LYS  18  -6.762  -9.647   7.424
  107    HE3  LYS  18           HE2      LYS  18  -7.299 -10.452   5.936
  108    HZ1  LYS  18           HZ1      LYS  18  -6.198 -11.973   7.418
  109    HZ2  LYS  18           HZ2      LYS  18  -4.822 -11.064   7.408
  110    HZ3  LYS  18           HZ3      LYS  18  -5.327 -11.811   6.027
  111    H    CYS  19           H        CYS  19  -3.873  -3.540   5.505
  112    HA   CYS  19           HA       CYS  19  -2.460  -3.549   2.947
  113    HB2  CYS  19           HB2      CYS  19  -1.918  -1.249   3.441
  114    HB3  CYS  19           HB3      CYS  19  -3.630  -1.544   3.782
  115    H    ILE  20           H        ILE  20  -0.374  -3.845   2.531
  116    HA   ILE  20           HA       ILE  20   1.439  -4.245   4.868
  117    HB   ILE  20           HB       ILE  20   2.831  -5.667   3.244
  118   HG12  ILE  20          HG12      ILE  20   1.060  -6.873   1.622
  119   HG13  ILE  20          HG13      ILE  20   0.379  -5.237   1.590
  120   HG21  ILE  20          HG21      ILE  20   1.518  -6.553   5.133
  121   HG22  ILE  20          HG22      ILE  20   0.101  -6.698   4.065
  122   HG23  ILE  20          HG23      ILE  20   1.556  -7.675   3.752
  123   HD11  ILE  20          HD11      ILE  20   2.158  -5.968  -0.189
  124   HD12  ILE  20          HD12      ILE  20   2.237  -4.343   0.532
  125   HD13  ILE  20          HD13      ILE  20   3.320  -5.629   1.117
  126    H    ILE  21           H        ILE  21   3.777  -3.887   4.395
  127    HA   ILE  21           HA       ILE  21   4.142  -1.183   3.454
  128    HB   ILE  21           HB       ILE  21   6.522  -2.983   3.865
  129   HG12  ILE  21          HG12      ILE  21   6.095  -2.253   6.426
  130   HG13  ILE  21          HG13      ILE  21   4.413  -2.473   5.912
  131   HG21  ILE  21          HG21      ILE  21   6.792  -0.730   5.443
  132   HG22  ILE  21          HG22      ILE  21   7.416  -0.921   3.788
  133   HG23  ILE  21          HG23      ILE  21   5.844  -0.132   4.060
  134   HD11  ILE  21          HD11      ILE  21   5.309  -4.517   6.914
  135   HD12  ILE  21          HD12      ILE  21   6.625  -4.540   5.716
  136   HD13  ILE  21          HD13      ILE  21   4.940  -4.769   5.191
  137    H    MET  22           H        MET  22   6.187  -0.742   1.993
  138    HA   MET  22           HA       MET  22   5.513  -1.328  -0.670
  139    HB2  MET  22           HB3      MET  22   7.702  -0.392  -1.265
  140    HB3  MET  22           HB2      MET  22   6.882   0.573  -0.031
  141    HG2  MET  22           HG2      MET  22   9.075   0.566   0.710
  142    HG3  MET  22           HG3      MET  22   8.343  -0.733   1.671
  143    HE1  MET  22           HE1      MET  22  12.004  -2.038   1.052
  144    HE2  MET  22           HE2      MET  22  11.497  -0.351   1.311
  145    HE3  MET  22           HE3      MET  22  10.763  -1.658   2.271
  146    H    LEU  23           H        LEU  23   6.512  -2.551  -2.339
  147    HA   LEU  23           HA       LEU  23   8.255  -4.782  -1.466
  148    HB2  LEU  23           HB2      LEU  23   6.495  -6.172  -1.427
  149    HB3  LEU  23           HB3      LEU  23   5.460  -5.073  -2.344
  150    HG   LEU  23           HG       LEU  23   7.056  -5.928  -4.344
  151   HD11  LEU  23          HD11      LEU  23   8.375  -7.392  -2.863
  152   HD12  LEU  23          HD12      LEU  23   6.895  -8.283  -2.435
  153   HD13  LEU  23          HD13      LEU  23   7.504  -8.321  -4.107
  154   HD21  LEU  23          HD21      LEU  23   4.594  -5.994  -4.272
  155   HD22  LEU  23          HD22      LEU  23   5.277  -7.497  -4.937
  156   HD23  LEU  23          HD23      LEU  23   4.668  -7.460  -3.265
  157    HA   PRO  24           HA       PRO  24   8.940  -4.332  -6.101
  158    HB2  PRO  24           HB3      PRO  24   7.103  -2.674  -7.556
  159    HB3  PRO  24           HB2      PRO  24   7.167  -4.458  -7.536
  160    HG2  PRO  24           HG2      PRO  24   5.108  -2.869  -6.510
  161    HG3  PRO  24           HG3      PRO  24   5.388  -4.594  -6.146
  162    HD2  PRO  24           HD3      PRO  24   6.127  -2.161  -4.549
  163    HD3  PRO  24           HD2      PRO  24   5.562  -3.767  -3.986
  164    H    THR  25           H        THR  25   9.149  -2.104  -4.011
  165    HA   THR  25           HA       THR  25  10.678  -0.216  -5.697
  166    HB   THR  25           HB       THR  25   9.685   1.729  -4.345
  167    HG1  THR  25           HG1      THR  25   8.543   0.380  -2.835
  168   HG21  THR  25          HG21      THR  25   7.773   2.009  -5.875
  169   HG22  THR  25          HG22      THR  25   9.214   1.414  -6.734
  170   HG23  THR  25          HG23      THR  25   7.890   0.293  -6.334
  171    H    TRP  26           H        TRP  26  12.137   1.158  -4.464
  172    HA   TRP  26           HA       TRP  26  13.216  -0.314  -2.165
  173    HB2  TRP  26           HB3      TRP  26  14.971   1.679  -2.343
  174    HB3  TRP  26           HB2      TRP  26  15.017   0.261  -3.400
  175    HD1  TRP  26           HD1      TRP  26  13.520   0.724  -5.849
  176    HE1  TRP  26           HE1      TRP  26  13.645   2.778  -7.385
  177    HE3  TRP  26           HE3      TRP  26  15.597   4.034  -2.540
  178    HZ2  TRP  26           HZ2      TRP  26  14.584   5.423  -7.222
  179    HZ3  TRP  26           HZ3      TRP  26  16.109   6.312  -3.326
  180    HH2  TRP  26           HH2      TRP  26  15.605   6.994  -5.635
  181    HA   PRO  27           HA       PRO  27  12.353   3.819   0.175
  182    HB2  PRO  27           HB2      PRO  27  10.249   5.278  -1.313
  183    HB3  PRO  27           HB3      PRO  27  11.842   5.858  -0.749
  184    HG2  PRO  27           HG2      PRO  27  11.289   5.500  -3.361
  185    HG3  PRO  27           HG3      PRO  27  12.913   5.208  -2.675
  186    HD2  PRO  27           HD3      PRO  27  10.735   3.213  -3.307
  187    HD3  PRO  27           HD2      PRO  27  12.479   3.144  -3.715
  188    HA   PRO  28           HA       PRO  28   8.758   2.246   2.283
  189    HB2  PRO  28           HB2      PRO  28   7.749   4.493   3.613
  190    HB3  PRO  28           HB3      PRO  28   9.132   3.508   4.169
  191    HG2  PRO  28           HG2      PRO  28   9.119   6.101   2.663
  192    HG3  PRO  28           HG3      PRO  28  10.165   5.564   4.007
  193    HD2  PRO  28           HD3      PRO  28  11.016   5.548   1.450
  194    HD3  PRO  28           HD2      PRO  28  11.521   4.286   2.615
  195    H    ARG  29           H        ARG  29   7.088   1.593   1.111
  196    HA   ARG  29           HA       ARG  29   4.995   3.552   0.348
  197    HB2  ARG  29           HB3      ARG  29   6.186   1.523  -1.590
  198    HB3  ARG  29           HB2      ARG  29   4.710   2.457  -1.879
  199    HG2  ARG  29           HG3      ARG  29   7.337   3.837  -1.316
  200    HG3  ARG  29           HG2      ARG  29   6.915   3.274  -2.945
  201    HD2  ARG  29           HD2      ARG  29   4.851   4.626  -2.876
  202    HD3  ARG  29           HD3      ARG  29   5.290   5.209  -1.258
  203    HE   ARG  29           HE       ARG  29   7.452   5.757  -3.004
  204   HH11  ARG  29          HH11      ARG  29   4.095   6.792  -2.525
  205   HH12  ARG  29          HH12      ARG  29   4.382   8.383  -3.192
  206   HH21  ARG  29          HH21      ARG  29   7.779   7.820  -3.855
  207   HH22  ARG  29          HH22      ARG  29   6.456   8.962  -3.940
  208    H    TYR  30           H        TYR  30   3.370   1.637  -1.054
  209    HA   TYR  30           HA       TYR  30   2.883  -0.618   0.785
  210    HB2  TYR  30           HB3      TYR  30   0.841   1.616   0.433
  211    HB3  TYR  30           HB2      TYR  30   0.508   0.040   1.165
  212    HD1  TYR  30           HD1      TYR  30   1.514  -0.543   3.374
  213    HD2  TYR  30           HD2      TYR  30   1.934   3.346   1.687
  214    HE1  TYR  30           HE1      TYR  30   2.149   0.342   5.574
  215    HE2  TYR  30           HE2      TYR  30   2.576   4.232   3.883
  216    HH   TYR  30           HH       TYR  30   2.043   2.690   6.717
  217    H    VAL  31           H        VAL  31   1.200  -2.075  -0.017
  218    HA   VAL  31           HA       VAL  31   0.467  -1.620  -2.872
  219    HB   VAL  31           HB       VAL  31   1.313  -4.379  -1.938
  220   HG11  VAL  31          HG11      VAL  31  -0.051  -4.178  -3.992
  221   HG12  VAL  31          HG12      VAL  31   1.196  -3.124  -4.701
  222   HG13  VAL  31          HG13      VAL  31   1.576  -4.821  -4.320
  223   HG21  VAL  31          HG21      VAL  31   3.269  -2.902  -1.618
  224   HG22  VAL  31          HG22      VAL  31   3.514  -4.076  -2.933
  225   HG23  VAL  31          HG23      VAL  31   3.135  -2.379  -3.315
  226    H    CYS  32           H        CYS  32  -1.645  -1.697  -3.080
  227    HA   CYS  32           HA       CYS  32  -3.257  -3.218  -1.102
  228    HB2  CYS  32           HB2      CYS  32  -3.961  -1.097  -3.150
  229    HB3  CYS  32           HB3      CYS  32  -5.185  -2.001  -2.246
  230    H    SER  33           H        SER  33  -3.393  -5.302  -1.636
  231    HA   SER  33           HA       SER  33  -3.711  -6.084  -4.481
  232    HB2  SER  33           HB2      SER  33  -3.134  -7.655  -1.956
  233    HB3  SER  33           HB3      SER  33  -3.391  -8.405  -3.546
  234    HG   SER  33           HG       SER  33  -1.161  -8.022  -3.092
  235    H    VAL  34           H        VAL  34  -5.809  -4.893  -2.611
  236    HA   VAL  34           HA       VAL  34  -7.833  -7.037  -2.555
  237    HB   VAL  34           HB       VAL  34  -9.272  -5.054  -1.622
  238   HG11  VAL  34          HG11      VAL  34  -8.501  -7.021  -0.353
  239   HG12  VAL  34          HG12      VAL  34  -6.964  -6.190  -0.018
  240   HG13  VAL  34          HG13      VAL  34  -8.487  -5.538   0.631
  241   HG21  VAL  34          HG21      VAL  34  -8.194  -3.198  -0.706
  242   HG22  VAL  34          HG22      VAL  34  -7.375  -3.393  -2.274
  243   HG23  VAL  34          HG23      VAL  34  -6.589  -3.963  -0.783
  Start of MODEL    6
    1    H1   CYS   1           H1       CYS   1 -10.794   5.077  -6.529
    2    H2   CYS   1           H2       CYS   1 -12.222   4.601  -5.857
    3    H3   CYS   1           H3       CYS   1 -11.484   3.649  -6.984
    4    HA   CYS   1           HA       CYS   1 -10.459   4.269  -4.298
    5    HB2  CYS   1           HB2      CYS   1 -12.441   2.680  -4.533
    6    HB3  CYS   1           HB3      CYS   1 -11.348   1.588  -5.398
    7    H    VAL   2           H        VAL   2  -8.760   2.411  -3.777
    8    HA   VAL   2           HA       VAL   2  -6.924   2.177  -6.118
    9    HB   VAL   2           HB       VAL   2  -5.939   2.637  -3.276
   10   HG11  VAL   2          HG11      VAL   2  -4.366   1.579  -4.865
   11   HG12  VAL   2          HG12      VAL   2  -3.823   3.197  -4.360
   12   HG13  VAL   2          HG13      VAL   2  -4.560   2.965  -5.964
   13   HG21  VAL   2          HG21      VAL   2  -7.245   4.615  -3.980
   14   HG22  VAL   2          HG22      VAL   2  -5.507   4.972  -3.843
   15   HG23  VAL   2          HG23      VAL   2  -6.244   4.740  -5.447
   16    H    SER   3           H        SER   3  -7.766   0.114  -6.456
   17    HA   SER   3           HA       SER   3  -7.701  -1.964  -4.439
   18    HB2  SER   3           HB2      SER   3  -7.890  -2.143  -7.465
   19    HB3  SER   3           HB3      SER   3  -8.178  -3.482  -6.332
   20    HG   SER   3           HG       SER   3 -10.126  -2.421  -6.969
   21    H    SER   4           H        SER   4  -5.538  -1.042  -7.136
   22    HA   SER   4           HA       SER   4  -3.396  -2.670  -5.862
   23    HB2  SER   4           HB2      SER   4  -2.641  -3.389  -8.149
   24    HB3  SER   4           HB3      SER   4  -4.179  -4.107  -7.625
   25    HG   SER   4           HG       SER   4  -4.260  -3.319  -9.792
   26    H    GLY   5           H        GLY   5  -1.483  -1.692  -5.737
   27    HA2  GLY   5           HA2      GLY   5   0.070  -0.225  -7.208
   28    HA3  GLY   5           HA3      GLY   5  -1.241   0.963  -7.076
   29    H    ILE   6           H        ILE   6   0.317   2.396  -6.140
   30    HA   ILE   6           HA       ILE   6   1.183   1.682  -3.385
   31    HB   ILE   6           HB       ILE   6   2.036   4.007  -5.165
   32   HG12  ILE   6          HG12      ILE   6   2.978   2.027  -6.070
   33   HG13  ILE   6          HG13      ILE   6   4.267   2.839  -5.173
   34   HG21  ILE   6          HG21      ILE   6   3.910   4.194  -3.381
   35   HG22  ILE   6          HG22      ILE   6   2.796   3.286  -2.331
   36   HG23  ILE   6          HG23      ILE   6   2.304   4.861  -3.000
   37   HD11  ILE   6          HD11      ILE   6   4.256   0.355  -4.909
   38   HD12  ILE   6          HD12      ILE   6   4.094   1.227  -3.366
   39   HD13  ILE   6          HD13      ILE   6   2.665   0.480  -4.119
   40    H    VAL   7           H        VAL   7   0.800   3.013  -1.629
   41    HA   VAL   7           HA       VAL   7  -1.125   5.227  -1.951
   42    HB   VAL   7           HB       VAL   7  -2.508   4.317  -0.002
   43   HG11  VAL   7          HG11      VAL   7  -2.848   4.168  -2.695
   44   HG12  VAL   7          HG12      VAL   7  -3.022   2.458  -2.233
   45   HG13  VAL   7          HG13      VAL   7  -4.070   3.690  -1.492
   46   HG21  VAL   7          HG21      VAL   7  -0.986   2.491   0.686
   47   HG22  VAL   7          HG22      VAL   7  -2.621   1.898   0.310
   48   HG23  VAL   7          HG23      VAL   7  -1.299   1.663  -0.858
   49    H    ASP   8           H        ASP   8  -1.033   6.776  -0.410
   50    HA   ASP   8           HA       ASP   8   1.261   6.607   1.455
   51    HB2  ASP   8           HB2      ASP   8  -0.561   8.878   0.591
   52    HB3  ASP   8           HB3      ASP   8   0.675   9.052   1.852
   53    H    ALA   9           H        ALA   9  -1.675   5.428   1.555
   54    HA   ALA   9           HA       ALA   9  -1.981   5.774   4.472
   55    HB1  ALA   9           HB1      ALA   9  -3.389   7.529   3.164
   56    HB2  ALA   9           HB2      ALA   9  -4.182   6.580   4.444
   57    HB3  ALA   9           HB3      ALA   9  -4.425   6.146   2.735
   58    H    CYS  10           H        CYS  10  -4.478   4.516   4.727
   59    HA   CYS  10           HA       CYS  10  -4.351   1.926   3.320
   60    HB2  CYS  10           HB2      CYS  10  -2.831   1.580   5.220
   61    HB3  CYS  10           HB3      CYS  10  -4.083   2.133   6.344
   62    H    SER  11           H        SER  11  -5.844   4.009   5.792
   63    HA   SER  11           HA       SER  11  -8.400   2.641   5.791
   64    HB2  SER  11           HB3      SER  11  -9.178   4.689   7.013
   65    HB3  SER  11           HB2      SER  11  -7.755   3.908   7.736
   66    HG   SER  11           HG       SER  11  -7.526   6.200   7.578
   67    H    GLU  12           H        GLU  12  -6.882   5.049   3.814
   68    HA   GLU  12           HA       GLU  12  -9.419   5.914   2.566
   69    HB2  GLU  12           HB2      GLU  12  -6.522   6.711   2.204
   70    HB3  GLU  12           HB3      GLU  12  -7.802   7.274   1.116
   71    HG2  GLU  12           HG3      GLU  12  -8.965   8.300   3.038
   72    HG3  GLU  12           HG2      GLU  12  -7.665   7.742   4.109
   73    H    CYS  13           H        CYS  13  -6.832   3.641   2.114
   74    HA   CYS  13           HA       CYS  13  -7.244   3.245  -0.753
   75    HB2  CYS  13           HB2      CYS  13  -5.090   2.837   0.550
   76    HB3  CYS  13           HB3      CYS  13  -5.856   1.373   1.189
   77    H    CYS  14           H        CYS  14  -7.639   0.882  -1.515
   78    HA   CYS  14           HA       CYS  14 -10.332   0.170  -0.739
   79    HB2  CYS  14           HB2      CYS  14  -8.397  -0.539  -2.807
   80    HB3  CYS  14           HB3      CYS  14  -9.345  -1.933  -2.264
   81    H    GLU  15           H        GLU  15  -7.302  -0.683   0.569
   82    HA   GLU  15           HA       GLU  15  -8.233  -3.314   1.573
   83    HB2  GLU  15           HB3      GLU  15  -5.862  -2.750   0.633
   84    HB3  GLU  15           HB2      GLU  15  -5.596  -1.992   2.210
   85    HG2  GLU  15           HG3      GLU  15  -4.709  -4.132   2.471
   86    HG3  GLU  15           HG2      GLU  15  -6.310  -4.239   3.223
   87    HA   PRO  16           HA       PRO  16  -9.483  -1.222   5.358
   88    HB2  PRO  16           HB3      PRO  16 -10.046  -3.809   6.607
   89    HB3  PRO  16           HB2      PRO  16 -11.200  -2.588   6.003
   90    HG2  PRO  16           HG2      PRO  16 -10.824  -5.052   4.863
   91    HG3  PRO  16           HG3      PRO  16 -11.409  -3.615   3.980
   92    HD2  PRO  16           HD2      PRO  16  -8.646  -4.814   4.048
   93    HD3  PRO  16           HD3      PRO  16  -9.561  -4.115   2.675
   94    H    ASP  17           H        ASP  17  -7.851  -4.389   6.057
   95    HA   ASP  17           HA       ASP  17  -5.912  -2.930   7.787
   96    HB2  ASP  17           HB3      ASP  17  -7.637  -5.275   8.640
   97    HB3  ASP  17           HB2      ASP  17  -6.160  -4.790   9.495
   98    H    LYS  18           H        LYS  18  -6.433  -5.126   5.321
   99    HA   LYS  18           HA       LYS  18  -4.178  -6.916   5.951
  100    HB2  LYS  18           HB2      LYS  18  -6.128  -6.703   3.649
  101    HB3  LYS  18           HB3      LYS  18  -4.738  -7.799   3.600
  102    HG2  LYS  18           HG2      LYS  18  -5.570  -8.935   5.623
  103    HG3  LYS  18           HG3      LYS  18  -6.964  -7.835   5.665
  104    HD2  LYS  18           HD2      LYS  18  -7.675  -8.656   3.454
  105    HD3  LYS  18           HD3      LYS  18  -6.281  -9.756   3.411
  106    HE2  LYS  18           HE2      LYS  18  -7.123 -10.897   5.424
  107    HE3  LYS  18           HE3      LYS  18  -8.517  -9.799   5.467
  108    HZ1  LYS  18           HZ1      LYS  18  -9.060 -11.885   4.426
  109    HZ2  LYS  18           HZ2      LYS  18  -7.881 -11.684   3.291
  110    HZ3  LYS  18           HZ3      LYS  18  -9.176 -10.664   3.324
  111    H    CYS  19           H        CYS  19  -3.891  -3.903   5.426
  112    HA   CYS  19           HA       CYS  19  -2.245  -3.853   2.977
  113    HB2  CYS  19           HB3      CYS  19  -2.095  -1.475   3.337
  114    HB3  CYS  19           HB2      CYS  19  -3.778  -1.987   3.539
  115    H    ILE  20           H        ILE  20  -0.072  -3.483   2.868
  116    HA   ILE  20           HA       ILE  20   1.441  -4.058   5.365
  117    HB   ILE  20           HB       ILE  20   2.685  -3.968   2.597
  118   HG12  ILE  20          HG12      ILE  20   2.364  -6.621   2.930
  119   HG13  ILE  20          HG13      ILE  20   0.879  -6.064   3.719
  120   HG21  ILE  20          HG21      ILE  20   4.164  -4.066   4.580
  121   HG22  ILE  20          HG22      ILE  20   4.291  -5.532   3.578
  122   HG23  ILE  20          HG23      ILE  20   3.358  -5.568   5.093
  123   HD11  ILE  20          HD11      ILE  20   0.490  -6.580   1.359
  124   HD12  ILE  20          HD12      ILE  20   1.748  -5.414   0.885
  125   HD13  ILE  20          HD13      ILE  20   0.256  -4.844   1.671
  126    H    ILE  21           H        ILE  21   3.291  -2.810   5.921
  127    HA   ILE  21           HA       ILE  21   2.999   0.024   5.059
  128    HB   ILE  21           HB       ILE  21   4.440  -1.047   7.529
  129   HG12  ILE  21          HG12      ILE  21   2.337   0.279   8.555
  130   HG13  ILE  21          HG13      ILE  21   1.593  -0.292   7.052
  131   HG21  ILE  21          HG21      ILE  21   5.247   1.160   6.747
  132   HG22  ILE  21          HG22      ILE  21   3.583   1.784   6.830
  133   HG23  ILE  21          HG23      ILE  21   4.413   1.266   8.316
  134   HD11  ILE  21          HD11      ILE  21   1.179  -1.848   8.894
  135   HD12  ILE  21          HD12      ILE  21   2.931  -2.024   9.153
  136   HD13  ILE  21          HD13      ILE  21   2.192  -2.608   7.643
  137    H    MET  22           H        MET  22   4.153   0.165   3.239
  138    HA   MET  22           HA       MET  22   5.952   0.352   1.826
  139    HB2  MET  22           HB2      MET  22   7.520   0.715   4.399
  140    HB3  MET  22           HB3      MET  22   8.073   1.159   2.776
  141    HG2  MET  22           HG3      MET  22   6.555   2.947   2.621
  142    HG3  MET  22           HG2      MET  22   5.538   2.315   3.930
  143    HE1  MET  22           HE1      MET  22   6.839   5.666   5.487
  144    HE2  MET  22           HE2      MET  22   5.413   4.668   5.116
  145    HE3  MET  22           HE3      MET  22   6.380   5.365   3.794
  146    H    LEU  23           H        LEU  23   6.580  -1.308   0.635
  147    HA   LEU  23           HA       LEU  23   8.557  -3.183   1.740
  148    HB2  LEU  23           HB3      LEU  23   6.838  -4.546   2.398
  149    HB3  LEU  23           HB2      LEU  23   5.736  -3.944   1.156
  150    HG   LEU  23           HG       LEU  23   7.340  -5.260  -0.480
  151   HD11  LEU  23          HD11      LEU  23   8.973  -5.877   1.261
  152   HD12  LEU  23          HD12      LEU  23   7.704  -6.775   2.126
  153   HD13  LEU  23          HD13      LEU  23   8.230  -7.310   0.512
  154   HD21  LEU  23          HD21      LEU  23   4.938  -5.677  -0.123
  155   HD22  LEU  23          HD22      LEU  23   5.855  -7.192  -0.303
  156   HD23  LEU  23          HD23      LEU  23   5.328  -6.658   1.311
  157    HA   PRO  24           HA       PRO  24   8.437  -3.957  -2.972
  158    HB2  PRO  24           HB3      PRO  24   6.533  -2.173  -4.308
  159    HB3  PRO  24           HB2      PRO  24   6.575  -3.958  -4.298
  160    HG2  PRO  24           HG3      PRO  24   4.644  -2.473  -3.075
  161    HG3  PRO  24           HG2      PRO  24   5.135  -4.101  -2.530
  162    HD2  PRO  24           HD2      PRO  24   5.917  -1.401  -1.436
  163    HD3  PRO  24           HD3      PRO  24   5.494  -2.911  -0.567
  164    H    THR  25           H        THR  25   9.337  -2.908  -4.933
  165    HA   THR  25           HA       THR  25  10.746  -1.419  -5.968
  166    HB   THR  25           HB       THR  25   9.574   0.953  -4.520
  167    HG1  THR  25           HG1      THR  25   7.797  -0.468  -5.022
  168   HG21  THR  25          HG21      THR  25   9.462   1.495  -7.182
  169   HG22  THR  25          HG22      THR  25  10.818   0.343  -7.151
  170   HG23  THR  25          HG23      THR  25  10.887   1.824  -6.166
  171    H    TRP  26           H        TRP  26  12.483   0.313  -5.612
  172    HA   TRP  26           HA       TRP  26  14.177  -0.520  -3.473
  173    HB2  TRP  26           HB2      TRP  26  15.219   1.934  -4.210
  174    HB3  TRP  26           HB3      TRP  26  15.645   0.360  -4.896
  175    HD1  TRP  26           HD1      TRP  26  13.842  -0.318  -7.103
  176    HE1  TRP  26           HE1      TRP  26  13.156   1.203  -9.061
  177    HE3  TRP  26           HE3      TRP  26  15.034   4.196  -5.019
  178    HZ2  TRP  26           HZ2      TRP  26  13.202   3.953  -9.650
  179    HZ3  TRP  26           HZ3      TRP  26  14.708   6.236  -6.360
  180    HH2  TRP  26           HH2      TRP  26  13.802   6.113  -8.644
  181    HA   PRO  27           HA       PRO  27  13.057   3.432  -1.020
  182    HB2  PRO  27           HB2      PRO  27  10.714   4.770  -2.172
  183    HB3  PRO  27           HB3      PRO  27  12.364   5.414  -1.946
  184    HG2  PRO  27           HG3      PRO  27  11.253   4.909  -4.386
  185    HG3  PRO  27           HG2      PRO  27  13.009   4.859  -4.065
  186    HD2  PRO  27           HD3      PRO  27  11.028   2.590  -4.232
  187    HD3  PRO  27           HD2      PRO  27  12.679   2.703  -4.921
  188    HA   PRO  28           HA       PRO  28   9.630   1.533   1.158
  189    HB2  PRO  28           HB2      PRO  28   9.095   3.831   2.899
  190    HB3  PRO  28           HB3      PRO  28   9.960   2.317   3.281
  191    HG2  PRO  28           HG2      PRO  28  11.168   4.764   3.139
  192    HG3  PRO  28           HG3      PRO  28  12.002   3.216   2.827
  193    HD2  PRO  28           HD3      PRO  28  10.892   5.213   0.864
  194    HD3  PRO  28           HD2      PRO  28  12.440   4.311   0.813
  195    H    ARG  29           H        ARG  29   7.683   1.188   0.241
  196    HA   ARG  29           HA       ARG  29   5.698   3.394   0.169
  197    HB2  ARG  29           HB2      ARG  29   6.622   1.836  -2.257
  198    HB3  ARG  29           HB3      ARG  29   5.054   2.658  -2.197
  199    HG2  ARG  29           HG3      ARG  29   6.112   4.806  -1.961
  200    HG3  ARG  29           HG2      ARG  29   7.705   4.054  -1.737
  201    HD2  ARG  29           HD2      ARG  29   7.567   3.135  -4.036
  202    HD3  ARG  29           HD3      ARG  29   6.016   3.969  -4.258
  203    HE   ARG  29           HE       ARG  29   7.959   5.874  -3.439
  204   HH11  ARG  29          HH11      ARG  29   7.211   3.844  -6.248
  205   HH12  ARG  29          HH12      ARG  29   7.960   4.950  -7.378
  206   HH21  ARG  29          HH21      ARG  29   8.913   7.273  -4.930
  207   HH22  ARG  29          HH22      ARG  29   8.918   6.880  -6.634
  208    H    TYR  30           H        TYR  30   3.629   2.780   0.463
  209    HA   TYR  30           HA       TYR  30   3.076   0.134   1.513
  210    HB2  TYR  30           HB2      TYR  30   1.258   2.458   0.793
  211    HB3  TYR  30           HB3      TYR  30   0.717   0.995   1.627
  212    HD1  TYR  30           HD1      TYR  30   2.939   3.971   1.944
  213    HD2  TYR  30           HD2      TYR  30   0.960   0.791   3.976
  214    HE1  TYR  30           HE1      TYR  30   3.470   5.019   4.100
  215    HE2  TYR  30           HE2      TYR  30   1.496   1.833   6.131
  216    HH   TYR  30           HH       TYR  30   1.995   4.274   6.920
  217    H    VAL  31           H        VAL  31   1.129  -1.148   0.801
  218    HA   VAL  31           HA       VAL  31   0.555  -1.032  -2.098
  219    HB   VAL  31           HB       VAL  31   0.813  -3.788  -1.604
  220   HG11  VAL  31          HG11      VAL  31   1.106  -2.591  -3.736
  221   HG12  VAL  31          HG12      VAL  31   2.663  -1.957  -3.154
  222   HG13  VAL  31          HG13      VAL  31   2.451  -3.707  -3.397
  223   HG21  VAL  31          HG21      VAL  31   3.139  -4.134  -1.003
  224   HG22  VAL  31          HG22      VAL  31   2.295  -3.279   0.310
  225   HG23  VAL  31          HG23      VAL  31   3.373  -2.382  -0.787
  226    H    CYS  32           H        CYS  32  -1.359  -1.966  -2.719
  227    HA   CYS  32           HA       CYS  32  -3.098  -2.991  -0.511
  228    HB2  CYS  32           HB2      CYS  32  -3.719  -1.011  -2.708
  229    HB3  CYS  32           HB3      CYS  32  -4.994  -1.922  -1.885
  230    H    SER  33           H        SER  33  -4.319  -4.762  -0.939
  231    HA   SER  33           HA       SER  33  -4.161  -5.869  -3.714
  232    HB2  SER  33           HB2      SER  33  -3.825  -7.314  -1.072
  233    HB3  SER  33           HB3      SER  33  -4.061  -8.138  -2.628
  234    HG   SER  33           HG       SER  33  -1.834  -7.901  -2.076
  235    H    VAL  34           H        VAL  34  -6.198  -4.395  -1.954
  236    HA   VAL  34           HA       VAL  34  -8.412  -4.409  -1.409
  237    HB   VAL  34           HB       VAL  34  -8.462  -4.077  -3.848
  238   HG11  VAL  34          HG11      VAL  34  -9.418  -5.979  -5.268
  239   HG12  VAL  34          HG12      VAL  34  -7.685  -6.040  -4.864
  240   HG13  VAL  34          HG13      VAL  34  -8.841  -7.066  -3.982
  241   HG21  VAL  34          HG21      VAL  34 -10.515  -3.919  -2.487
  242   HG22  VAL  34          HG22      VAL  34 -10.834  -4.406  -4.169
  243   HG23  VAL  34          HG23      VAL  34 -10.876  -5.620  -2.868
  Start of MODEL    7
    1    H1   CYS   1           H1       CYS   1 -11.013   5.232  -4.848
    2    H2   CYS   1           H2       CYS   1 -11.832   4.410  -6.020
    3    H3   CYS   1           H3       CYS   1 -12.544   4.690  -4.559
    4    HA   CYS   1           HA       CYS   1 -10.971   3.296  -3.437
    5    HB2  CYS   1           HB3      CYS   1 -13.078   2.338  -4.353
    6    HB3  CYS   1           HB2      CYS   1 -12.222   1.950  -5.854
    7    H    VAL   2           H        VAL   2  -9.137   2.048  -3.441
    8    HA   VAL   2           HA       VAL   2  -7.544   2.030  -5.962
    9    HB   VAL   2           HB       VAL   2  -6.268   2.424  -3.228
   10   HG11  VAL   2          HG11      VAL   2  -4.845   1.513  -5.034
   11   HG12  VAL   2          HG12      VAL   2  -5.226   2.934  -6.036
   12   HG13  VAL   2          HG13      VAL   2  -4.319   3.133  -4.517
   13   HG21  VAL   2          HG21      VAL   2  -7.731   4.366  -3.684
   14   HG22  VAL   2          HG22      VAL   2  -6.912   4.601  -5.247
   15   HG23  VAL   2          HG23      VAL   2  -6.005   4.800  -3.729
   16    H    SER   3           H        SER   3  -8.344  -0.059  -6.286
   17    HA   SER   3           HA       SER   3  -7.932  -2.182  -4.346
   18    HB2  SER   3           HB2      SER   3  -8.607  -2.285  -7.305
   19    HB3  SER   3           HB3      SER   3  -8.661  -3.667  -6.189
   20    HG   SER   3           HG       SER   3 -10.721  -2.661  -6.459
   21    H    SER   4           H        SER   4  -6.212  -1.065  -7.268
   22    HA   SER   4           HA       SER   4  -3.916  -2.786  -6.455
   23    HB2  SER   4           HB2      SER   4  -4.934  -2.457  -9.300
   24    HB3  SER   4           HB3      SER   4  -3.471  -3.339  -8.812
   25    HG   SER   4           HG       SER   4  -5.293  -4.727  -9.093
   26    H    GLY   5           H        GLY   5  -2.035  -1.770  -6.370
   27    HA2  GLY   5           HA3      GLY   5  -0.598  -0.173  -7.810
   28    HA3  GLY   5           HA2      GLY   5  -1.916   0.979  -7.522
   29    H    ILE   6           H        ILE   6   0.166   2.113  -6.754
   30    HA   ILE   6           HA       ILE   6   0.850   1.372  -3.963
   31    HB   ILE   6           HB       ILE   6   2.071   3.469  -5.811
   32   HG12  ILE   6          HG12      ILE   6   2.629   1.253  -6.575
   33   HG13  ILE   6          HG13      ILE   6   4.061   1.991  -5.846
   34   HG21  ILE   6          HG21      ILE   6   3.940   3.458  -4.030
   35   HG22  ILE   6          HG22      ILE   6   2.723   2.741  -2.948
   36   HG23  ILE   6          HG23      ILE   6   2.444   4.348  -3.661
   37   HD11  ILE   6          HD11      ILE   6   3.873  -0.394  -5.273
   38   HD12  ILE   6          HD12      ILE   6   3.740   0.625  -3.819
   39   HD13  ILE   6          HD13      ILE   6   2.280  -0.098  -4.536
   40    H    VAL   7           H        VAL   7   0.561   2.686  -2.227
   41    HA   VAL   7           HA       VAL   7  -1.030   5.161  -2.628
   42    HB   VAL   7           HB       VAL   7  -2.409   4.535  -0.583
   43   HG11  VAL   7          HG11      VAL   7  -3.284   4.527  -2.885
   44   HG12  VAL   7          HG12      VAL   7  -4.045   3.281  -1.867
   45   HG13  VAL   7          HG13      VAL   7  -2.798   2.823  -3.051
   46   HG21  VAL   7          HG21      VAL   7  -1.025   2.646   0.221
   47   HG22  VAL   7          HG22      VAL   7  -1.474   1.716  -1.229
   48   HG23  VAL   7          HG23      VAL   7  -2.721   2.174  -0.045
   49    H    ASP   8           H        ASP   8  -0.773   6.760  -1.116
   50    HA   ASP   8           HA       ASP   8   1.642   6.491   0.581
   51    HB2  ASP   8           HB2      ASP   8  -0.048   8.860  -0.282
   52    HB3  ASP   8           HB3      ASP   8   1.275   8.992   0.892
   53    H    ALA   9           H        ALA   9  -1.275   5.457   0.994
   54    HA   ALA   9           HA       ALA   9  -1.430   6.216   3.862
   55    HB1  ALA   9           HB1      ALA   9  -3.028   7.576   2.337
   56    HB2  ALA   9           HB2      ALA   9  -3.940   6.055   2.187
   57    HB3  ALA   9           HB3      ALA   9  -3.704   6.797   3.787
   58    H    CYS  10           H        CYS  10  -3.836   4.809   4.392
   59    HA   CYS  10           HA       CYS  10  -3.526   2.032   3.488
   60    HB2  CYS  10           HB2      CYS  10  -2.915   2.874   6.334
   61    HB3  CYS  10           HB3      CYS  10  -3.393   1.223   5.909
   62    H    SER  11           H        SER  11  -5.020   4.409   5.659
   63    HA   SER  11           HA       SER  11  -7.468   2.824   5.995
   64    HB2  SER  11           HB3      SER  11  -6.800   5.678   6.808
   65    HB3  SER  11           HB2      SER  11  -8.256   4.778   7.284
   66    HG   SER  11           HG       SER  11  -6.594   4.685   8.881
   67    H    GLU  12           H        GLU  12  -6.214   5.206   3.818
   68    HA   GLU  12           HA       GLU  12  -8.846   6.071   2.831
   69    HB2  GLU  12           HB2      GLU  12  -5.999   6.649   1.987
   70    HB3  GLU  12           HB3      GLU  12  -7.398   7.222   1.065
   71    HG2  GLU  12           HG3      GLU  12  -8.193   8.447   3.055
   72    HG3  GLU  12           HG2      GLU  12  -6.780   7.872   3.961
   73    H    CYS  13           H        CYS  13  -6.398   3.679   2.097
   74    HA   CYS  13           HA       CYS  13  -7.342   3.091  -0.602
   75    HB2  CYS  13           HB2      CYS  13  -5.002   2.672   0.466
   76    HB3  CYS  13           HB3      CYS  13  -5.738   1.200   1.123
   77    H    CYS  14           H        CYS  14  -8.104   0.830  -1.177
   78    HA   CYS  14           HA       CYS  14 -10.431   0.216   0.510
   79    HB2  CYS  14           HB3      CYS  14  -9.522  -0.677  -2.231
   80    HB3  CYS  14           HB2      CYS  14 -10.913  -1.408  -1.410
   81    H    GLU  15           H        GLU  15  -7.644  -0.492   1.400
   82    HA   GLU  15           HA       GLU  15  -8.122  -3.413   1.815
   83    HB2  GLU  15           HB3      GLU  15  -5.706  -1.948   0.979
   84    HB3  GLU  15           HB2      GLU  15  -5.441  -3.046   2.344
   85    HG2  GLU  15           HG2      GLU  15  -6.864  -3.969  -0.146
   86    HG3  GLU  15           HG3      GLU  15  -5.094  -3.944  -0.053
   87    HA   PRO  16           HA       PRO  16  -8.295  -1.409   5.982
   88    HB2  PRO  16           HB3      PRO  16 -10.487  -3.266   6.590
   89    HB3  PRO  16           HB2      PRO  16 -10.527  -1.483   6.504
   90    HG2  PRO  16           HG2      PRO  16 -11.786  -3.113   4.717
   91    HG3  PRO  16           HG3      PRO  16 -11.183  -1.481   4.315
   92    HD2  PRO  16           HD3      PRO  16  -9.934  -4.165   3.755
   93    HD3  PRO  16           HD2      PRO  16 -10.062  -2.728   2.691
   94    H    ASP  17           H        ASP  17  -7.140  -2.089   7.681
   95    HA   ASP  17           HA       ASP  17  -5.978  -3.397   9.163
   96    HB2  ASP  17           HB2      ASP  17  -8.074  -5.458   8.425
   97    HB3  ASP  17           HB3      ASP  17  -6.840  -5.723   9.672
   98    H    LYS  18           H        LYS  18  -5.786  -3.828   5.939
   99    HA   LYS  18           HA       LYS  18  -3.506  -5.722   6.225
  100    HB2  LYS  18           HB2      LYS  18  -5.733  -5.860   4.178
  101    HB3  LYS  18           HB3      LYS  18  -4.157  -6.627   3.918
  102    HG2  LYS  18           HG2      LYS  18  -4.488  -7.987   5.943
  103    HG3  LYS  18           HG3      LYS  18  -6.066  -7.214   6.206
  104    HD2  LYS  18           HD3      LYS  18  -6.847  -8.090   4.032
  105    HD3  LYS  18           HD2      LYS  18  -5.270  -8.867   3.785
  106    HE2  LYS  18           HE2      LYS  18  -7.021  -9.443   6.186
  107    HE3  LYS  18           HE3      LYS  18  -7.147 -10.353   4.667
  108    HZ1  LYS  18           HZ1      LYS  18  -5.708 -11.443   6.239
  109    HZ2  LYS  18           HZ2      LYS  18  -4.837 -10.965   4.923
  110    HZ3  LYS  18           HZ3      LYS  18  -4.726 -10.121   6.335
  111    H    CYS  19           H        CYS  19  -2.243  -3.814   6.286
  112    HA   CYS  19           HA       CYS  19  -1.684  -2.749   3.561
  113    HB2  CYS  19           HB3      CYS  19  -3.089  -1.130   4.947
  114    HB3  CYS  19           HB2      CYS  19  -1.698  -0.999   6.035
  115    H    ILE  20           H        ILE  20   0.324  -3.245   3.062
  116    HA   ILE  20           HA       ILE  20   2.316  -3.501   5.262
  117    HB   ILE  20           HB       ILE  20   3.725  -4.704   3.493
  118   HG12  ILE  20          HG12      ILE  20   1.988  -5.926   1.851
  119   HG13  ILE  20          HG13      ILE  20   1.183  -4.352   1.964
  120   HG21  ILE  20          HG21      ILE  20   2.559  -5.817   5.359
  121   HG22  ILE  20          HG22      ILE  20   2.625  -6.834   3.900
  122   HG23  ILE  20          HG23      ILE  20   1.115  -5.998   4.333
  123   HD11  ILE  20          HD11      ILE  20   2.680  -4.446   0.031
  124   HD12  ILE  20          HD12      ILE  20   4.051  -4.832   1.097
  125   HD13  ILE  20          HD13      ILE  20   3.253  -3.245   1.214
  126    H    ILE  21           H        ILE  21   4.523  -2.809   4.871
  127    HA   ILE  21           HA       ILE  21   4.523  -0.208   3.432
  128    HB   ILE  21           HB       ILE  21   6.716  -1.185   5.303
  129   HG12  ILE  21          HG13      ILE  21   5.360   0.543   6.877
  130   HG13  ILE  21          HG12      ILE  21   4.003  -0.151   5.974
  131   HG21  ILE  21          HG21      ILE  21   7.203   0.772   3.865
  132   HG22  ILE  21          HG22      ILE  21   5.787   1.609   4.544
  133   HG23  ILE  21          HG23      ILE  21   7.168   1.202   5.592
  134   HD11  ILE  21          HD11      ILE  21   4.378  -1.354   8.070
  135   HD12  ILE  21          HD12      ILE  21   6.047  -1.718   7.572
  136   HD13  ILE  21          HD13      ILE  21   4.678  -2.406   6.667
  137    H    MET  22           H        MET  22   5.104  -0.324   1.419
  138    HA   MET  22           HA       MET  22   6.102  -0.898  -0.553
  139    HB2  MET  22           HB2      MET  22   8.533  -0.672  -0.657
  140    HB3  MET  22           HB3      MET  22   7.779   0.619   0.284
  141    HG2  MET  22           HG2      MET  22   9.715   0.102   1.476
  142    HG3  MET  22           HG3      MET  22   8.444  -0.761   2.361
  143    HE1  MET  22           HE1      MET  22  11.540  -3.158   2.717
  144    HE2  MET  22           HE2      MET  22  10.272  -2.253   3.578
  145    HE3  MET  22           HE3      MET  22  11.555  -1.378   2.707
  146    H    LEU  23           H        LEU  23   6.602  -2.494  -1.932
  147    HA   LEU  23           HA       LEU  23   7.721  -5.001  -0.812
  148    HB2  LEU  23           HB3      LEU  23   5.634  -5.868  -0.778
  149    HB3  LEU  23           HB2      LEU  23   4.998  -4.659  -1.900
  150    HG   LEU  23           HG       LEU  23   6.440  -6.092  -3.649
  151   HD11  LEU  23          HD11      LEU  23   7.263  -7.662  -1.937
  152   HD12  LEU  23          HD12      LEU  23   6.271  -8.482  -3.166
  153   HD13  LEU  23          HD13      LEU  23   5.585  -8.125  -1.563
  154   HD21  LEU  23          HD21      LEU  23   4.040  -5.557  -3.785
  155   HD22  LEU  23          HD22      LEU  23   4.372  -7.241  -4.256
  156   HD23  LEU  23          HD23      LEU  23   3.686  -6.884  -2.653
  157    HA   PRO  24           HA       PRO  24   8.742  -5.100  -5.381
  158    HB2  PRO  24           HB2      PRO  24   7.392  -3.343  -7.161
  159    HB3  PRO  24           HB3      PRO  24   6.986  -5.052  -6.844
  160    HG2  PRO  24           HG2      PRO  24   5.433  -2.778  -6.192
  161    HG3  PRO  24           HG3      PRO  24   5.150  -4.464  -5.681
  162    HD2  PRO  24           HD3      PRO  24   6.436  -2.211  -4.193
  163    HD3  PRO  24           HD2      PRO  24   5.471  -3.587  -3.572
  164    H    THR  25           H        THR  25   9.225  -2.680  -3.518
  165    HA   THR  25           HA       THR  25  11.239  -1.366  -5.239
  166    HB   THR  25           HB       THR  25  10.551   0.903  -4.274
  167    HG1  THR  25           HG1      THR  25   8.848   0.950  -3.040
  168   HG21  THR  25          HG21      THR  25   9.729  -0.441  -6.596
  169   HG22  THR  25          HG22      THR  25   9.678   1.312  -6.295
  170   HG23  THR  25          HG23      THR  25   8.250   0.309  -5.948
  171    H    TRP  26           H        TRP  26  12.731   0.044  -3.960
  172    HA   TRP  26           HA       TRP  26  13.421  -1.361  -1.476
  173    HB2  TRP  26           HB3      TRP  26  15.418   0.384  -1.621
  174    HB3  TRP  26           HB2      TRP  26  15.371  -1.096  -2.590
  175    HD1  TRP  26           HD1      TRP  26  14.182  -0.639  -5.187
  176    HE1  TRP  26           HE1      TRP  26  14.663   1.286  -6.817
  177    HE3  TRP  26           HE3      TRP  26  16.294   2.657  -1.885
  178    HZ2  TRP  26           HZ2      TRP  26  15.865   3.825  -6.715
  179    HZ3  TRP  26           HZ3      TRP  26  17.113   4.814  -2.745
  180    HH2  TRP  26           HH2      TRP  26  16.895   5.390  -5.126
  181    HA   PRO  27           HA       PRO  27  12.891   3.021   0.480
  182    HB2  PRO  27           HB2      PRO  27  11.090   4.588  -1.269
  183    HB3  PRO  27           HB3      PRO  27  12.702   5.021  -0.633
  184    HG2  PRO  27           HG2      PRO  27  12.280   4.513  -3.245
  185    HG3  PRO  27           HG3      PRO  27  13.807   4.090  -2.420
  186    HD2  PRO  27           HD3      PRO  27  11.440   2.320  -3.053
  187    HD3  PRO  27           HD2      PRO  27  13.184   2.012  -3.334
  188    HA   PRO  28           HA       PRO  28   8.950   2.097   2.379
  189    HB2  PRO  28           HB3      PRO  28   8.470   4.974   3.048
  190    HB3  PRO  28           HB2      PRO  28   8.626   3.566   4.137
  191    HG2  PRO  28           HG2      PRO  28  10.562   5.393   3.946
  192    HG3  PRO  28           HG3      PRO  28  10.939   3.655   4.121
  193    HD2  PRO  28           HD3      PRO  28  10.981   5.373   1.646
  194    HD3  PRO  28           HD2      PRO  28  12.164   4.144   2.192
  195    H    ARG  29           H        ARG  29   7.134   1.583   1.387
  196    HA   ARG  29           HA       ARG  29   5.463   3.658   0.104
  197    HB2  ARG  29           HB2      ARG  29   6.569   1.237  -1.354
  198    HB3  ARG  29           HB3      ARG  29   5.113   2.090  -1.896
  199    HG2  ARG  29           HG2      ARG  29   6.475   4.183  -2.057
  200    HG3  ARG  29           HG3      ARG  29   7.918   3.226  -1.661
  201    HD2  ARG  29           HD2      ARG  29   7.533   1.824  -3.645
  202    HD3  ARG  29           HD3      ARG  29   6.083   2.769  -4.039
  203    HE   ARG  29           HE       ARG  29   8.395   4.469  -3.794
  204   HH11  ARG  29          HH11      ARG  29   6.841   2.178  -6.009
  205   HH12  ARG  29          HH12      ARG  29   7.561   2.903  -7.429
  206   HH21  ARG  29          HH21      ARG  29   9.303   5.373  -5.651
  207   HH22  ARG  29          HH22      ARG  29   8.947   4.702  -7.226
  208    H    TYR  30           H        TYR  30   3.653   1.783  -1.111
  209    HA   TYR  30           HA       TYR  30   2.726  -0.092   0.951
  210    HB2  TYR  30           HB2      TYR  30   1.127   2.407   0.285
  211    HB3  TYR  30           HB3      TYR  30   0.449   0.984   1.090
  212    HD1  TYR  30           HD1      TYR  30   2.339   4.047   1.500
  213    HD2  TYR  30           HD2      TYR  30   1.310   0.372   3.396
  214    HE1  TYR  30           HE1      TYR  30   3.012   4.979   3.669
  215    HE2  TYR  30           HE2      TYR  30   1.984   1.302   5.566
  216    HH   TYR  30           HH       TYR  30   2.166   3.711   6.561
  217    H    VAL  31           H        VAL  31   1.161  -1.538   0.175
  218    HA   VAL  31           HA       VAL  31   0.363  -1.193  -2.681
  219    HB   VAL  31           HB       VAL  31   1.204  -3.897  -1.574
  220   HG11  VAL  31          HG11      VAL  31  -0.318  -3.889  -3.524
  221   HG12  VAL  31          HG12      VAL  31   0.864  -2.912  -4.427
  222   HG13  VAL  31          HG13      VAL  31   1.280  -4.567  -3.919
  223   HG21  VAL  31          HG21      VAL  31   3.175  -2.407  -1.556
  224   HG22  VAL  31          HG22      VAL  31   3.318  -3.701  -2.768
  225   HG23  VAL  31          HG23      VAL  31   2.903  -2.047  -3.278
  226    H    CYS  32           H        CYS  32  -1.614  -1.999  -3.254
  227    HA   CYS  32           HA       CYS  32  -3.288  -3.095  -1.033
  228    HB2  CYS  32           HB2      CYS  32  -3.950  -0.997  -3.107
  229    HB3  CYS  32           HB3      CYS  32  -5.205  -1.892  -2.235
  230    H    SER  33           H        SER  33  -4.558  -4.813  -1.478
  231    HA   SER  33           HA       SER  33  -4.671  -5.749  -4.315
  232    HB2  SER  33           HB3      SER  33  -3.985  -7.368  -1.844
  233    HB3  SER  33           HB2      SER  33  -4.416  -8.086  -3.411
  234    HG   SER  33           HG       SER  33  -2.137  -7.851  -3.138
  235    H    VAL  34           H        VAL  34  -6.501  -4.426  -2.264
  236    HA   VAL  34           HA       VAL  34  -8.638  -4.490  -1.485
  237    HB   VAL  34           HB       VAL  34  -8.959  -4.176  -3.926
  238   HG11  VAL  34          HG11      VAL  34 -10.166  -6.116  -5.130
  239   HG12  VAL  34          HG12      VAL  34  -8.389  -6.131  -5.041
  240   HG13  VAL  34          HG13      VAL  34  -9.343  -7.159  -3.946
  241   HG21  VAL  34          HG21      VAL  34 -10.807  -3.950  -2.307
  242   HG22  VAL  34          HG22      VAL  34 -11.357  -4.455  -3.922
  243   HG23  VAL  34          HG23      VAL  34 -11.251  -5.647  -2.605
  Start of MODEL    8
    1    H1   CYS   1           H1       CYS   1 -11.390   5.126  -6.087
    2    H2   CYS   1           H2       CYS   1 -12.075   3.662  -6.415
    3    H3   CYS   1           H3       CYS   1 -12.715   4.628  -5.241
    4    HA   CYS   1           HA       CYS   1 -10.776   4.407  -3.884
    5    HB2  CYS   1           HB3      CYS   1 -12.715   2.744  -3.835
    6    HB3  CYS   1           HB2      CYS   1 -11.693   1.668  -4.802
    7    H    VAL   2           H        VAL   2  -9.010   2.524  -3.528
    8    HA   VAL   2           HA       VAL   2  -7.404   2.332  -6.034
    9    HB   VAL   2           HB       VAL   2  -6.137   2.799  -3.309
   10   HG11  VAL   2          HG11      VAL   2  -4.730   1.797  -5.078
   11   HG12  VAL   2          HG12      VAL   2  -4.168   3.420  -4.612
   12   HG13  VAL   2          HG13      VAL   2  -5.074   3.193  -6.127
   13   HG21  VAL   2          HG21      VAL   2  -7.554   4.756  -3.834
   14   HG22  VAL   2          HG22      VAL   2  -6.725   4.923  -5.400
   15   HG23  VAL   2          HG23      VAL   2  -5.819   5.150  -3.885
   16    H    SER   3           H        SER   3  -8.200   0.260  -6.305
   17    HA   SER   3           HA       SER   3  -8.010  -1.813  -4.311
   18    HB2  SER   3           HB2      SER   3  -8.278  -1.994  -7.330
   19    HB3  SER   3           HB3      SER   3  -8.514  -3.338  -6.192
   20    HG   SER   3           HG       SER   3 -10.495  -2.306  -6.772
   21    H    SER   4           H        SER   4  -5.915  -0.871  -7.062
   22    HA   SER   4           HA       SER   4  -3.778  -2.573  -5.862
   23    HB2  SER   4           HB2      SER   4  -3.022  -3.137  -8.183
   24    HB3  SER   4           HB3      SER   4  -4.587  -3.848  -7.735
   25    HG   SER   4           HG       SER   4  -4.613  -2.894  -9.836
   26    H    GLY   5           H        GLY   5  -1.665  -1.881  -6.109
   27    HA2  GLY   5           HA2      GLY   5  -0.088  -0.328  -7.210
   28    HA3  GLY   5           HA3      GLY   5  -1.364   0.903  -7.165
   29    H    ILE   6           H        ILE   6   0.713   1.949  -6.216
   30    HA   ILE   6           HA       ILE   6   1.023   1.369  -3.328
   31    HB   ILE   6           HB       ILE   6   2.529   3.298  -5.150
   32   HG12  ILE   6          HG13      ILE   6   3.079   0.999  -5.677
   33   HG13  ILE   6          HG12      ILE   6   4.443   1.773  -4.861
   34   HG21  ILE   6          HG21      ILE   6   4.179   3.376  -3.173
   35   HG22  ILE   6          HG22      ILE   6   2.677   4.321  -3.033
   36   HG23  ILE   6          HG23      ILE   6   2.830   2.762  -2.187
   37   HD11  ILE   6          HD11      ILE   6   4.161  -0.538  -4.103
   38   HD12  ILE   6          HD12      ILE   6   3.878   0.605  -2.768
   39   HD13  ILE   6          HD13      ILE   6   2.499  -0.177  -3.578
   40    H    VAL   7           H        VAL   7   0.601   2.794  -1.707
   41    HA   VAL   7           HA       VAL   7  -0.769   5.329  -2.390
   42    HB   VAL   7           HB       VAL   7  -2.502   4.825  -0.577
   43   HG11  VAL   7          HG11      VAL   7  -2.997   4.909  -2.987
   44   HG12  VAL   7          HG12      VAL   7  -2.624   3.174  -3.114
   45   HG13  VAL   7          HG13      VAL   7  -4.005   3.718  -2.132
   46   HG21  VAL   7          HG21      VAL   7  -1.416   2.821   0.393
   47   HG22  VAL   7          HG22      VAL   7  -3.079   2.489  -0.148
   48   HG23  VAL   7          HG23      VAL   7  -1.698   1.944  -1.130
   49    H    ASP   8           H        ASP   8  -0.701   6.920  -0.842
   50    HA   ASP   8           HA       ASP   8   1.414   6.562   1.199
   51    HB2  ASP   8           HB3      ASP   8  -0.068   8.995   0.139
   52    HB3  ASP   8           HB2      ASP   8   1.090   9.065   1.481
   53    H    ALA   9           H        ALA   9  -1.517   5.560   1.213
   54    HA   ALA   9           HA       ALA   9  -2.140   6.482   3.978
   55    HB1  ALA   9           HB1      ALA   9  -3.597   7.443   2.024
   56    HB2  ALA   9           HB2      ALA   9  -4.344   5.828   2.036
   57    HB3  ALA   9           HB3      ALA   9  -4.385   6.839   3.501
   58    H    CYS  10           H        CYS  10  -4.241   4.916   4.612
   59    HA   CYS  10           HA       CYS  10  -3.626   2.099   3.968
   60    HB2  CYS  10           HB2      CYS  10  -2.094   2.592   5.821
   61    HB3  CYS  10           HB3      CYS  10  -3.437   3.213   6.794
   62    H    SER  11           H        SER  11  -5.511   4.480   5.815
   63    HA   SER  11           HA       SER  11  -7.819   2.653   6.022
   64    HB2  SER  11           HB3      SER  11  -7.455   5.533   6.932
   65    HB3  SER  11           HB2      SER  11  -8.860   4.504   7.283
   66    HG   SER  11           HG       SER  11  -7.315   4.512   8.996
   67    H    GLU  12           H        GLU  12  -6.588   5.060   3.903
   68    HA   GLU  12           HA       GLU  12  -9.221   5.777   2.779
   69    HB2  GLU  12           HB3      GLU  12  -6.383   6.593   2.090
   70    HB3  GLU  12           HB2      GLU  12  -7.795   7.092   1.146
   71    HG2  GLU  12           HG2      GLU  12  -7.644   7.619   4.108
   72    HG3  GLU  12           HG3      GLU  12  -6.864   8.703   2.942
   73    H    CYS  13           H        CYS  13  -6.541   3.599   2.158
   74    HA   CYS  13           HA       CYS  13  -7.230   3.028  -0.613
   75    HB2  CYS  13           HB3      CYS  13  -4.967   2.685   0.636
   76    HB3  CYS  13           HB2      CYS  13  -5.691   1.169   1.198
   77    H    CYS  14           H        CYS  14  -7.830   0.782  -1.339
   78    HA   CYS  14           HA       CYS  14 -10.310  -0.011  -0.048
   79    HB2  CYS  14           HB2      CYS  14  -8.860  -0.600  -2.542
   80    HB3  CYS  14           HB3      CYS  14  -9.794  -1.964  -1.908
   81    H    GLU  15           H        GLU  15  -7.172  -0.721   0.763
   82    HA   GLU  15           HA       GLU  15  -7.859  -3.467   1.719
   83    HB2  GLU  15           HB2      GLU  15  -5.796  -2.850   0.150
   84    HB3  GLU  15           HB3      GLU  15  -5.044  -2.431   1.698
   85    HG2  GLU  15           HG3      GLU  15  -5.259  -4.659   2.509
   86    HG3  GLU  15           HG2      GLU  15  -6.358  -5.107   1.191
   87    HA   PRO  16           HA       PRO  16  -7.625  -0.901   5.565
   88    HB2  PRO  16           HB2      PRO  16 -10.103  -2.073   6.506
   89    HB3  PRO  16           HB3      PRO  16  -9.820  -0.404   5.940
   90    HG2  PRO  16           HG2      PRO  16 -11.388  -2.281   4.643
   91    HG3  PRO  16           HG3      PRO  16 -10.663  -0.838   3.882
   92    HD2  PRO  16           HD3      PRO  16  -9.719  -3.693   3.845
   93    HD3  PRO  16           HD2      PRO  16  -9.710  -2.474   2.531
   94    H    ASP  17           H        ASP  17  -8.601  -4.324   5.232
   95    HA   ASP  17           HA       ASP  17  -7.666  -4.949   7.964
   96    HB2  ASP  17           HB2      ASP  17  -8.995  -6.601   5.801
   97    HB3  ASP  17           HB3      ASP  17  -8.409  -7.294   7.326
   98    H    LYS  18           H        LYS  18  -6.849  -5.818   4.584
   99    HA   LYS  18           HA       LYS  18  -4.391  -7.177   5.541
  100    HB2  LYS  18           HB3      LYS  18  -6.122  -8.007   3.708
  101    HB3  LYS  18           HB2      LYS  18  -5.161  -6.964   2.647
  102    HG2  LYS  18           HG3      LYS  18  -3.130  -8.214   3.229
  103    HG3  LYS  18           HG2      LYS  18  -4.077  -9.252   4.315
  104    HD2  LYS  18           HD2      LYS  18  -5.432 -10.018   2.408
  105    HD3  LYS  18           HD3      LYS  18  -4.487  -8.983   1.317
  106    HE2  LYS  18           HE2      LYS  18  -3.568 -11.153   1.092
  107    HE3  LYS  18           HE3      LYS  18  -2.426 -10.259   2.116
  108    HZ1  LYS  18           HZ1      LYS  18  -2.862 -12.451   2.974
  109    HZ2  LYS  18           HZ2      LYS  18  -3.423 -11.316   4.030
  110    HZ3  LYS  18           HZ3      LYS  18  -4.479 -12.146   3.074
  111    H    CYS  19           H        CYS  19  -4.480  -4.399   5.957
  112    HA   CYS  19           HA       CYS  19  -3.019  -3.040   3.814
  113    HB2  CYS  19           HB2      CYS  19  -4.670  -1.891   5.257
  114    HB3  CYS  19           HB3      CYS  19  -3.628  -2.171   6.660
  115    H    ILE  20           H        ILE  20  -0.935  -3.206   3.467
  116    HA   ILE  20           HA       ILE  20   0.856  -3.937   5.747
  117    HB   ILE  20           HB       ILE  20   1.690  -4.190   2.844
  118   HG12  ILE  20          HG12      ILE  20   1.067  -6.750   3.396
  119   HG13  ILE  20          HG13      ILE  20  -0.217  -5.950   4.319
  120   HG21  ILE  20          HG21      ILE  20   3.390  -4.391   4.632
  121   HG22  ILE  20          HG22      ILE  20   3.190  -5.908   3.724
  122   HG23  ILE  20          HG23      ILE  20   2.468  -5.737   5.342
  123   HD11  ILE  20          HD11      ILE  20   0.356  -5.626   1.358
  124   HD12  ILE  20          HD12      ILE  20  -0.888  -4.730   2.263
  125   HD13  ILE  20          HD13      ILE  20  -1.011  -6.498   2.093
  126    H    ILE  21           H        ILE  21   2.902  -2.907   5.910
  127    HA   ILE  21           HA       ILE  21   2.832  -0.126   4.852
  128    HB   ILE  21           HB       ILE  21   4.684  -1.126   7.052
  129   HG12  ILE  21          HG12      ILE  21   2.832   0.234   8.456
  130   HG13  ILE  21          HG13      ILE  21   1.782  -0.442   7.198
  131   HG21  ILE  21          HG21      ILE  21   5.227   1.041   5.987
  132   HG22  ILE  21          HG22      ILE  21   4.767   1.231   7.696
  133   HG23  ILE  21          HG23      ILE  21   3.607   1.643   6.411
  134   HD11  ILE  21          HD11      ILE  21   1.841  -1.884   9.173
  135   HD12  ILE  21          HD12      ILE  21   3.611  -2.019   9.036
  136   HD13  ILE  21          HD13      ILE  21   2.565  -2.707   7.770
  137    H    MET  22           H        MET  22   3.635  -0.309   2.848
  138    HA   MET  22           HA       MET  22   5.071  -0.628   1.100
  139    HB2  MET  22           HB2      MET  22   7.298   0.294   1.346
  140    HB3  MET  22           HB3      MET  22   6.091   1.309   2.141
  141    HG2  MET  22           HG2      MET  22   7.880   1.348   3.620
  142    HG3  MET  22           HG3      MET  22   6.826   0.105   4.319
  143    HE1  MET  22           HE1      MET  22  10.437  -1.236   5.122
  144    HE2  MET  22           HE2      MET  22   9.905   0.462   5.097
  145    HE3  MET  22           HE3      MET  22   8.850  -0.791   5.793
  146    H    LEU  23           H        LEU  23   6.102  -2.120  -0.069
  147    HA   LEU  23           HA       LEU  23   7.653  -4.190   1.395
  148    HB2  LEU  23           HB2      LEU  23   5.905  -5.578   1.166
  149    HB3  LEU  23           HB3      LEU  23   5.141  -4.598  -0.091
  150    HG   LEU  23           HG       LEU  23   7.163  -5.649  -1.536
  151   HD11  LEU  23          HD11      LEU  23   8.059  -6.927   0.371
  152   HD12  LEU  23          HD12      LEU  23   6.506  -7.785   0.518
  153   HD13  LEU  23          HD13      LEU  23   7.504  -7.995  -0.941
  154   HD21  LEU  23          HD21      LEU  23   4.757  -5.732  -2.060
  155   HD22  LEU  23          HD22      LEU  23   4.560  -7.080  -0.915
  156   HD23  LEU  23          HD23      LEU  23   5.558  -7.290  -2.374
  157    HA   PRO  24           HA       PRO  24   9.421  -4.199  -2.956
  158    HB2  PRO  24           HB2      PRO  24   7.996  -2.794  -5.003
  159    HB3  PRO  24           HB3      PRO  24   8.019  -4.556  -4.722
  160    HG2  PRO  24           HG3      PRO  24   5.814  -2.847  -4.421
  161    HG3  PRO  24           HG2      PRO  24   5.946  -4.525  -3.827
  162    HD2  PRO  24           HD2      PRO  24   6.314  -1.939  -2.347
  163    HD3  PRO  24           HD3      PRO  24   5.645  -3.503  -1.783
  164    H    THR  25           H        THR  25   9.154  -1.762  -1.140
  165    HA   THR  25           HA       THR  25  11.003  -0.016  -2.650
  166    HB   THR  25           HB       THR  25   9.709   2.025  -1.748
  167    HG1  THR  25           HG1      THR  25   7.958   1.551  -0.680
  168   HG21  THR  25          HG21      THR  25   8.224   2.103  -3.712
  169   HG22  THR  25          HG22      THR  25   8.467   0.358  -3.964
  170   HG23  THR  25          HG23      THR  25   9.837   1.481  -4.138
  171    H    TRP  26           H        TRP  26  12.426   1.132  -1.401
  172    HA   TRP  26           HA       TRP  26  12.869   0.132   1.287
  173    HB2  TRP  26           HB2      TRP  26  14.353   2.542   0.338
  174    HB3  TRP  26           HB3      TRP  26  14.944   1.102   1.185
  175    HD1  TRP  26           HD1      TRP  26  13.754   2.133  -2.373
  176    HE1  TRP  26           HE1      TRP  26  14.924   0.660  -4.117
  177    HE3  TRP  26           HE3      TRP  26  16.377  -0.896   0.814
  178    HZ2  TRP  26           HZ2      TRP  26  16.783  -1.449  -4.125
  179    HZ3  TRP  26           HZ3      TRP  26  17.856  -2.611  -0.151
  180    HH2  TRP  26           HH2      TRP  26  18.057  -2.880  -2.588
  181    HA   PRO  27           HA       PRO  27  11.758   4.608   2.775
  182    HB2  PRO  27           HB2      PRO  27  10.137   5.866   0.631
  183    HB3  PRO  27           HB3      PRO  27  11.569   6.503   1.487
  184    HG2  PRO  27           HG2      PRO  27  11.665   5.779  -1.098
  185    HG3  PRO  27           HG3      PRO  27  13.048   5.546   0.010
  186    HD2  PRO  27           HD3      PRO  27  10.978   3.539  -0.889
  187    HD3  PRO  27           HD2      PRO  27  12.760   3.366  -0.819
  188    HA   PRO  28           HA       PRO  28   7.662   3.579   4.241
  189    HB2  PRO  28           HB3      PRO  28   6.884   6.480   4.311
  190    HB3  PRO  28           HB2      PRO  28   6.869   5.268   5.625
  191    HG2  PRO  28           HG2      PRO  28   8.732   7.162   5.537
  192    HG3  PRO  28           HG3      PRO  28   9.144   5.492   6.020
  193    HD2  PRO  28           HD2      PRO  28   9.623   6.887   3.393
  194    HD3  PRO  28           HD3      PRO  28  10.686   5.776   4.311
  195    H    ARG  29           H        ARG  29   6.184   2.666   3.009
  196    HA   ARG  29           HA       ARG  29   4.451   4.292   1.268
  197    HB2  ARG  29           HB2      ARG  29   6.414   2.274   0.243
  198    HB3  ARG  29           HB3      ARG  29   4.816   2.346  -0.523
  199    HG2  ARG  29           HG3      ARG  29   5.139   4.679  -1.089
  200    HG3  ARG  29           HG2      ARG  29   6.660   4.729  -0.174
  201    HD2  ARG  29           HD2      ARG  29   7.711   3.198  -1.713
  202    HD3  ARG  29           HD3      ARG  29   6.178   2.926  -2.565
  203    HE   ARG  29           HE       ARG  29   6.294   5.340  -3.245
  204   HH11  ARG  29          HH11      ARG  29   9.282   3.669  -2.311
  205   HH12  ARG  29          HH12      ARG  29  10.296   4.746  -3.245
  206   HH21  ARG  29          HH21      ARG  29   7.639   6.700  -4.434
  207   HH22  ARG  29          HH22      ARG  29   9.371   6.451  -4.439
  208    H    TYR  30           H        TYR  30   3.090   2.236  -0.030
  209    HA   TYR  30           HA       TYR  30   2.217   0.242   1.958
  210    HB2  TYR  30           HB3      TYR  30   0.387   2.483   1.013
  211    HB3  TYR  30           HB2      TYR  30  -0.190   0.979   1.747
  212    HD1  TYR  30           HD1      TYR  30   1.277   4.248   2.374
  213    HD2  TYR  30           HD2      TYR  30   0.344   0.485   4.144
  214    HE1  TYR  30           HE1      TYR  30   1.517   5.239   4.607
  215    HE2  TYR  30           HE2      TYR  30   0.586   1.476   6.378
  216    HH   TYR  30           HH       TYR  30   1.894   3.513   7.358
  217    H    VAL  31           H        VAL  31   0.683  -1.310   1.059
  218    HA   VAL  31           HA       VAL  31   0.495  -1.232  -1.918
  219    HB   VAL  31           HB       VAL  31   1.161  -3.799  -0.426
  220   HG11  VAL  31          HG11      VAL  31   0.043  -4.029  -2.621
  221   HG12  VAL  31          HG12      VAL  31   1.703  -4.670  -2.638
  222   HG13  VAL  31          HG13      VAL  31   1.352  -3.086  -3.372
  223   HG21  VAL  31          HG21      VAL  31   3.053  -2.230  -0.179
  224   HG22  VAL  31          HG22      VAL  31   3.458  -3.620  -1.213
  225   HG23  VAL  31          HG23      VAL  31   3.107  -2.037  -1.947
  226    H    CYS  32           H        CYS  32  -1.314  -2.016  -2.800
  227    HA   CYS  32           HA       CYS  32  -3.336  -3.314  -1.033
  228    HB2  CYS  32           HB3      CYS  32  -3.780  -0.966  -2.911
  229    HB3  CYS  32           HB2      CYS  32  -5.087  -1.961  -2.249
  230    H    SER  33           H        SER  33  -3.927  -5.205  -1.874
  231    HA   SER  33           HA       SER  33  -3.823  -5.517  -4.850
  232    HB2  SER  33           HB2      SER  33  -2.909  -7.440  -2.697
  233    HB3  SER  33           HB3      SER  33  -3.155  -7.909  -4.392
  234    HG   SER  33           HG       SER  33  -0.972  -7.311  -3.943
  235    H    VAL  34           H        VAL  34  -5.978  -5.000  -2.768
  236    HA   VAL  34           HA       VAL  34  -7.675  -7.388  -2.991
  237    HB   VAL  34           HB       VAL  34  -9.363  -5.833  -1.791
  238   HG11  VAL  34          HG11      VAL  34  -8.129  -7.690  -0.743
  239   HG12  VAL  34          HG12      VAL  34  -8.368  -6.324   0.372
  240   HG13  VAL  34          HG13      VAL  34  -6.781  -6.582  -0.392
  241   HG21  VAL  34          HG21      VAL  34  -8.215  -3.696  -2.268
  242   HG22  VAL  34          HG22      VAL  34  -6.830  -4.233  -1.287
  243   HG23  VAL  34          HG23      VAL  34  -8.416  -3.975  -0.522
  Start of MODEL    9
    1    H1   CYS   1           H1       CYS   1 -10.893   5.085  -4.942
    2    H2   CYS   1           H2       CYS   1 -11.605   4.253  -6.174
    3    H3   CYS   1           H3       CYS   1 -12.414   4.477  -4.755
    4    HA   CYS   1           HA       CYS   1 -10.855   3.128  -3.562
    5    HB2  CYS   1           HB2      CYS   1 -12.857   2.104  -4.609
    6    HB3  CYS   1           HB3      CYS   1 -11.913   1.777  -6.071
    7    H    VAL   2           H        VAL   2  -8.980   1.929  -3.486
    8    HA   VAL   2           HA       VAL   2  -7.236   2.039  -5.902
    9    HB   VAL   2           HB       VAL   2  -6.146   2.414  -3.085
   10   HG11  VAL   2          HG11      VAL   2  -5.022   2.328  -5.826
   11   HG12  VAL   2          HG12      VAL   2  -4.387   3.616  -4.775
   12   HG13  VAL   2          HG13      VAL   2  -4.277   1.915  -4.263
   13   HG21  VAL   2          HG21      VAL   2  -7.651   4.310  -3.587
   14   HG22  VAL   2          HG22      VAL   2  -6.748   4.615  -5.091
   15   HG23  VAL   2          HG23      VAL   2  -5.944   4.809  -3.515
   16    H    SER   3           H        SER   3  -7.915  -0.071  -6.327
   17    HA   SER   3           HA       SER   3  -7.550  -2.223  -4.410
   18    HB2  SER   3           HB3      SER   3  -8.026  -2.278  -7.410
   19    HB3  SER   3           HB2      SER   3  -8.088  -3.689  -6.332
   20    HG   SER   3           HG       SER   3 -10.170  -2.768  -6.709
   21    H    SER   4           H        SER   4  -5.679  -0.971  -7.182
   22    HA   SER   4           HA       SER   4  -3.374  -2.615  -6.244
   23    HB2  SER   4           HB3      SER   4  -4.244  -2.307  -9.142
   24    HB3  SER   4           HB2      SER   4  -2.757  -3.103  -8.583
   25    HG   SER   4           HG       SER   4  -4.472  -4.597  -8.968
   26    H    GLY   5           H        GLY   5  -1.499  -1.563  -6.112
   27    HA2  GLY   5           HA2      GLY   5  -0.051   0.097  -7.417
   28    HA3  GLY   5           HA3      GLY   5  -1.423   1.206  -7.240
   29    H    ILE   6           H        ILE   6   0.437   2.491  -6.332
   30    HA   ILE   6           HA       ILE   6   1.131   1.784  -3.539
   31    HB   ILE   6           HB       ILE   6   2.075   4.076  -5.318
   32   HG12  ILE   6          HG13      ILE   6   2.977   2.018  -6.149
   33   HG13  ILE   6          HG12      ILE   6   4.263   2.890  -5.305
   34   HG21  ILE   6          HG21      ILE   6   3.916   4.260  -3.506
   35   HG22  ILE   6          HG22      ILE   6   2.767   3.394  -2.459
   36   HG23  ILE   6          HG23      ILE   6   2.318   4.964  -3.165
   37   HD11  ILE   6          HD11      ILE   6   4.321   0.447  -4.889
   38   HD12  ILE   6          HD12      ILE   6   2.714   0.557  -4.132
   39   HD13  ILE   6          HD13      ILE   6   4.103   1.392  -3.397
   40    H    VAL   7           H        VAL   7   0.779   3.194  -1.780
   41    HA   VAL   7           HA       VAL   7  -1.176   5.374  -2.205
   42    HB   VAL   7           HB       VAL   7  -2.504   4.562  -0.176
   43   HG11  VAL   7          HG11      VAL   7  -3.339   4.537  -2.494
   44   HG12  VAL   7          HG12      VAL   7  -2.673   2.900  -2.703
   45   HG13  VAL   7          HG13      VAL   7  -3.979   3.186  -1.527
   46   HG21  VAL   7          HG21      VAL   7  -2.523   1.899  -0.226
   47   HG22  VAL   7          HG22      VAL   7  -1.449   2.810   0.861
   48   HG23  VAL   7          HG23      VAL   7  -0.814   2.141  -0.660
   49    H    ASP   8           H        ASP   8  -1.082   7.029  -0.794
   50    HA   ASP   8           HA       ASP   8   1.246   7.049   1.035
   51    HB2  ASP   8           HB3      ASP   8  -0.635   9.217   0.038
   52    HB3  ASP   8           HB2      ASP   8   0.627   9.500   1.252
   53    H    ALA   9           H        ALA   9  -1.634   5.803   1.302
   54    HA   ALA   9           HA       ALA   9  -1.985   6.579   4.151
   55    HB1  ALA   9           HB1      ALA   9  -3.622   7.742   2.509
   56    HB2  ALA   9           HB2      ALA   9  -4.297   6.929   3.941
   57    HB3  ALA   9           HB3      ALA   9  -4.371   6.135   2.350
   58    H    CYS  10           H        CYS  10  -4.259   4.942   4.600
   59    HA   CYS  10           HA       CYS  10  -3.635   2.199   3.760
   60    HB2  CYS  10           HB3      CYS  10  -2.037   2.584   5.639
   61    HB3  CYS  10           HB2      CYS  10  -3.408   2.980   6.688
   62    H    SER  11           H        SER  11  -5.433   4.455   5.818
   63    HA   SER  11           HA       SER  11  -7.737   2.636   6.058
   64    HB2  SER  11           HB3      SER  11  -7.349   5.512   6.969
   65    HB3  SER  11           HB2      SER  11  -8.738   4.476   7.364
   66    HG   SER  11           HG       SER  11  -7.135   4.482   9.023
   67    H    GLU  12           H        GLU  12  -6.597   5.131   3.960
   68    HA   GLU  12           HA       GLU  12  -9.253   5.836   2.909
   69    HB2  GLU  12           HB2      GLU  12  -6.428   6.618   2.164
   70    HB3  GLU  12           HB3      GLU  12  -7.832   7.107   1.201
   71    HG2  GLU  12           HG2      GLU  12  -8.776   8.246   3.171
   72    HG3  GLU  12           HG3      GLU  12  -7.362   7.761   4.127
   73    H    CYS  13           H        CYS  13  -6.615   3.639   2.194
   74    HA   CYS  13           HA       CYS  13  -7.419   3.035  -0.538
   75    HB2  CYS  13           HB3      CYS  13  -5.112   2.693   0.646
   76    HB3  CYS  13           HB2      CYS  13  -5.828   1.184   1.238
   77    H    CYS  14           H        CYS  14  -8.074   0.772  -1.193
   78    HA   CYS  14           HA       CYS  14 -10.433   0.003   0.382
   79    HB2  CYS  14           HB2      CYS  14  -9.351  -0.811  -2.319
   80    HB3  CYS  14           HB3      CYS  14 -10.755  -1.604  -1.584
   81    H    GLU  15           H        GLU  15  -7.711  -0.531   1.428
   82    HA   GLU  15           HA       GLU  15  -7.979  -3.484   1.793
   83    HB2  GLU  15           HB2      GLU  15  -5.507  -1.783   1.431
   84    HB3  GLU  15           HB3      GLU  15  -5.433  -3.360   2.235
   85    HG2  GLU  15           HG2      GLU  15  -6.716  -3.106  -0.472
   86    HG3  GLU  15           HG3      GLU  15  -4.948  -3.154  -0.332
   87    HA   PRO  16           HA       PRO  16  -8.368  -1.600   5.970
   88    HB2  PRO  16           HB2      PRO  16 -10.210  -3.763   6.656
   89    HB3  PRO  16           HB3      PRO  16 -10.556  -2.022   6.466
   90    HG2  PRO  16           HG2      PRO  16 -11.483  -3.972   4.776
   91    HG3  PRO  16           HG3      PRO  16 -11.242  -2.265   4.313
   92    HD2  PRO  16           HD3      PRO  16  -9.474  -4.648   3.802
   93    HD3  PRO  16           HD2      PRO  16  -9.890  -3.287   2.713
   94    H    ASP  17           H        ASP  17  -8.088  -5.085   5.196
   95    HA   ASP  17           HA       ASP  17  -6.537  -5.469   7.723
   96    HB2  ASP  17           HB3      ASP  17  -8.131  -7.416   6.034
   97    HB3  ASP  17           HB2      ASP  17  -7.014  -7.926   7.314
   98    H    LYS  18           H        LYS  18  -6.544  -6.046   4.215
   99    HA   LYS  18           HA       LYS  18  -3.873  -7.296   4.327
  100    HB2  LYS  18           HB2      LYS  18  -5.945  -7.867   2.786
  101    HB3  LYS  18           HB3      LYS  18  -5.278  -6.579   1.768
  102    HG2  LYS  18           HG2      LYS  18  -3.134  -7.788   1.650
  103    HG3  LYS  18           HG3      LYS  18  -3.804  -9.076   2.673
  104    HD2  LYS  18           HD3      LYS  18  -5.535  -9.517   0.962
  105    HD3  LYS  18           HD2      LYS  18  -4.841  -8.240  -0.058
  106    HE2  LYS  18           HE2      LYS  18  -3.975 -10.271  -0.905
  107    HE3  LYS  18           HE3      LYS  18  -2.652  -9.540   0.025
  108    HZ1  LYS  18           HZ1      LYS  18  -2.875 -11.878   0.485
  109    HZ2  LYS  18           HZ2      LYS  18  -3.213 -11.006   1.844
  110    HZ3  LYS  18           HZ3      LYS  18  -4.439 -11.685   0.974
  111    H    CYS  19           H        CYS  19  -4.091  -4.553   5.229
  112    HA   CYS  19           HA       CYS  19  -2.736  -2.998   3.087
  113    HB2  CYS  19           HB3      CYS  19  -4.617  -1.944   4.291
  114    HB3  CYS  19           HB2      CYS  19  -3.758  -2.167   5.822
  115    H    ILE  20           H        ILE  20  -0.606  -2.753   3.041
  116    HA   ILE  20           HA       ILE  20   0.933  -3.456   5.508
  117    HB   ILE  20           HB       ILE  20   2.152  -3.451   2.728
  118   HG12  ILE  20          HG12      ILE  20   1.816  -6.091   3.139
  119   HG13  ILE  20          HG13      ILE  20   0.340  -5.501   3.922
  120   HG21  ILE  20          HG21      ILE  20   3.650  -3.508   4.699
  121   HG22  ILE  20          HG22      ILE  20   3.755  -4.999   3.734
  122   HG23  ILE  20          HG23      ILE  20   2.838  -4.990   5.259
  123   HD11  ILE  20          HD11      ILE  20  -0.068  -6.080   1.581
  124   HD12  ILE  20          HD12      ILE  20   1.195  -4.937   1.066
  125   HD13  ILE  20          HD13      ILE  20  -0.287  -4.333   1.846
  126    H    ILE  21           H        ILE  21   2.796  -2.228   6.012
  127    HA   ILE  21           HA       ILE  21   2.592   0.582   5.033
  128    HB   ILE  21           HB       ILE  21   3.878  -0.399   7.624
  129   HG12  ILE  21          HG13      ILE  21   1.740   1.025   8.466
  130   HG13  ILE  21          HG12      ILE  21   1.077   0.358   6.964
  131   HG21  ILE  21          HG21      ILE  21   4.767   1.750   6.779
  132   HG22  ILE  21          HG22      ILE  21   3.862   1.947   8.299
  133   HG23  ILE  21          HG23      ILE  21   3.114   2.410   6.751
  134   HD11  ILE  21          HD11      ILE  21   0.547  -1.071   8.877
  135   HD12  ILE  21          HD12      ILE  21   1.608  -1.914   7.723
  136   HD13  ILE  21          HD13      ILE  21   2.282  -1.253   9.232
  137    H    MET  22           H        MET  22   3.838   0.519   3.248
  138    HA   MET  22           HA       MET  22   5.711   0.533   1.923
  139    HB2  MET  22           HB3      MET  22   7.224   1.077   4.500
  140    HB3  MET  22           HB2      MET  22   7.769   1.425   2.852
  141    HG2  MET  22           HG2      MET  22   6.089   3.116   2.568
  142    HG3  MET  22           HG3      MET  22   5.316   2.685   4.105
  143    HE1  MET  22           HE1      MET  22   6.761   6.203   4.978
  144    HE2  MET  22           HE2      MET  22   5.998   5.676   3.459
  145    HE3  MET  22           HE3      MET  22   5.335   5.138   5.020
  146    H    LEU  23           H        LEU  23   6.235  -1.311   0.956
  147    HA   LEU  23           HA       LEU  23   8.144  -3.087   2.327
  148    HB2  LEU  23           HB2      LEU  23   6.396  -4.333   3.058
  149    HB3  LEU  23           HB3      LEU  23   5.317  -3.822   1.756
  150    HG   LEU  23           HG       LEU  23   6.925  -5.352   0.290
  151   HD11  LEU  23          HD11      LEU  23   8.480  -5.844   2.141
  152   HD12  LEU  23          HD12      LEU  23   7.149  -6.602   3.048
  153   HD13  LEU  23          HD13      LEU  23   7.704  -7.319   1.517
  154   HD21  LEU  23          HD21      LEU  23   4.499  -5.643   0.605
  155   HD22  LEU  23          HD22      LEU  23   4.805  -6.483   2.143
  156   HD23  LEU  23          HD23      LEU  23   5.359  -7.200   0.612
  157    HA   PRO  24           HA       PRO  24   8.211  -4.409  -2.267
  158    HB2  PRO  24           HB2      PRO  24   6.351  -2.727  -3.834
  159    HB3  PRO  24           HB3      PRO  24   6.452  -4.507  -3.727
  160    HG2  PRO  24           HG2      PRO  24   4.398  -3.118  -2.680
  161    HG3  PRO  24           HG3      PRO  24   5.026  -4.617  -1.937
  162    HD2  PRO  24           HD3      PRO  24   5.601  -1.745  -1.191
  163    HD3  PRO  24           HD2      PRO  24   5.163  -3.119  -0.127
  164    H    THR  25           H        THR  25   8.885  -3.414  -4.505
  165    HA   THR  25           HA       THR  25  10.419  -2.126  -5.610
  166    HB   THR  25           HB       THR  25  10.115   0.358  -5.586
  167    HG1  THR  25           HG1      THR  25   8.450   1.226  -4.333
  168   HG21  THR  25          HG21      THR  25   7.847   0.347  -6.552
  169   HG22  THR  25          HG22      THR  25   8.806  -1.043  -7.115
  170   HG23  THR  25          HG23      THR  25   7.563  -1.268  -5.861
  171    H    TRP  26           H        TRP  26  12.186  -0.395  -5.468
  172    HA   TRP  26           HA       TRP  26  14.005  -1.118  -3.403
  173    HB2  TRP  26           HB2      TRP  26  14.351   1.516  -4.787
  174    HB3  TRP  26           HB3      TRP  26  15.551   0.267  -4.412
  175    HD1  TRP  26           HD1      TRP  26  12.616   0.883  -6.888
  176    HE1  TRP  26           HE1      TRP  26  13.046  -0.427  -9.053
  177    HE3  TRP  26           HE3      TRP  26  16.951  -1.472  -5.515
  178    HZ2  TRP  26           HZ2      TRP  26  15.014  -2.167 -10.057
  179    HZ3  TRP  26           HZ3      TRP  26  18.062  -2.934  -7.157
  180    HH2  TRP  26           HH2      TRP  26  17.105  -3.272  -9.398
  181    HA   PRO  27           HA       PRO  27  12.998   2.872  -1.014
  182    HB2  PRO  27           HB2      PRO  27  10.783   4.398  -2.076
  183    HB3  PRO  27           HB3      PRO  27  12.516   4.824  -2.114
  184    HG2  PRO  27           HG2      PRO  27  10.968   4.241  -4.338
  185    HG3  PRO  27           HG3      PRO  27  12.750   4.152  -4.267
  186    HD2  PRO  27           HD3      PRO  27  10.720   1.944  -4.007
  187    HD3  PRO  27           HD2      PRO  27  12.285   1.951  -4.881
  188    HA   PRO  28           HA       PRO  28   9.465   1.320   1.275
  189    HB2  PRO  28           HB2      PRO  28   9.209   3.672   3.000
  190    HB3  PRO  28           HB3      PRO  28   9.949   2.091   3.373
  191    HG2  PRO  28           HG3      PRO  28  11.352   4.430   3.149
  192    HG3  PRO  28           HG2      PRO  28  12.049   2.811   2.861
  193    HD2  PRO  28           HD2      PRO  28  11.084   4.860   0.869
  194    HD3  PRO  28           HD3      PRO  28  12.523   3.794   0.812
  195    H    ARG  29           H        ARG  29   7.532   1.177   0.285
  196    HA   ARG  29           HA       ARG  29   5.726   3.532   0.313
  197    HB2  ARG  29           HB2      ARG  29   6.541   2.002  -2.171
  198    HB3  ARG  29           HB3      ARG  29   5.024   2.912  -2.080
  199    HG2  ARG  29           HG2      ARG  29   6.191   4.983  -1.797
  200    HG3  ARG  29           HG3      ARG  29   7.742   4.150  -1.563
  201    HD2  ARG  29           HD2      ARG  29   7.669   3.333  -3.872
  202    HD3  ARG  29           HD3      ARG  29   6.092   4.111  -4.114
  203    HE   ARG  29           HE       ARG  29   8.049   6.029  -3.243
  204   HH11  ARG  29          HH11      ARG  29   7.053   4.185  -6.103
  205   HH12  ARG  29          HH12      ARG  29   7.698   5.369  -7.218
  206   HH21  ARG  29          HH21      ARG  29   8.866   7.530  -4.715
  207   HH22  ARG  29          HH22      ARG  29   8.719   7.252  -6.436
  208    H    TYR  30           H        TYR  30   3.569   3.053   0.464
  209    HA   TYR  30           HA       TYR  30   2.836   0.438   1.481
  210    HB2  TYR  30           HB2      TYR  30   1.138   2.810   0.629
  211    HB3  TYR  30           HB3      TYR  30   0.524   1.387   1.482
  212    HD1  TYR  30           HD1      TYR  30   2.947   4.226   1.831
  213    HD2  TYR  30           HD2      TYR  30   0.521   1.348   3.833
  214    HE1  TYR  30           HE1      TYR  30   3.414   5.325   3.976
  215    HE2  TYR  30           HE2      TYR  30   0.991   2.445   5.977
  216    HH   TYR  30           HH       TYR  30   3.434   4.556   6.475
  217    H    VAL  31           H        VAL  31   1.137  -0.973   0.584
  218    HA   VAL  31           HA       VAL  31   0.622  -0.645  -2.301
  219    HB   VAL  31           HB       VAL  31   2.806  -1.902  -2.041
  220   HG11  VAL  31          HG11      VAL  31   2.202  -3.282  -0.087
  221   HG12  VAL  31          HG12      VAL  31   2.801  -4.249  -1.456
  222   HG13  VAL  31          HG13      VAL  31   1.058  -4.191  -1.104
  223   HG21  VAL  31          HG21      VAL  31   1.437  -1.965  -4.090
  224   HG22  VAL  31          HG22      VAL  31   2.349  -3.470  -3.823
  225   HG23  VAL  31          HG23      VAL  31   0.605  -3.412  -3.471
  226    H    CYS  32           H        CYS  32  -1.282  -1.348  -2.956
  227    HA   CYS  32           HA       CYS  32  -2.919  -2.937  -1.021
  228    HB2  CYS  32           HB2      CYS  32  -3.685  -0.731  -2.949
  229    HB3  CYS  32           HB3      CYS  32  -4.880  -1.828  -2.238
  230    H    SER  33           H        SER  33  -3.757  -4.815  -1.699
  231    HA   SER  33           HA       SER  33  -3.675  -5.395  -4.633
  232    HB2  SER  33           HB2      SER  33  -2.847  -7.189  -2.335
  233    HB3  SER  33           HB3      SER  33  -3.087  -7.757  -4.001
  234    HG   SER  33           HG       SER  33  -0.889  -7.217  -3.554
  235    H    VAL  34           H        VAL  34  -5.735  -4.650  -2.471
  236    HA   VAL  34           HA       VAL  34  -7.848  -5.163  -1.785
  237    HB   VAL  34           HB       VAL  34  -8.179  -4.418  -4.120
  238   HG11  VAL  34          HG11      VAL  34  -9.020  -6.199  -5.769
  239   HG12  VAL  34          HG12      VAL  34  -7.264  -6.015  -5.552
  240   HG13  VAL  34          HG13      VAL  34  -8.121  -7.360  -4.763
  241   HG21  VAL  34          HG21      VAL  34 -10.074  -4.809  -2.590
  242   HG22  VAL  34          HG22      VAL  34 -10.503  -5.047  -4.301
  243   HG23  VAL  34          HG23      VAL  34 -10.240  -6.456  -3.245
  Start of MODEL   10
    1    H1   CYS   1           H1       CYS   1 -11.801   2.580  -6.913
    2    H2   CYS   1           H2       CYS   1 -12.884   2.490  -5.673
    3    H3   CYS   1           H3       CYS   1 -11.946   1.186  -6.045
    4    HA   CYS   1           HA       CYS   1 -11.004   3.759  -4.984
    5    HB2  CYS   1           HB2      CYS   1 -10.390   2.413  -2.991
    6    HB3  CYS   1           HB3      CYS   1 -12.135   2.489  -3.277
    7    H    VAL   2           H        VAL   2  -8.702   3.006  -3.830
    8    HA   VAL   2           HA       VAL   2  -6.963   2.516  -6.136
    9    HB   VAL   2           HB       VAL   2  -6.103   2.915  -3.239
   10   HG11  VAL   2          HG11      VAL   2  -4.363   2.095  -4.793
   11   HG12  VAL   2          HG12      VAL   2  -4.018   3.740  -4.208
   12   HG13  VAL   2          HG13      VAL   2  -4.661   3.496  -5.850
   13   HG21  VAL   2          HG21      VAL   2  -7.584   4.769  -3.928
   14   HG22  VAL   2          HG22      VAL   2  -6.545   5.059  -5.344
   15   HG23  VAL   2          HG23      VAL   2  -5.902   5.303  -3.702
   16    H    SER   3           H        SER   3  -8.085   0.356  -6.282
   17    HA   SER   3           HA       SER   3  -7.537  -1.797  -4.508
   18    HB2  SER   3           HB3      SER   3  -8.086  -1.802  -7.495
   19    HB3  SER   3           HB2      SER   3  -8.112  -3.240  -6.451
   20    HG   SER   3           HG       SER   3 -10.206  -2.313  -6.739
   21    H    SER   4           H        SER   4  -5.666  -0.536  -7.270
   22    HA   SER   4           HA       SER   4  -3.410  -2.283  -6.406
   23    HB2  SER   4           HB3      SER   4  -4.254  -1.843  -9.295
   24    HB3  SER   4           HB2      SER   4  -2.828  -2.748  -8.744
   25    HG   SER   4           HG       SER   4  -4.628  -4.119  -9.197
   26    H    GLY   5           H        GLY   5  -1.612  -1.206  -6.060
   27    HA2  GLY   5           HA3      GLY   5  -0.075   0.432  -7.386
   28    HA3  GLY   5           HA2      GLY   5  -1.417   1.564  -7.133
   29    H    ILE   6           H        ILE   6   0.246   2.872  -6.103
   30    HA   ILE   6           HA       ILE   6   1.078   1.940  -3.411
   31    HB   ILE   6           HB       ILE   6   1.859   4.427  -4.992
   32   HG12  ILE   6          HG12      ILE   6   2.865   2.532  -6.014
   33   HG13  ILE   6          HG13      ILE   6   4.123   3.347  -5.077
   34   HG21  ILE   6          HG21      ILE   6   3.707   4.573  -3.188
   35   HG22  ILE   6          HG22      ILE   6   2.637   3.542  -2.209
   36   HG23  ILE   6          HG23      ILE   6   2.072   5.135  -2.766
   37   HD11  ILE   6          HD11      ILE   6   4.239   0.864  -4.947
   38   HD12  ILE   6          HD12      ILE   6   4.012   1.628  -3.355
   39   HD13  ILE   6          HD13      ILE   6   2.635   0.854  -4.175
   40    H    VAL   7           H        VAL   7   0.683   3.138  -1.528
   41    HA   VAL   7           HA       VAL   7  -1.371   5.257  -1.691
   42    HB   VAL   7           HB       VAL   7  -2.648   4.167   0.230
   43   HG11  VAL   7          HG11      VAL   7  -2.992   4.065  -2.490
   44   HG12  VAL   7          HG12      VAL   7  -3.119   2.351  -2.030
   45   HG13  VAL   7          HG13      VAL   7  -4.191   3.556  -1.277
   46   HG21  VAL   7          HG21      VAL   7  -0.756   2.365   0.509
   47   HG22  VAL   7          HG22      VAL   7  -2.460   1.918   0.758
   48   HG23  VAL   7          HG23      VAL   7  -1.649   1.513  -0.773
   49    H    ASP   8           H        ASP   8  -1.298   6.750  -0.125
   50    HA   ASP   8           HA       ASP   8   1.013   6.593   1.731
   51    HB2  ASP   8           HB3      ASP   8   0.401   8.598   0.143
   52    HB3  ASP   8           HB2      ASP   8  -0.791   8.991   1.396
   53    H    ALA   9           H        ALA   9  -1.888   5.375   1.807
   54    HA   ALA   9           HA       ALA   9  -2.270   5.806   4.710
   55    HB1  ALA   9           HB1      ALA   9  -3.722   7.427   3.297
   56    HB2  ALA   9           HB2      ALA   9  -4.669   5.979   2.878
   57    HB3  ALA   9           HB3      ALA   9  -4.516   6.482   4.579
   58    H    CYS  10           H        CYS  10  -4.755   4.448   4.880
   59    HA   CYS  10           HA       CYS  10  -4.439   1.793   3.646
   60    HB2  CYS  10           HB2      CYS  10  -2.972   1.594   5.595
   61    HB3  CYS  10           HB3      CYS  10  -4.255   2.193   6.658
   62    H    SER  11           H        SER  11  -6.106   3.978   5.888
   63    HA   SER  11           HA       SER  11  -8.611   2.481   5.859
   64    HB2  SER  11           HB3      SER  11  -7.991   5.311   6.785
   65    HB3  SER  11           HB2      SER  11  -9.504   4.429   7.084
   66    HG   SER  11           HG       SER  11  -8.028   4.286   8.853
   67    H    GLU  12           H        GLU  12  -7.098   4.926   3.913
   68    HA   GLU  12           HA       GLU  12  -9.606   5.757   2.606
   69    HB2  GLU  12           HB3      GLU  12  -6.696   6.502   2.204
   70    HB3  GLU  12           HB2      GLU  12  -7.990   7.062   1.132
   71    HG2  GLU  12           HG2      GLU  12  -9.106   8.148   3.024
   72    HG3  GLU  12           HG3      GLU  12  -7.821   7.588   4.112
   73    H    CYS  13           H        CYS  13  -6.941   3.532   2.139
   74    HA   CYS  13           HA       CYS  13  -7.525   3.014  -0.687
   75    HB2  CYS  13           HB2      CYS  13  -5.250   2.800   0.438
   76    HB3  CYS  13           HB3      CYS  13  -5.862   1.328   1.213
   77    H    CYS  14           H        CYS  14  -7.815   0.559  -1.305
   78    HA   CYS  14           HA       CYS  14 -10.394  -0.259  -0.301
   79    HB2  CYS  14           HB2      CYS  14  -8.544  -2.043  -1.873
   80    HB3  CYS  14           HB3      CYS  14 -10.313  -1.985  -1.894
   81    H    GLU  15           H        GLU  15  -7.161  -0.919   0.711
   82    HA   GLU  15           HA       GLU  15  -8.036  -3.291   2.291
   83    HB2  GLU  15           HB3      GLU  15  -5.290  -2.253   1.508
   84    HB3  GLU  15           HB2      GLU  15  -5.537  -3.542   2.697
   85    HG2  GLU  15           HG2      GLU  15  -6.693  -3.753  -0.078
   86    HG3  GLU  15           HG3      GLU  15  -5.003  -4.184   0.245
   87    HA   PRO  16           HA       PRO  16  -8.031   0.020   5.508
   88    HB2  PRO  16           HB3      PRO  16  -9.995  -1.686   6.905
   89    HB3  PRO  16           HB2      PRO  16 -10.186  -0.019   6.295
   90    HG2  PRO  16           HG3      PRO  16 -11.443  -2.152   5.198
   91    HG3  PRO  16           HG2      PRO  16 -10.948  -0.723   4.247
   92    HD2  PRO  16           HD2      PRO  16  -9.613  -3.419   4.484
   93    HD3  PRO  16           HD3      PRO  16  -9.869  -2.392   3.039
   94    H    ASP  17           H        ASP  17  -8.003  -3.516   5.991
   95    HA   ASP  17           HA       ASP  17  -6.134  -3.112   8.291
   96    HB2  ASP  17           HB2      ASP  17  -8.388  -5.114   8.001
   97    HB3  ASP  17           HB3      ASP  17  -7.085  -5.293   9.191
   98    H    LYS  18           H        LYS  18  -6.947  -4.836   5.361
   99    HA   LYS  18           HA       LYS  18  -4.703  -6.737   5.705
  100    HB2  LYS  18           HB2      LYS  18  -7.192  -6.994   4.594
  101    HB3  LYS  18           HB3      LYS  18  -6.211  -6.690   3.152
  102    HG2  LYS  18           HG2      LYS  18  -5.339  -8.771   5.144
  103    HG3  LYS  18           HG3      LYS  18  -6.633  -9.144   3.988
  104    HD2  LYS  18           HD3      LYS  18  -5.123  -8.549   2.121
  105    HD3  LYS  18           HD2      LYS  18  -3.832  -8.195   3.289
  106    HE2  LYS  18           HE2      LYS  18  -3.891 -10.524   4.071
  107    HE3  LYS  18           HE3      LYS  18  -5.186 -10.887   2.911
  108    HZ1  LYS  18           HZ1      LYS  18  -3.040 -11.542   2.080
  109    HZ2  LYS  18           HZ2      LYS  18  -2.459 -10.004   2.221
  110    HZ3  LYS  18           HZ3      LYS  18  -3.660 -10.337   1.140
  111    H    CYS  19           H        CYS  19  -4.279  -3.791   5.359
  112    HA   CYS  19           HA       CYS  19  -3.071  -3.567   2.676
  113    HB2  CYS  19           HB2      CYS  19  -2.603  -1.272   3.272
  114    HB3  CYS  19           HB3      CYS  19  -4.288  -1.653   3.658
  115    H    ILE  20           H        ILE  20  -0.877  -3.225   2.258
  116    HA   ILE  20           HA       ILE  20   0.910  -4.416   4.315
  117    HB   ILE  20           HB       ILE  20   1.756  -3.798   1.465
  118   HG12  ILE  20          HG12      ILE  20   0.810  -6.553   2.095
  119   HG13  ILE  20          HG13      ILE  20  -0.447  -5.326   1.868
  120   HG21  ILE  20          HG21      ILE  20   3.485  -4.439   3.123
  121   HG22  ILE  20          HG22      ILE  20   3.312  -5.660   1.840
  122   HG23  ILE  20          HG23      ILE  20   2.602  -5.951   3.446
  123   HD11  ILE  20          HD11      ILE  20   0.020  -6.515  -0.220
  124   HD12  ILE  20          HD12      ILE  20   1.732  -6.040  -0.121
  125   HD13  ILE  20          HD13      ILE  20   0.477  -4.801  -0.357
  126    H    ILE  21           H        ILE  21   2.940  -3.495   4.804
  127    HA   ILE  21           HA       ILE  21   2.853  -0.537   4.849
  128    HB   ILE  21           HB       ILE  21   5.025  -2.168   6.192
  129   HG12  ILE  21          HG13      ILE  21   3.278  -1.875   8.241
  130   HG13  ILE  21          HG12      ILE  21   2.136  -2.130   6.910
  131   HG21  ILE  21          HG21      ILE  21   5.157   0.305   6.191
  132   HG22  ILE  21          HG22      ILE  21   3.577   0.378   7.006
  133   HG23  ILE  21          HG23      ILE  21   4.971  -0.356   7.833
  134   HD11  ILE  21          HD11      ILE  21   2.682  -4.238   8.024
  135   HD12  ILE  21          HD12      ILE  21   4.408  -3.988   7.668
  136   HD13  ILE  21          HD13      ILE  21   3.253  -4.238   6.338
  137    H    MET  22           H        MET  22   4.876   0.687   4.492
  138    HA   MET  22           HA       MET  22   5.900   0.377   1.889
  139    HB2  MET  22           HB3      MET  22   7.253   1.763   4.234
  140    HB3  MET  22           HB2      MET  22   7.615   2.014   2.520
  141    HG2  MET  22           HG2      MET  22   5.163   2.724   2.278
  142    HG3  MET  22           HG3      MET  22   5.141   2.816   4.049
  143    HE1  MET  22           HE1      MET  22   7.375   5.810   4.903
  144    HE2  MET  22           HE2      MET  22   7.625   4.063   5.135
  145    HE3  MET  22           HE3      MET  22   6.018   4.776   5.411
  146    H    LEU  23           H        LEU  23   6.879  -1.403   1.178
  147    HA   LEU  23           HA       LEU  23   9.457  -2.138   2.381
  148    HB2  LEU  23           HB3      LEU  23   8.368  -3.656   3.696
  149    HB3  LEU  23           HB2      LEU  23   7.009  -3.816   2.580
  150    HG   LEU  23           HG       LEU  23   8.747  -5.099   1.080
  151   HD11  LEU  23          HD11      LEU  23  10.696  -4.617   2.514
  152   HD12  LEU  23          HD12      LEU  23  10.394  -6.365   2.372
  153   HD13  LEU  23          HD13      LEU  23   9.921  -5.497   3.853
  154   HD21  LEU  23          HD21      LEU  23   6.691  -6.035   2.067
  155   HD22  LEU  23          HD22      LEU  23   7.564  -6.330   3.590
  156   HD23  LEU  23          HD23      LEU  23   8.037  -7.199   2.110
  157    HA   PRO  24           HA       PRO  24   8.952  -4.544  -1.868
  158    HB2  PRO  24           HB3      PRO  24   6.666  -3.019  -3.090
  159    HB3  PRO  24           HB2      PRO  24   7.068  -4.757  -3.215
  160    HG2  PRO  24           HG2      PRO  24   5.055  -3.962  -1.693
  161    HG3  PRO  24           HG3      PRO  24   6.172  -5.233  -1.117
  162    HD2  PRO  24           HD3      PRO  24   6.100  -2.301  -0.408
  163    HD3  PRO  24           HD2      PRO  24   6.288  -3.720   0.669
  164    H    THR  25           H        THR  25   9.614  -3.892  -4.087
  165    HA   THR  25           HA       THR  25  10.968  -2.644  -5.451
  166    HB   THR  25           HB       THR  25  10.303  -0.282  -5.947
  167    HG1  THR  25           HG1      THR  25   8.487   0.566  -4.901
  168   HG21  THR  25          HG21      THR  25   8.093  -0.831  -6.887
  169   HG22  THR  25          HG22      THR  25   9.263  -2.147  -7.148
  170   HG23  THR  25          HG23      THR  25   8.028  -2.293  -5.874
  171    H    TRP  26           H        TRP  26  12.334  -0.480  -5.638
  172    HA   TRP  26           HA       TRP  26  14.210  -0.573  -3.468
  173    HB2  TRP  26           HB3      TRP  26  14.939   1.711  -4.781
  174    HB3  TRP  26           HB2      TRP  26  15.448   0.071  -5.204
  175    HD1  TRP  26           HD1      TRP  26  13.628  -1.161  -7.096
  176    HE1  TRP  26           HE1      TRP  26  12.657  -0.116  -9.236
  177    HE3  TRP  26           HE3      TRP  26  14.414   3.767  -5.970
  178    HZ2  TRP  26           HZ2      TRP  26  12.348   2.460 -10.316
  179    HZ3  TRP  26           HZ3      TRP  26  13.772   5.470  -7.630
  180    HH2  TRP  26           HH2      TRP  26  12.753   4.822  -9.774
  181    HA   PRO  27           HA       PRO  27  12.557   3.616  -1.933
  182    HB2  PRO  27           HB3      PRO  27  10.096   4.457  -3.204
  183    HB3  PRO  27           HB2      PRO  27  11.712   5.196  -3.367
  184    HG2  PRO  27           HG2      PRO  27  10.332   3.904  -5.393
  185    HG3  PRO  27           HG3      PRO  27  12.096   4.173  -5.356
  186    HD2  PRO  27           HD2      PRO  27  10.532   1.697  -4.659
  187    HD3  PRO  27           HD3      PRO  27  12.099   1.865  -5.510
  188    HA   PRO  28           HA       PRO  28   9.664   1.398   0.791
  189    HB2  PRO  28           HB3      PRO  28   9.755   3.922   2.412
  190    HB3  PRO  28           HB2      PRO  28  10.087   2.239   2.914
  191    HG2  PRO  28           HG2      PRO  28  12.060   4.006   2.595
  192    HG3  PRO  28           HG3      PRO  28  12.256   2.298   2.113
  193    HD2  PRO  28           HD2      PRO  28  11.761   4.718   0.393
  194    HD3  PRO  28           HD3      PRO  28  12.815   3.300   0.102
  195    H    ARG  29           H        ARG  29   7.668   1.237  -0.062
  196    HA   ARG  29           HA       ARG  29   5.778   3.489   0.312
  197    HB2  ARG  29           HB2      ARG  29   6.408   2.197  -2.355
  198    HB3  ARG  29           HB3      ARG  29   4.879   3.038  -2.047
  199    HG2  ARG  29           HG2      ARG  29   5.977   5.126  -1.749
  200    HG3  ARG  29           HG3      ARG  29   7.574   4.358  -1.636
  201    HD2  ARG  29           HD2      ARG  29   7.330   3.613  -4.002
  202    HD3  ARG  29           HD3      ARG  29   5.798   4.505  -4.095
  203    HE   ARG  29           HE       ARG  29   7.816   6.286  -3.194
  204   HH11  ARG  29          HH11      ARG  29   6.943   4.502  -6.130
  205   HH12  ARG  29          HH12      ARG  29   7.691   5.675  -7.191
  206   HH21  ARG  29          HH21      ARG  29   8.768   7.773  -4.595
  207   HH22  ARG  29          HH22      ARG  29   8.720   7.517  -6.324
  208    H    TYR  30           H        TYR  30   3.618   2.888   0.482
  209    HA   TYR  30           HA       TYR  30   3.103   0.186   1.421
  210    HB2  TYR  30           HB2      TYR  30   1.276   2.541   0.845
  211    HB3  TYR  30           HB3      TYR  30   0.717   1.014   1.542
  212    HD1  TYR  30           HD1      TYR  30   2.696   4.071   2.159
  213    HD2  TYR  30           HD2      TYR  30   1.144   0.489   3.864
  214    HE1  TYR  30           HE1      TYR  30   3.192   4.927   4.407
  215    HE2  TYR  30           HE2      TYR  30   1.644   1.340   6.113
  216    HH   TYR  30           HH       TYR  30   1.912   3.720   7.160
  217    H    VAL  31           H        VAL  31   1.523  -1.303   0.578
  218    HA   VAL  31           HA       VAL  31   0.755  -0.911  -2.267
  219    HB   VAL  31           HB       VAL  31   2.097  -3.459  -1.249
  220   HG11  VAL  31          HG11      VAL  31   0.319  -3.894  -2.917
  221   HG12  VAL  31          HG12      VAL  31   1.940  -4.274  -3.546
  222   HG13  VAL  31          HG13      VAL  31   1.121  -2.774  -4.045
  223   HG21  VAL  31          HG21      VAL  31   3.703  -1.618  -1.635
  224   HG22  VAL  31          HG22      VAL  31   3.910  -2.949  -2.798
  225   HG23  VAL  31          HG23      VAL  31   3.090  -1.449  -3.298
  226    H    CYS  32           H        CYS  32  -1.282  -1.419  -2.648
  227    HA   CYS  32           HA       CYS  32  -2.812  -2.789  -0.497
  228    HB2  CYS  32           HB3      CYS  32  -3.573  -0.941  -2.765
  229    HB3  CYS  32           HB2      CYS  32  -4.784  -1.930  -1.932
  230    H    SER  33           H        SER  33  -3.530  -4.785  -0.715
  231    HA   SER  33           HA       SER  33  -3.250  -6.105  -3.366
  232    HB2  SER  33           HB2      SER  33  -3.517  -7.206  -0.553
  233    HB3  SER  33           HB3      SER  33  -3.477  -8.214  -2.016
  234    HG   SER  33           HG       SER  33  -1.397  -7.964  -1.050
  235    H    VAL  34           H        VAL  34  -5.495  -4.354  -2.195
  236    HA   VAL  34           HA       VAL  34  -7.765  -4.215  -2.099
  237    HB   VAL  34           HB       VAL  34  -7.298  -4.220  -4.534
  238   HG11  VAL  34          HG11      VAL  34  -8.217  -6.247  -5.834
  239   HG12  VAL  34          HG12      VAL  34  -6.569  -6.336  -5.167
  240   HG13  VAL  34          HG13      VAL  34  -7.911  -7.160  -4.337
  241   HG21  VAL  34          HG21      VAL  34  -9.530  -3.701  -3.619
  242   HG22  VAL  34          HG22      VAL  34  -9.595  -4.397  -5.256
  243   HG23  VAL  34          HG23      VAL  34  -9.997  -5.404  -3.844
  Start of MODEL   11
    1    H1   CYS   1           H1       CYS   1 -12.822   3.014  -5.067
    2    H2   CYS   1           H2       CYS   1 -12.583   2.236  -3.632
    3    H3   CYS   1           H3       CYS   1 -11.679   1.830  -4.951
    4    HA   CYS   1           HA       CYS   1 -11.495   4.586  -4.375
    5    HB2  CYS   1           HB3      CYS   1  -9.855   3.808  -2.344
    6    HB3  CYS   1           HB2      CYS   1 -11.494   4.441  -2.135
    7    H    VAL   2           H        VAL   2  -9.265   1.943  -3.479
    8    HA   VAL   2           HA       VAL   2  -7.703   2.366  -5.963
    9    HB   VAL   2           HB       VAL   2  -6.376   2.414  -3.213
   10   HG11  VAL   2          HG11      VAL   2  -5.392   2.103  -5.938
   11   HG12  VAL   2          HG12      VAL   2  -4.650   3.501  -5.123
   12   HG13  VAL   2          HG13      VAL   2  -4.547   1.884  -4.387
   13   HG21  VAL   2          HG21      VAL   2  -7.647   4.504  -3.576
   14   HG22  VAL   2          HG22      VAL   2  -5.888   4.776  -3.566
   15   HG23  VAL   2          HG23      VAL   2  -6.777   4.753  -5.108
   16    H    SER   3           H        SER   3  -8.359   0.378  -6.644
   17    HA   SER   3           HA       SER   3  -8.421  -2.007  -5.096
   18    HB2  SER   3           HB2      SER   3  -8.099  -1.652  -8.093
   19    HB3  SER   3           HB3      SER   3  -8.527  -3.171  -7.277
   20    HG   SER   3           HG       SER   3 -10.376  -2.016  -8.033
   21    H    SER   4           H        SER   4  -5.900  -0.896  -7.434
   22    HA   SER   4           HA       SER   4  -3.925  -2.511  -5.905
   23    HB2  SER   4           HB2      SER   4  -4.204  -2.615  -8.930
   24    HB3  SER   4           HB3      SER   4  -2.959  -3.432  -7.960
   25    HG   SER   4           HG       SER   4  -4.723  -4.821  -8.495
   26    H    GLY   5           H        GLY   5  -1.719  -1.918  -6.230
   27    HA2  GLY   5           HA2      GLY   5  -0.138  -0.396  -7.390
   28    HA3  GLY   5           HA3      GLY   5  -1.405   0.845  -7.337
   29    H    ILE   6           H        ILE   6   0.720   1.862  -6.413
   30    HA   ILE   6           HA       ILE   6   1.032   1.296  -3.524
   31    HB   ILE   6           HB       ILE   6   2.555   3.199  -5.356
   32   HG12  ILE   6          HG13      ILE   6   3.084   0.905  -5.892
   33   HG13  ILE   6          HG12      ILE   6   4.452   1.642  -5.051
   34   HG21  ILE   6          HG21      ILE   6   4.215   3.255  -3.387
   35   HG22  ILE   6          HG22      ILE   6   2.726   4.219  -3.238
   36   HG23  ILE   6          HG23      ILE   6   2.863   2.658  -2.394
   37   HD11  ILE   6          HD11      ILE   6   4.067  -0.694  -4.348
   38   HD12  ILE   6          HD12      ILE   6   2.446  -0.242  -3.769
   39   HD13  ILE   6          HD13      ILE   6   3.892   0.451  -2.996
   40    H    VAL   7           H        VAL   7   0.600   2.707  -1.905
   41    HA   VAL   7           HA       VAL   7  -0.777   5.242  -2.610
   42    HB   VAL   7           HB       VAL   7  -2.461   4.782  -0.761
   43   HG11  VAL   7          HG11      VAL   7  -3.006   4.705  -3.162
   44   HG12  VAL   7          HG12      VAL   7  -3.970   3.549  -2.212
   45   HG13  VAL   7          HG13      VAL   7  -2.597   2.973  -3.188
   46   HG21  VAL   7          HG21      VAL   7  -1.311   2.867   0.307
   47   HG22  VAL   7          HG22      VAL   7  -1.604   1.892  -1.153
   48   HG23  VAL   7          HG23      VAL   7  -2.977   2.467  -0.177
   49    H    ASP   8           H        ASP   8  -0.699   6.870  -1.088
   50    HA   ASP   8           HA       ASP   8   1.488   6.589   0.890
   51    HB2  ASP   8           HB2      ASP   8   1.150   8.531  -0.833
   52    HB3  ASP   8           HB3      ASP   8  -0.049   9.129   0.329
   53    H    ALA   9           H        ALA   9  -1.426   5.551   1.008
   54    HA   ALA   9           HA       ALA   9  -1.990   6.526   3.766
   55    HB1  ALA   9           HB1      ALA   9  -3.495   7.472   1.856
   56    HB2  ALA   9           HB2      ALA   9  -4.228   5.850   1.865
   57    HB3  ALA   9           HB3      ALA   9  -4.258   6.849   3.338
   58    H    CYS  10           H        CYS  10  -4.155   4.938   4.367
   59    HA   CYS  10           HA       CYS  10  -3.534   2.125   3.766
   60    HB2  CYS  10           HB3      CYS  10  -1.938   2.659   5.591
   61    HB3  CYS  10           HB2      CYS  10  -3.287   3.209   6.596
   62    H    SER  11           H        SER  11  -5.326   4.502   5.718
   63    HA   SER  11           HA       SER  11  -7.646   2.692   5.967
   64    HB2  SER  11           HB3      SER  11  -7.212   5.540   6.943
   65    HB3  SER  11           HB2      SER  11  -8.615   4.517   7.320
   66    HG   SER  11           HG       SER  11  -7.004   4.458   8.971
   67    H    GLU  12           H        GLU  12  -6.454   5.053   3.812
   68    HA   GLU  12           HA       GLU  12  -9.098   5.929   2.850
   69    HB2  GLU  12           HB2      GLU  12  -6.266   6.531   1.961
   70    HB3  GLU  12           HB3      GLU  12  -7.695   7.134   1.107
   71    HG2  GLU  12           HG3      GLU  12  -7.272   7.659   4.053
   72    HG3  GLU  12           HG2      GLU  12  -6.525   8.678   2.808
   73    H    CYS  13           H        CYS  13  -6.571   3.616   2.020
   74    HA   CYS  13           HA       CYS  13  -7.575   3.059  -0.659
   75    HB2  CYS  13           HB2      CYS  13  -5.211   2.672   0.083
   76    HB3  CYS  13           HB3      CYS  13  -5.787   1.333   1.090
   77    H    CYS  14           H        CYS  14  -8.291   0.804  -1.291
   78    HA   CYS  14           HA       CYS  14 -10.643   0.109   0.281
   79    HB2  CYS  14           HB3      CYS  14  -9.546  -1.437  -2.073
   80    HB3  CYS  14           HB2      CYS  14 -11.217  -1.336  -1.500
   81    H    GLU  15           H        GLU  15  -7.472  -0.675   0.750
   82    HA   GLU  15           HA       GLU  15  -8.088  -3.426   1.737
   83    HB2  GLU  15           HB3      GLU  15  -6.193  -2.915   0.005
   84    HB3  GLU  15           HB2      GLU  15  -5.310  -2.295   1.409
   85    HG2  GLU  15           HG2      GLU  15  -5.295  -4.414   2.471
   86    HG3  GLU  15           HG3      GLU  15  -6.489  -5.077   1.340
   87    HA   PRO  16           HA       PRO  16  -7.561  -0.952   5.602
   88    HB2  PRO  16           HB2      PRO  16  -9.892  -2.219   6.757
   89    HB3  PRO  16           HB3      PRO  16  -9.733  -0.541   6.170
   90    HG2  PRO  16           HG3      PRO  16 -11.327  -2.503   5.028
   91    HG3  PRO  16           HG2      PRO  16 -10.777  -1.012   4.217
   92    HD2  PRO  16           HD3      PRO  16  -9.689  -3.808   4.030
   93    HD3  PRO  16           HD2      PRO  16  -9.865  -2.567   2.749
   94    H    ASP  17           H        ASP  17  -8.414  -4.407   5.281
   95    HA   ASP  17           HA       ASP  17  -7.214  -5.026   7.914
   96    HB2  ASP  17           HB3      ASP  17  -8.703  -6.704   5.875
   97    HB3  ASP  17           HB2      ASP  17  -7.949  -7.382   7.331
   98    H    LYS  18           H        LYS  18  -6.684  -5.795   4.456
   99    HA   LYS  18           HA       LYS  18  -4.179  -7.215   5.129
  100    HB2  LYS  18           HB2      LYS  18  -6.027  -7.836   3.339
  101    HB3  LYS  18           HB3      LYS  18  -5.111  -6.718   2.316
  102    HG2  LYS  18           HG2      LYS  18  -3.077  -8.059   2.677
  103    HG3  LYS  18           HG3      LYS  18  -3.997  -9.178   3.705
  104    HD2  LYS  18           HD2      LYS  18  -5.461  -9.720   1.799
  105    HD3  LYS  18           HD3      LYS  18  -4.539  -8.603   0.771
  106    HE2  LYS  18           HE3      LYS  18  -2.508  -9.959   1.133
  107    HE3  LYS  18           HE2      LYS  18  -3.439 -11.071   2.157
  108    HZ1  LYS  18           HZ1      LYS  18  -3.219 -11.897  -0.077
  109    HZ2  LYS  18           HZ2      LYS  18  -3.945 -10.552  -0.698
  110    HZ3  LYS  18           HZ3      LYS  18  -4.804 -11.586   0.257
  111    H    CYS  19           H        CYS  19  -4.333  -4.378   5.693
  112    HA   CYS  19           HA       CYS  19  -2.706  -3.063   3.612
  113    HB2  CYS  19           HB3      CYS  19  -4.552  -1.862   4.761
  114    HB3  CYS  19           HB2      CYS  19  -3.686  -2.042   6.294
  115    H    ILE  20           H        ILE  20  -0.588  -3.087   3.575
  116    HA   ILE  20           HA       ILE  20   0.882  -3.498   6.140
  117    HB   ILE  20           HB       ILE  20   2.719  -4.562   4.696
  118   HG12  ILE  20          HG12      ILE  20   1.453  -5.904   2.749
  119   HG13  ILE  20          HG13      ILE  20   0.505  -4.409   2.692
  120   HG21  ILE  20          HG21      ILE  20   1.298  -5.783   6.300
  121   HG22  ILE  20          HG22      ILE  20   1.732  -6.778   4.889
  122   HG23  ILE  20          HG23      ILE  20   0.105  -6.066   5.009
  123   HD11  ILE  20          HD11      ILE  20   2.354  -4.349   1.090
  124   HD12  ILE  20          HD12      ILE  20   2.575  -3.116   2.354
  125   HD13  ILE  20          HD13      ILE  20   3.519  -4.625   2.408
  126    H    ILE  21           H        ILE  21   3.078  -2.638   6.201
  127    HA   ILE  21           HA       ILE  21   3.157  -0.023   4.792
  128    HB   ILE  21           HB       ILE  21   5.103  -0.773   6.985
  129   HG12  ILE  21          HG12      ILE  21   3.262   0.561   8.424
  130   HG13  ILE  21          HG13      ILE  21   2.175  -0.274   7.301
  131   HG21  ILE  21          HG21      ILE  21   3.889   1.902   6.947
  132   HG22  ILE  21          HG22      ILE  21   4.737   1.488   5.438
  133   HG23  ILE  21          HG23      ILE  21   5.602   1.421   6.992
  134   HD11  ILE  21          HD11      ILE  21   2.475  -1.556   9.363
  135   HD12  ILE  21          HD12      ILE  21   3.151  -2.435   7.970
  136   HD13  ILE  21          HD13      ILE  21   4.235  -1.588   9.100
  137    H    MET  22           H        MET  22   4.025  -0.234   2.866
  138    HA   MET  22           HA       MET  22   5.418  -0.747   1.133
  139    HB2  MET  22           HB3      MET  22   7.702  -0.076   1.341
  140    HB3  MET  22           HB2      MET  22   6.694   1.007   2.307
  141    HG2  MET  22           HG2      MET  22   7.952  -1.291   3.727
  142    HG3  MET  22           HG3      MET  22   9.019   0.020   3.189
  143    HE1  MET  22           HE1      MET  22   8.567   0.764   7.024
  144    HE2  MET  22           HE2      MET  22   9.730   0.488   5.705
  145    HE3  MET  22           HE3      MET  22   8.669  -0.834   6.246
  146    H    LEU  23           H        LEU  23   6.165  -2.404  -0.018
  147    HA   LEU  23           HA       LEU  23   7.373  -4.678   1.473
  148    HB2  LEU  23           HB3      LEU  23   5.412  -5.757   1.196
  149    HB3  LEU  23           HB2      LEU  23   4.880  -4.677  -0.097
  150    HG   LEU  23           HG       LEU  23   6.736  -6.049  -1.468
  151   HD11  LEU  23          HD11      LEU  23   7.364  -7.445   0.464
  152   HD12  LEU  23          HD12      LEU  23   6.682  -8.417  -0.862
  153   HD13  LEU  23          HD13      LEU  23   5.691  -8.043   0.569
  154   HD21  LEU  23          HD21      LEU  23   4.363  -5.752  -2.058
  155   HD22  LEU  23          HD22      LEU  23   3.923  -7.045  -0.917
  156   HD23  LEU  23          HD23      LEU  23   4.914  -7.420  -2.347
  157    HA   PRO  24           HA       PRO  24   9.231  -4.972  -2.829
  158    HB2  PRO  24           HB3      PRO  24   8.095  -3.366  -4.907
  159    HB3  PRO  24           HB2      PRO  24   7.836  -5.111  -4.635
  160    HG2  PRO  24           HG2      PRO  24   5.915  -3.080  -4.389
  161    HG3  PRO  24           HG3      PRO  24   5.774  -4.754  -3.788
  162    HD2  PRO  24           HD2      PRO  24   6.500  -2.250  -2.299
  163    HD3  PRO  24           HD3      PRO  24   5.579  -3.688  -1.756
  164    H    THR  25           H        THR  25   9.243  -2.482  -1.036
  165    HA   THR  25           HA       THR  25  11.428  -1.075  -2.441
  166    HB   THR  25           HB       THR  25  10.405   1.168  -1.698
  167    HG1  THR  25           HG1      THR  25   8.501   1.075  -0.814
  168   HG21  THR  25          HG21      THR  25  10.161  -0.311  -4.088
  169   HG22  THR  25          HG22      THR  25  10.002   1.449  -3.878
  170   HG23  THR  25          HG23      THR  25   8.560   0.409  -3.792
  171    H    TRP  26           H        TRP  26  12.679   0.333  -1.032
  172    HA   TRP  26           HA       TRP  26  12.848  -0.817   1.666
  173    HB2  TRP  26           HB2      TRP  26  14.871   0.916   1.720
  174    HB3  TRP  26           HB3      TRP  26  14.996  -0.679   0.964
  175    HD1  TRP  26           HD1      TRP  26  14.310  -0.525  -1.872
  176    HE1  TRP  26           HE1      TRP  26  15.167   1.184  -3.586
  177    HE3  TRP  26           HE3      TRP  26  15.896   3.101   1.378
  178    HZ2  TRP  26           HZ2      TRP  26  16.427   3.696  -3.545
  179    HZ3  TRP  26           HZ3      TRP  26  16.949   5.125   0.452
  180    HH2  TRP  26           HH2      TRP  26  17.211   5.416  -1.976
  181    HA   PRO  27           HA       PRO  27  12.068   3.762   3.013
  182    HB2  PRO  27           HB2      PRO  27  10.674   5.111   0.771
  183    HB3  PRO  27           HB3      PRO  27  12.119   5.635   1.681
  184    HG2  PRO  27           HG3      PRO  27  12.251   4.843  -0.885
  185    HG3  PRO  27           HG2      PRO  27  13.570   4.524   0.278
  186    HD2  PRO  27           HD2      PRO  27  11.371   2.673  -0.668
  187    HD3  PRO  27           HD3      PRO  27  13.129   2.363  -0.505
  188    HA   PRO  28           HA       PRO  28   7.830   3.090   4.266
  189    HB2  PRO  28           HB2      PRO  28   7.262   6.042   4.235
  190    HB3  PRO  28           HB3      PRO  28   7.100   4.861   5.567
  191    HG2  PRO  28           HG2      PRO  28   9.096   6.616   5.542
  192    HG3  PRO  28           HG3      PRO  28   9.352   4.933   6.084
  193    HD2  PRO  28           HD3      PRO  28  10.063   6.219   3.456
  194    HD3  PRO  28           HD2      PRO  28  11.010   5.069   4.450
  195    H    ARG  29           H        ARG  29   6.323   2.274   3.002
  196    HA   ARG  29           HA       ARG  29   4.841   3.978   1.106
  197    HB2  ARG  29           HB2      ARG  29   6.506   1.601   0.257
  198    HB3  ARG  29           HB3      ARG  29   5.060   2.074  -0.653
  199    HG2  ARG  29           HG2      ARG  29   6.068   4.373  -0.883
  200    HG3  ARG  29           HG3      ARG  29   7.558   3.723  -0.165
  201    HD2  ARG  29           HD2      ARG  29   7.711   2.070  -1.981
  202    HD3  ARG  29           HD3      ARG  29   6.218   2.709  -2.697
  203    HE   ARG  29           HE       ARG  29   8.197   4.781  -2.348
  204   HH11  ARG  29          HH11      ARG  29   7.312   2.074  -4.460
  205   HH12  ARG  29          HH12      ARG  29   8.120   2.760  -5.852
  206   HH21  ARG  29          HH21      ARG  29   9.226   5.631  -4.166
  207   HH22  ARG  29          HH22      ARG  29   9.198   4.764  -5.685
  208    H    TYR  30           H        TYR  30   3.361   1.990  -0.171
  209    HA   TYR  30           HA       TYR  30   2.221   0.149   1.814
  210    HB2  TYR  30           HB2      TYR  30   0.695   2.586   0.840
  211    HB3  TYR  30           HB3      TYR  30  -0.111   1.142   1.472
  212    HD1  TYR  30           HD1      TYR  30   1.653   4.201   2.305
  213    HD2  TYR  30           HD2      TYR  30   0.262   0.496   3.885
  214    HE1  TYR  30           HE1      TYR  30   1.878   5.090   4.583
  215    HE2  TYR  30           HE2      TYR  30   0.488   1.383   6.164
  216    HH   TYR  30           HH       TYR  30   2.236   4.033   6.945
  217    H    VAL  31           H        VAL  31   0.681  -1.319   0.891
  218    HA   VAL  31           HA       VAL  31   0.451  -1.205  -2.081
  219    HB   VAL  31           HB       VAL  31   1.012  -3.834  -0.668
  220   HG11  VAL  31          HG11      VAL  31  -0.060  -3.912  -2.896
  221   HG12  VAL  31          HG12      VAL  31   1.312  -3.003  -3.573
  222   HG13  VAL  31          HG13      VAL  31   1.568  -4.632  -2.903
  223   HG21  VAL  31          HG21      VAL  31   2.969  -2.370  -0.304
  224   HG22  VAL  31          HG22      VAL  31   3.335  -3.732  -1.390
  225   HG23  VAL  31          HG23      VAL  31   3.080  -2.103  -2.061
  226    H    CYS  32           H        CYS  32  -1.377  -2.056  -2.955
  227    HA   CYS  32           HA       CYS  32  -3.419  -3.168  -1.084
  228    HB2  CYS  32           HB2      CYS  32  -3.787  -0.980  -3.150
  229    HB3  CYS  32           HB3      CYS  32  -5.138  -1.891  -2.458
  230    H    SER  33           H        SER  33  -3.584  -5.217  -1.704
  231    HA   SER  33           HA       SER  33  -3.486  -5.874  -4.609
  232    HB2  SER  33           HB3      SER  33  -3.142  -7.551  -2.109
  233    HB3  SER  33           HB2      SER  33  -3.223  -8.231  -3.748
  234    HG   SER  33           HG       SER  33  -1.059  -7.841  -3.056
  235    H    VAL  34           H        VAL  34  -5.799  -4.775  -3.002
  236    HA   VAL  34           HA       VAL  34  -7.774  -6.939  -3.058
  237    HB   VAL  34           HB       VAL  34  -9.371  -4.993  -2.461
  238   HG11  VAL  34          HG11      VAL  34  -8.542  -6.705  -0.897
  239   HG12  VAL  34          HG12      VAL  34  -8.738  -5.117  -0.118
  240   HG13  VAL  34          HG13      VAL  34  -7.115  -5.696  -0.565
  241   HG21  VAL  34          HG21      VAL  34  -7.893  -3.135  -3.160
  242   HG22  VAL  34          HG22      VAL  34  -8.355  -3.017  -1.445
  243   HG23  VAL  34          HG23      VAL  34  -6.732  -3.596  -1.892
  Start of MODEL   12
    1    H1   CYS   1           H1       CYS   1 -11.105   4.912  -5.224
    2    H2   CYS   1           H2       CYS   1 -11.731   3.963  -6.418
    3    H3   CYS   1           H3       CYS   1 -12.589   4.219  -5.032
    4    HA   CYS   1           HA       CYS   1 -10.980   3.047  -3.725
    5    HB2  CYS   1           HB2      CYS   1 -12.882   1.833  -4.744
    6    HB3  CYS   1           HB3      CYS   1 -11.889   1.486  -6.169
    7    H    VAL   2           H        VAL   2  -9.073   1.857  -3.575
    8    HA   VAL   2           HA       VAL   2  -7.238   2.058  -5.920
    9    HB   VAL   2           HB       VAL   2  -6.311   2.445  -3.044
   10   HG11  VAL   2          HG11      VAL   2  -5.016   2.556  -5.746
   11   HG12  VAL   2          HG12      VAL   2  -4.414   3.632  -4.462
   12   HG13  VAL   2          HG13      VAL   2  -4.415   1.869  -4.217
   13   HG21  VAL   2          HG21      VAL   2  -7.830   4.298  -3.652
   14   HG22  VAL   2          HG22      VAL   2  -6.145   4.841  -3.472
   15   HG23  VAL   2          HG23      VAL   2  -6.839   4.621  -5.095
   16    H    SER   3           H        SER   3  -7.903  -0.085  -6.367
   17    HA   SER   3           HA       SER   3  -7.347  -2.213  -4.430
   18    HB2  SER   3           HB3      SER   3  -8.174  -2.333  -7.351
   19    HB3  SER   3           HB2      SER   3  -8.090  -3.718  -6.240
   20    HG   SER   3           HG       SER   3 -10.215  -2.833  -6.399
   21    H    SER   4           H        SER   4  -5.795  -0.823  -7.297
   22    HA   SER   4           HA       SER   4  -3.437  -2.572  -6.755
   23    HB2  SER   4           HB3      SER   4  -3.032  -2.652  -9.229
   24    HB3  SER   4           HB2      SER   4  -4.485  -3.526  -8.701
   25    HG   SER   4           HG       SER   4  -4.869  -2.203 -10.553
   26    H    GLY   5           H        GLY   5  -1.617  -1.506  -6.443
   27    HA2  GLY   5           HA2      GLY   5  -0.159   0.255  -7.607
   28    HA3  GLY   5           HA3      GLY   5  -1.521   1.352  -7.310
   29    H    ILE   6           H        ILE   6   0.284   2.567  -6.273
   30    HA   ILE   6           HA       ILE   6   1.015   1.564  -3.577
   31    HB   ILE   6           HB       ILE   6   1.965   4.010  -5.134
   32   HG12  ILE   6          HG13      ILE   6   2.857   2.035  -6.148
   33   HG13  ILE   6          HG12      ILE   6   4.148   2.813  -5.224
   34   HG21  ILE   6          HG21      ILE   6   3.806   4.031  -3.314
   35   HG22  ILE   6          HG22      ILE   6   2.208   4.702  -2.910
   36   HG23  ILE   6          HG23      ILE   6   2.658   3.075  -2.347
   37   HD11  ILE   6          HD11      ILE   6   4.119   0.309  -5.073
   38   HD12  ILE   6          HD12      ILE   6   4.045   1.142  -3.502
   39   HD13  ILE   6          HD13      ILE   6   2.571   0.432  -4.203
   40    H    VAL   7           H        VAL   7   0.718   2.840  -1.690
   41    HA   VAL   7           HA       VAL   7  -1.297   5.000  -1.893
   42    HB   VAL   7           HB       VAL   7  -2.534   4.024   0.103
   43   HG11  VAL   7          HG11      VAL   7  -3.429   4.045  -2.193
   44   HG12  VAL   7          HG12      VAL   7  -3.977   2.628  -1.266
   45   HG13  VAL   7          HG13      VAL   7  -2.690   2.452  -2.483
   46   HG21  VAL   7          HG21      VAL   7  -0.660   2.256   0.504
   47   HG22  VAL   7          HG22      VAL   7  -1.506   1.322  -0.753
   48   HG23  VAL   7          HG23      VAL   7  -2.361   1.787   0.738
   49    H    ASP   8           H        ASP   8  -1.171   6.561  -0.384
   50    HA   ASP   8           HA       ASP   8   1.218   6.482   1.373
   51    HB2  ASP   8           HB2      ASP   8  -0.649   8.709   0.497
   52    HB3  ASP   8           HB3      ASP   8   0.624   8.935   1.711
   53    H    ALA   9           H        ALA   9  -1.727   5.313   1.617
   54    HA   ALA   9           HA       ALA   9  -1.911   5.769   4.532
   55    HB1  ALA   9           HB1      ALA   9  -3.425   7.384   3.027
   56    HB2  ALA   9           HB2      ALA   9  -4.007   6.710   4.567
   57    HB3  ALA   9           HB3      ALA   9  -4.493   5.960   3.028
   58    H    CYS  10           H        CYS  10  -4.511   4.537   4.754
   59    HA   CYS  10           HA       CYS  10  -4.378   1.874   3.537
   60    HB2  CYS  10           HB2      CYS  10  -3.390   2.381   6.271
   61    HB3  CYS  10           HB3      CYS  10  -4.626   1.116   6.177
   62    H    SER  11           H        SER  11  -5.778   4.167   5.830
   63    HA   SER  11           HA       SER  11  -8.348   2.800   6.020
   64    HB2  SER  11           HB3      SER  11  -9.056   4.912   7.176
   65    HB3  SER  11           HB2      SER  11  -7.625   4.139   7.891
   66    HG   SER  11           HG       SER  11  -7.364   6.416   7.627
   67    H    GLU  12           H        GLU  12  -6.840   5.095   3.898
   68    HA   GLU  12           HA       GLU  12  -9.360   6.038   2.708
   69    HB2  GLU  12           HB2      GLU  12  -6.438   6.500   2.058
   70    HB3  GLU  12           HB3      GLU  12  -7.753   7.124   1.048
   71    HG2  GLU  12           HG3      GLU  12  -8.617   8.395   2.980
   72    HG3  GLU  12           HG2      GLU  12  -7.288   7.769   3.974
   73    H    CYS  13           H        CYS  13  -6.908   3.589   2.187
   74    HA   CYS  13           HA       CYS  13  -7.716   2.945  -0.549
   75    HB2  CYS  13           HB2      CYS  13  -5.419   2.550   0.277
   76    HB3  CYS  13           HB3      CYS  13  -6.040   1.382   1.456
   77    H    CYS  14           H        CYS  14  -8.455   0.671  -1.099
   78    HA   CYS  14           HA       CYS  14 -10.866   0.079   0.453
   79    HB2  CYS  14           HB2      CYS  14  -9.689  -1.022  -2.104
   80    HB3  CYS  14           HB3      CYS  14 -11.155  -1.692  -1.368
   81    H    GLU  15           H        GLU  15  -8.073  -0.486   1.525
   82    HA   GLU  15           HA       GLU  15  -8.592  -3.314   2.331
   83    HB2  GLU  15           HB3      GLU  15  -5.978  -2.015   1.523
   84    HB3  GLU  15           HB2      GLU  15  -6.034  -3.462   2.543
   85    HG2  GLU  15           HG2      GLU  15  -7.444  -4.523   0.693
   86    HG3  GLU  15           HG3      GLU  15  -6.939  -3.158  -0.321
   87    HA   PRO  16           HA       PRO  16  -8.502  -0.814   6.191
   88    HB2  PRO  16           HB2      PRO  16  -9.913  -3.136   7.381
   89    HB3  PRO  16           HB3      PRO  16 -10.439  -1.434   7.251
   90    HG2  PRO  16           HG2      PRO  16 -11.573  -3.413   5.812
   91    HG3  PRO  16           HG3      PRO  16 -11.401  -1.746   5.195
   92    HD2  PRO  16           HD3      PRO  16  -9.725  -4.179   4.602
   93    HD3  PRO  16           HD2      PRO  16 -10.335  -2.921   3.481
   94    H    ASP  17           H        ASP  17  -7.925  -4.343   5.972
   95    HA   ASP  17           HA       ASP  17  -5.611  -4.016   7.828
   96    HB2  ASP  17           HB3      ASP  17  -7.770  -6.145   7.954
   97    HB3  ASP  17           HB2      ASP  17  -6.194  -6.306   8.752
   98    H    LYS  18           H        LYS  18  -6.704  -4.926   4.821
   99    HA   LYS  18           HA       LYS  18  -4.838  -7.185   4.446
  100    HB2  LYS  18           HB3      LYS  18  -6.897  -5.847   2.677
  101    HB3  LYS  18           HB2      LYS  18  -5.757  -7.055   2.061
  102    HG2  LYS  18           HG2      LYS  18  -6.618  -8.705   3.661
  103    HG3  LYS  18           HG3      LYS  18  -7.761  -7.501   4.294
  104    HD2  LYS  18           HD2      LYS  18  -8.814  -7.337   2.072
  105    HD3  LYS  18           HD3      LYS  18  -7.671  -8.539   1.438
  106    HE2  LYS  18           HE2      LYS  18  -9.665  -9.728   1.908
  107    HE3  LYS  18           HE3      LYS  18  -8.549 -10.124   3.230
  108    HZ1  LYS  18           HZ1      LYS  18 -10.745  -9.629   4.040
  109    HZ2  LYS  18           HZ2      LYS  18 -10.718  -8.131   3.351
  110    HZ3  LYS  18           HZ3      LYS  18  -9.681  -8.491   4.582
  111    H    CYS  19           H        CYS  19  -4.469  -3.902   4.542
  112    HA   CYS  19           HA       CYS  19  -2.673  -3.675   2.204
  113    HB2  CYS  19           HB3      CYS  19  -2.454  -1.325   2.866
  114    HB3  CYS  19           HB2      CYS  19  -4.151  -1.804   2.708
  115    H    ILE  20           H        ILE  20  -0.502  -3.632   2.253
  116    HA   ILE  20           HA       ILE  20   0.764  -4.228   4.873
  117    HB   ILE  20           HB       ILE  20   2.790  -4.874   3.505
  118   HG12  ILE  20          HG12      ILE  20   1.881  -5.609   1.063
  119   HG13  ILE  20          HG13      ILE  20   0.980  -4.097   1.276
  120   HG21  ILE  20          HG21      ILE  20   1.187  -6.509   4.422
  121   HG22  ILE  20          HG22      ILE  20   1.913  -7.057   2.892
  122   HG23  ILE  20          HG23      ILE  20   0.251  -6.420   2.911
  123   HD11  ILE  20          HD11      ILE  20   3.094  -3.712   0.102
  124   HD12  ILE  20          HD12      ILE  20   3.095  -2.901   1.686
  125   HD13  ILE  20          HD13      ILE  20   3.992  -4.422   1.465
  126    H    ILE  21           H        ILE  21   2.842  -3.278   5.396
  127    HA   ILE  21           HA       ILE  21   2.781  -0.381   4.877
  128    HB   ILE  21           HB       ILE  21   4.868  -1.783   6.582
  129   HG12  ILE  21          HG13      ILE  21   3.035  -1.037   8.442
  130   HG13  ILE  21          HG12      ILE  21   1.958  -1.522   7.121
  131   HG21  ILE  21          HG21      ILE  21   5.122   0.642   6.144
  132   HG22  ILE  21          HG22      ILE  21   3.513   0.925   6.851
  133   HG23  ILE  21          HG23      ILE  21   4.832   0.296   7.866
  134   HD11  ILE  21          HD11      ILE  21   2.370  -3.382   8.654
  135   HD12  ILE  21          HD12      ILE  21   3.030  -3.727   7.038
  136   HD13  ILE  21          HD13      ILE  21   4.120  -3.247   8.360
  137    H    MET  22           H        MET  22   4.758   0.814   4.407
  138    HA   MET  22           HA       MET  22   5.893   0.344   1.943
  139    HB2  MET  22           HB2      MET  22   7.249   1.676   4.312
  140    HB3  MET  22           HB3      MET  22   7.722   1.872   2.617
  141    HG2  MET  22           HG2      MET  22   5.399   2.792   2.199
  142    HG3  MET  22           HG3      MET  22   5.171   2.802   3.958
  143    HE1  MET  22           HE1      MET  22   7.443   5.612   5.226
  144    HE2  MET  22           HE2      MET  22   7.565   3.844   5.395
  145    HE3  MET  22           HE3      MET  22   5.978   4.642   5.513
  146    H    LEU  23           H        LEU  23   6.877  -1.422   1.209
  147    HA   LEU  23           HA       LEU  23   9.339  -2.314   2.546
  148    HB2  LEU  23           HB2      LEU  23   8.134  -3.846   3.706
  149    HB3  LEU  23           HB3      LEU  23   6.815  -3.888   2.532
  150    HG   LEU  23           HG       LEU  23   8.603  -5.176   1.056
  151   HD11  LEU  23          HD11      LEU  23  10.460  -4.862   2.649
  152   HD12  LEU  23          HD12      LEU  23   9.550  -5.771   3.879
  153   HD13  LEU  23          HD13      LEU  23  10.091  -6.584   2.391
  154   HD21  LEU  23          HD21      LEU  23   6.439  -6.056   1.840
  155   HD22  LEU  23          HD22      LEU  23   7.182  -6.473   3.403
  156   HD23  LEU  23          HD23      LEU  23   7.723  -7.287   1.915
  157    HA   PRO  24           HA       PRO  24   9.115  -4.484  -1.824
  158    HB2  PRO  24           HB2      PRO  24   6.871  -2.990  -3.155
  159    HB3  PRO  24           HB3      PRO  24   7.311  -4.721  -3.256
  160    HG2  PRO  24           HG3      PRO  24   5.198  -3.958  -1.859
  161    HG3  PRO  24           HG2      PRO  24   6.285  -5.231  -1.231
  162    HD2  PRO  24           HD3      PRO  24   6.159  -2.297  -0.514
  163    HD3  PRO  24           HD2      PRO  24   6.262  -3.718   0.573
  164    H    THR  25           H        THR  25   9.690  -3.667  -4.106
  165    HA   THR  25           HA       THR  25  11.050  -2.333  -5.379
  166    HB   THR  25           HB       THR  25  10.451   0.085  -5.622
  167    HG1  THR  25           HG1      THR  25   8.694   0.884  -4.446
  168   HG21  THR  25          HG21      THR  25   8.199  -0.299  -6.545
  169   HG22  THR  25          HG22      THR  25   9.316  -1.618  -6.969
  170   HG23  THR  25          HG23      THR  25   8.112  -1.852  -5.679
  171    H    TRP  26           H        TRP  26  12.463  -0.167  -5.374
  172    HA   TRP  26           HA       TRP  26  14.391  -0.557  -3.281
  173    HB2  TRP  26           HB2      TRP  26  15.143   1.842  -4.365
  174    HB3  TRP  26           HB3      TRP  26  15.629   0.248  -4.957
  175    HD1  TRP  26           HD1      TRP  26  13.702  -0.750  -6.921
  176    HE1  TRP  26           HE1      TRP  26  12.731   0.534  -8.926
  177    HE3  TRP  26           HE3      TRP  26  14.706   4.011  -5.341
  178    HZ2  TRP  26           HZ2      TRP  26  12.504   3.215  -9.744
  179    HZ3  TRP  26           HZ3      TRP  26  14.101   5.891  -6.812
  180    HH2  TRP  26           HH2      TRP  26  13.014   5.495  -8.984
  181    HA   PRO  27           HA       PRO  27  12.918   3.455  -1.232
  182    HB2  PRO  27           HB2      PRO  27  10.576   4.671  -2.366
  183    HB3  PRO  27           HB3      PRO  27  12.263   5.232  -2.519
  184    HG2  PRO  27           HG3      PRO  27  10.654   4.259  -4.587
  185    HG3  PRO  27           HG2      PRO  27  12.428   4.452  -4.634
  186    HD2  PRO  27           HD2      PRO  27  10.786   1.982  -4.148
  187    HD3  PRO  27           HD3      PRO  27  12.349   2.175  -5.002
  188    HA   PRO  28           HA       PRO  28   9.564   1.712   1.194
  189    HB2  PRO  28           HB3      PRO  28   9.065   4.177   2.707
  190    HB3  PRO  28           HB2      PRO  28   9.923   2.702   3.233
  191    HG2  PRO  28           HG2      PRO  28  11.146   5.111   2.830
  192    HG3  PRO  28           HG3      PRO  28  11.968   3.536   2.648
  193    HD2  PRO  28           HD3      PRO  28  10.826   5.345   0.527
  194    HD3  PRO  28           HD2      PRO  28  12.370   4.436   0.532
  195    H    ARG  29           H        ARG  29   7.629   1.295   0.288
  196    HA   ARG  29           HA       ARG  29   5.606   3.446   0.133
  197    HB2  ARG  29           HB3      ARG  29   6.648   1.929  -2.270
  198    HB3  ARG  29           HB2      ARG  29   5.008   2.601  -2.233
  199    HG2  ARG  29           HG2      ARG  29   5.834   4.836  -2.014
  200    HG3  ARG  29           HG3      ARG  29   7.495   4.263  -1.753
  201    HD2  ARG  29           HD2      ARG  29   7.499   3.315  -4.044
  202    HD3  ARG  29           HD3      ARG  29   5.865   3.961  -4.299
  203    HE   ARG  29           HE       ARG  29   7.581   6.080  -3.476
  204   HH11  ARG  29          HH11      ARG  29   7.045   3.971  -6.276
  205   HH12  ARG  29          HH12      ARG  29   7.662   5.149  -7.413
  206   HH21  ARG  29          HH21      ARG  29   8.368   7.570  -4.977
  207   HH22  ARG  29          HH22      ARG  29   8.406   7.175  -6.680
  208    H    TYR  30           H        TYR  30   3.565   2.775   0.464
  209    HA   TYR  30           HA       TYR  30   3.057   0.034   1.341
  210    HB2  TYR  30           HB2      TYR  30   1.254   2.439   0.881
  211    HB3  TYR  30           HB3      TYR  30   0.670   0.889   1.501
  212    HD1  TYR  30           HD1      TYR  30   2.883   3.783   2.270
  213    HD2  TYR  30           HD2      TYR  30   0.882   0.349   3.805
  214    HE1  TYR  30           HE1      TYR  30   3.364   4.526   4.562
  215    HE2  TYR  30           HE2      TYR  30   1.370   1.085   6.094
  216    HH   TYR  30           HH       TYR  30   1.843   3.394   7.223
  217    H    VAL  31           H        VAL  31   1.419  -1.408   0.379
  218    HA   VAL  31           HA       VAL  31   0.767  -0.786  -2.463
  219    HB   VAL  31           HB       VAL  31   1.792  -3.533  -1.640
  220   HG11  VAL  31          HG11      VAL  31   0.254  -3.481  -3.578
  221   HG12  VAL  31          HG12      VAL  31   1.335  -2.321  -4.387
  222   HG13  VAL  31          HG13      VAL  31   1.903  -3.971  -4.037
  223   HG21  VAL  31          HG21      VAL  31   3.626  -1.879  -1.496
  224   HG22  VAL  31          HG22      VAL  31   3.297  -1.388  -3.175
  225   HG23  VAL  31          HG23      VAL  31   3.865  -3.038  -2.825
  226    H    CYS  32           H        CYS  32  -1.264  -1.086  -2.944
  227    HA   CYS  32           HA       CYS  32  -2.980  -2.648  -1.074
  228    HB2  CYS  32           HB2      CYS  32  -3.488  -0.413  -3.032
  229    HB3  CYS  32           HB3      CYS  32  -4.815  -1.463  -2.512
  230    H    SER  33           H        SER  33  -3.907  -4.511  -1.676
  231    HA   SER  33           HA       SER  33  -3.911  -5.211  -4.583
  232    HB2  SER  33           HB2      SER  33  -2.006  -6.265  -3.276
  233    HB3  SER  33           HB3      SER  33  -3.237  -7.170  -2.370
  234    HG   SER  33           HG       SER  33  -2.430  -8.341  -4.186
  235    H    VAL  34           H        VAL  34  -5.856  -4.346  -2.377
  236    HA   VAL  34           HA       VAL  34  -7.948  -4.775  -1.586
  237    HB   VAL  34           HB       VAL  34  -8.368  -4.206  -3.963
  238   HG11  VAL  34          HG11      VAL  34  -9.333  -6.112  -5.405
  239   HG12  VAL  34          HG12      VAL  34  -8.373  -7.188  -4.362
  240   HG13  VAL  34          HG13      VAL  34  -7.566  -5.919  -5.314
  241   HG21  VAL  34          HG21      VAL  34 -10.192  -4.430  -2.317
  242   HG22  VAL  34          HG22      VAL  34 -10.418  -6.121  -2.826
  243   HG23  VAL  34          HG23      VAL  34 -10.708  -4.797  -3.981
  Start of MODEL   13
    1    H1   CYS   1           H1       CYS   1 -10.819   5.229  -5.164
    2    H2   CYS   1           H2       CYS   1 -12.338   4.605  -5.009
    3    H3   CYS   1           H3       CYS   1 -11.487   4.367  -6.401
    4    HA   CYS   1           HA       CYS   1 -10.800   3.296  -3.749
    5    HB2  CYS   1           HB2      CYS   1 -12.748   2.211  -4.794
    6    HB3  CYS   1           HB3      CYS   1 -11.807   1.917  -6.265
    7    H    VAL   2           H        VAL   2  -8.979   1.962  -3.661
    8    HA   VAL   2           HA       VAL   2  -7.108   2.182  -5.974
    9    HB   VAL   2           HB       VAL   2  -6.207   2.375  -3.068
   10   HG11  VAL   2          HG11      VAL   2  -4.537   1.528  -4.684
   11   HG12  VAL   2          HG12      VAL   2  -4.750   3.001  -5.660
   12   HG13  VAL   2          HG13      VAL   2  -4.080   3.113  -4.014
   13   HG21  VAL   2          HG21      VAL   2  -7.567   4.358  -3.641
   14   HG22  VAL   2          HG22      VAL   2  -5.851   4.766  -3.405
   15   HG23  VAL   2          HG23      VAL   2  -6.521   4.655  -5.050
   16    H    SER   3           H        SER   3  -7.857   0.131  -6.567
   17    HA   SER   3           HA       SER   3  -7.620  -2.156  -4.787
   18    HB2  SER   3           HB3      SER   3  -8.020  -2.004  -7.796
   19    HB3  SER   3           HB2      SER   3  -8.180  -3.469  -6.803
   20    HG   SER   3           HG       SER   3 -10.204  -2.428  -7.184
   21    H    SER   4           H        SER   4  -5.663  -0.793  -7.442
   22    HA   SER   4           HA       SER   4  -3.416  -2.538  -6.562
   23    HB2  SER   4           HB2      SER   4  -4.257  -2.119  -9.456
   24    HB3  SER   4           HB3      SER   4  -2.791  -2.967  -8.916
   25    HG   SER   4           HG       SER   4  -4.539  -4.407  -9.358
   26    H    GLY   5           H        GLY   5  -1.679  -1.398  -6.120
   27    HA2  GLY   5           HA2      GLY   5  -0.144   0.257  -7.470
   28    HA3  GLY   5           HA3      GLY   5  -1.495   1.371  -7.183
   29    H    ILE   6           H        ILE   6   0.227   2.644  -6.159
   30    HA   ILE   6           HA       ILE   6   1.041   1.670  -3.475
   31    HB   ILE   6           HB       ILE   6   1.910   4.131  -5.052
   32   HG12  ILE   6          HG12      ILE   6   2.824   2.187  -6.081
   33   HG13  ILE   6          HG13      ILE   6   4.123   2.965  -5.170
   34   HG21  ILE   6          HG21      ILE   6   3.776   4.193  -3.259
   35   HG22  ILE   6          HG22      ILE   6   2.666   3.208  -2.276
   36   HG23  ILE   6          HG23      ILE   6   2.169   4.826  -2.828
   37   HD11  ILE   6          HD11      ILE   6   4.111   0.459  -5.044
   38   HD12  ILE   6          HD12      ILE   6   4.027   1.262  -3.458
   39   HD13  ILE   6          HD13      ILE   6   2.559   0.556  -4.176
   40    H    VAL   7           H        VAL   7   0.719   2.914  -1.590
   41    HA   VAL   7           HA       VAL   7  -1.333   5.042  -1.762
   42    HB   VAL   7           HB       VAL   7  -2.568   4.027   0.204
   43   HG11  VAL   7          HG11      VAL   7  -3.180   3.920  -2.320
   44   HG12  VAL   7          HG12      VAL   7  -2.781   2.192  -2.167
   45   HG13  VAL   7          HG13      VAL   7  -4.067   2.901  -1.161
   46   HG21  VAL   7          HG21      VAL   7  -0.643   2.318   0.635
   47   HG22  VAL   7          HG22      VAL   7  -2.332   1.806   0.863
   48   HG23  VAL   7          HG23      VAL   7  -1.456   1.349  -0.617
   49    H    ASP   8           H        ASP   8  -1.238   6.582  -0.220
   50    HA   ASP   8           HA       ASP   8   1.160   6.523   1.525
   51    HB2  ASP   8           HB2      ASP   8   0.393   8.482  -0.042
   52    HB3  ASP   8           HB3      ASP   8  -0.751   8.849   1.263
   53    H    ALA   9           H        ALA   9  -1.767   5.278   1.736
   54    HA   ALA   9           HA       ALA   9  -1.924   5.524   4.663
   55    HB1  ALA   9           HB1      ALA   9  -3.371   7.364   3.366
   56    HB2  ALA   9           HB2      ALA   9  -4.518   6.009   3.245
   57    HB3  ALA   9           HB3      ALA   9  -3.966   6.567   4.842
   58    H    CYS  10           H        CYS  10  -4.595   4.428   4.816
   59    HA   CYS  10           HA       CYS  10  -4.588   1.874   3.361
   60    HB2  CYS  10           HB2      CYS  10  -3.091   1.360   5.238
   61    HB3  CYS  10           HB3      CYS  10  -4.293   1.965   6.389
   62    H    SER  11           H        SER  11  -5.936   4.038   5.821
   63    HA   SER  11           HA       SER  11  -8.574   2.830   5.871
   64    HB2  SER  11           HB2      SER  11  -7.576   4.226   7.715
   65    HB3  SER  11           HB3      SER  11  -7.774   5.652   6.674
   66    HG   SER  11           HG       SER  11  -9.550   5.351   8.117
   67    H    GLU  12           H        GLU  12  -6.914   5.122   3.857
   68    HA   GLU  12           HA       GLU  12  -9.367   6.152   2.594
   69    HB2  GLU  12           HB3      GLU  12  -6.410   6.605   2.092
   70    HB3  GLU  12           HB2      GLU  12  -7.680   7.275   1.054
   71    HG2  GLU  12           HG2      GLU  12  -8.616   8.495   2.963
   72    HG3  GLU  12           HG3      GLU  12  -7.357   7.824   4.018
   73    H    CYS  13           H        CYS  13  -6.941   3.676   2.131
   74    HA   CYS  13           HA       CYS  13  -7.648   3.133  -0.664
   75    HB2  CYS  13           HB2      CYS  13  -5.364   2.754   0.309
   76    HB3  CYS  13           HB3      CYS  13  -6.042   1.437   1.282
   77    H    CYS  14           H        CYS  14  -8.275   0.807  -1.268
   78    HA   CYS  14           HA       CYS  14 -10.734   0.159   0.202
   79    HB2  CYS  14           HB3      CYS  14  -9.513  -0.768  -2.398
   80    HB3  CYS  14           HB2      CYS  14 -10.922  -1.578  -1.690
   81    H    GLU  15           H        GLU  15  -8.028  -0.385   1.387
   82    HA   GLU  15           HA       GLU  15  -8.410  -3.304   1.921
   83    HB2  GLU  15           HB2      GLU  15  -5.876  -1.668   1.663
   84    HB3  GLU  15           HB3      GLU  15  -5.903  -3.209   2.535
   85    HG2  GLU  15           HG3      GLU  15  -6.954  -3.051  -0.281
   86    HG3  GLU  15           HG2      GLU  15  -5.206  -3.121   0.016
   87    HA   PRO  16           HA       PRO  16  -9.231  -1.323   5.959
   88    HB2  PRO  16           HB2      PRO  16 -10.230  -3.990   6.777
   89    HB3  PRO  16           HB3      PRO  16 -11.097  -2.432   6.689
   90    HG2  PRO  16           HG3      PRO  16 -11.570  -4.466   4.980
   91    HG3  PRO  16           HG2      PRO  16 -11.724  -2.750   4.508
   92    HD2  PRO  16           HD2      PRO  16  -9.482  -4.693   3.958
   93    HD3  PRO  16           HD3      PRO  16 -10.222  -3.466   2.884
   94    H    ASP  17           H        ASP  17  -8.016  -4.716   5.746
   95    HA   ASP  17           HA       ASP  17  -5.920  -4.001   7.737
   96    HB2  ASP  17           HB2      ASP  17  -6.247  -6.235   8.847
   97    HB3  ASP  17           HB3      ASP  17  -7.550  -5.065   9.118
   98    H    LYS  18           H        LYS  18  -6.689  -5.307   4.749
   99    HA   LYS  18           HA       LYS  18  -4.482  -7.268   4.692
  100    HB2  LYS  18           HB3      LYS  18  -6.593  -6.423   2.696
  101    HB3  LYS  18           HB2      LYS  18  -5.243  -7.483   2.255
  102    HG2  LYS  18           HG2      LYS  18  -5.947  -9.106   3.961
  103    HG3  LYS  18           HG3      LYS  18  -7.305  -8.051   4.406
  104    HD2  LYS  18           HD3      LYS  18  -8.206  -8.252   2.118
  105    HD3  LYS  18           HD2      LYS  18  -6.846  -9.307   1.679
  106    HE2  LYS  18           HE2      LYS  18  -7.557 -10.938   3.376
  107    HE3  LYS  18           HE3      LYS  18  -8.918  -9.889   3.822
  108    HZ1  LYS  18           HZ1      LYS  18  -9.589 -11.622   2.316
  109    HZ2  LYS  18           HZ2      LYS  18  -9.762 -10.151   1.589
  110    HZ3  LYS  18           HZ3      LYS  18  -8.498 -11.128   1.181
  111    H    CYS  19           H        CYS  19  -4.266  -4.134   4.855
  112    HA   CYS  19           HA       CYS  19  -2.629  -3.616   2.443
  113    HB2  CYS  19           HB2      CYS  19  -2.548  -1.329   3.184
  114    HB3  CYS  19           HB3      CYS  19  -4.223  -1.894   3.284
  115    H    ILE  20           H        ILE  20  -0.464  -3.633   2.379
  116    HA   ILE  20           HA       ILE  20   0.940  -4.250   4.922
  117    HB   ILE  20           HB       ILE  20   2.915  -4.813   3.415
  118   HG12  ILE  20          HG13      ILE  20   1.014  -5.260   1.153
  119   HG13  ILE  20          HG12      ILE  20   1.593  -3.605   1.409
  120   HG21  ILE  20          HG21      ILE  20   2.006  -7.043   2.862
  121   HG22  ILE  20          HG22      ILE  20   0.361  -6.433   3.159
  122   HG23  ILE  20          HG23      ILE  20   1.537  -6.509   4.494
  123   HD11  ILE  20          HD11      ILE  20   2.991  -4.791  -0.216
  124   HD12  ILE  20          HD12      ILE  20   3.919  -4.380   1.246
  125   HD13  ILE  20          HD13      ILE  20   3.347  -6.046   0.995
  126    H    ILE  21           H        ILE  21   3.021  -3.303   5.357
  127    HA   ILE  21           HA       ILE  21   2.915  -0.394   4.922
  128    HB   ILE  21           HB       ILE  21   5.112  -1.787   6.481
  129   HG12  ILE  21          HG12      ILE  21   3.349  -1.220   8.455
  130   HG13  ILE  21          HG13      ILE  21   2.219  -1.691   7.174
  131   HG21  ILE  21          HG21      ILE  21   4.482   0.337   7.963
  132   HG22  ILE  21          HG22      ILE  21   3.851   0.925   6.407
  133   HG23  ILE  21          HG23      ILE  21   5.564   0.462   6.555
  134   HD11  ILE  21          HD11      ILE  21   2.798  -3.599   8.591
  135   HD12  ILE  21          HD12      ILE  21   4.524  -3.362   8.224
  136   HD13  ILE  21          HD13      ILE  21   3.397  -3.841   6.932
  137    H    MET  22           H        MET  22   4.918   0.820   4.456
  138    HA   MET  22           HA       MET  22   5.949   0.398   1.916
  139    HB2  MET  22           HB3      MET  22   7.326   1.760   4.261
  140    HB3  MET  22           HB2      MET  22   7.795   1.929   2.563
  141    HG2  MET  22           HG2      MET  22   5.474   2.827   2.120
  142    HG3  MET  22           HG3      MET  22   5.247   2.883   3.879
  143    HE1  MET  22           HE1      MET  22   5.888   6.633   2.483
  144    HE2  MET  22           HE2      MET  22   5.242   5.295   1.503
  145    HE3  MET  22           HE3      MET  22   4.653   5.547   3.164
  146    H    LEU  23           H        LEU  23   6.894  -1.386   1.170
  147    HA   LEU  23           HA       LEU  23   9.424  -2.242   2.405
  148    HB2  LEU  23           HB3      LEU  23   8.252  -3.770   3.633
  149    HB3  LEU  23           HB2      LEU  23   6.913  -3.834   2.484
  150    HG   LEU  23           HG       LEU  23   8.644  -5.121   0.972
  151   HD11  LEU  23          HD11      LEU  23  10.565  -4.780   2.480
  152   HD12  LEU  23          HD12      LEU  23   9.715  -5.682   3.757
  153   HD13  LEU  23          HD13      LEU  23  10.198  -6.507   2.255
  154   HD21  LEU  23          HD21      LEU  23   6.523  -6.008   1.856
  155   HD22  LEU  23          HD22      LEU  23   7.818  -7.229   1.887
  156   HD23  LEU  23          HD23      LEU  23   7.335  -6.405   3.389
  157    HA   PRO  24           HA       PRO  24   9.006  -4.456  -1.938
  158    HB2  PRO  24           HB2      PRO  24   6.729  -2.931  -3.177
  159    HB3  PRO  24           HB3      PRO  24   7.148  -4.665  -3.305
  160    HG2  PRO  24           HG2      PRO  24   5.098  -3.906  -1.818
  161    HG3  PRO  24           HG3      PRO  24   6.216  -5.174  -1.238
  162    HD2  PRO  24           HD3      PRO  24   6.123  -2.246  -0.505
  163    HD3  PRO  24           HD2      PRO  24   6.269  -3.673   0.568
  164    H    THR  25           H        THR  25   9.518  -3.659  -4.236
  165    HA   THR  25           HA       THR  25  10.848  -2.349  -5.563
  166    HB   THR  25           HB       THR  25  10.273   0.075  -5.802
  167    HG1  THR  25           HG1      THR  25   8.576   0.910  -4.568
  168   HG21  THR  25          HG21      THR  25   7.983  -0.283  -6.641
  169   HG22  THR  25          HG22      THR  25   9.065  -1.621  -7.094
  170   HG23  THR  25          HG23      THR  25   7.905  -1.827  -5.759
  171    H    TRP  26           H        TRP  26  12.281  -0.187  -5.611
  172    HA   TRP  26           HA       TRP  26  14.284  -0.603  -3.592
  173    HB2  TRP  26           HB2      TRP  26  15.013   1.794  -4.698
  174    HB3  TRP  26           HB3      TRP  26  15.465   0.197  -5.309
  175    HD1  TRP  26           HD1      TRP  26  13.461  -0.783  -7.203
  176    HE1  TRP  26           HE1      TRP  26  12.427   0.512  -9.169
  177    HE3  TRP  26           HE3      TRP  26  14.559   3.967  -5.655
  178    HZ2  TRP  26           HZ2      TRP  26  12.191   3.196  -9.975
  179    HZ3  TRP  26           HZ3      TRP  26  13.917   5.855  -7.100
  180    HH2  TRP  26           HH2      TRP  26  12.747   5.471  -9.232
  181    HA   PRO  27           HA       PRO  27  12.928   3.407  -1.468
  182    HB2  PRO  27           HB2      PRO  27  10.577   4.676  -2.512
  183    HB3  PRO  27           HB3      PRO  27  12.269   5.200  -2.732
  184    HG2  PRO  27           HG3      PRO  27  10.552   4.259  -4.733
  185    HG3  PRO  27           HG2      PRO  27  12.324   4.432  -4.856
  186    HD2  PRO  27           HD2      PRO  27  10.675   1.980  -4.315
  187    HD3  PRO  27           HD3      PRO  27  12.209   2.159  -5.225
  188    HA   PRO  28           HA       PRO  28   9.627   1.711   1.061
  189    HB2  PRO  28           HB2      PRO  28   9.207   4.185   2.588
  190    HB3  PRO  28           HB3      PRO  28  10.056   2.694   3.084
  191    HG2  PRO  28           HG2      PRO  28  11.312   5.077   2.652
  192    HG3  PRO  28           HG3      PRO  28  12.094   3.486   2.443
  193    HD2  PRO  28           HD3      PRO  28  10.927   5.324   0.361
  194    HD3  PRO  28           HD2      PRO  28  12.454   4.386   0.319
  195    H    ARG  29           H        ARG  29   7.672   1.320   0.185
  196    HA   ARG  29           HA       ARG  29   5.666   3.493   0.098
  197    HB2  ARG  29           HB3      ARG  29   6.595   1.951  -2.340
  198    HB3  ARG  29           HB2      ARG  29   4.990   2.696  -2.248
  199    HG2  ARG  29           HG2      ARG  29   5.929   4.892  -2.036
  200    HG3  ARG  29           HG3      ARG  29   7.569   4.236  -1.852
  201    HD2  ARG  29           HD2      ARG  29   7.357   3.270  -4.160
  202    HD3  ARG  29           HD3      ARG  29   5.813   4.131  -4.325
  203    HE   ARG  29           HE       ARG  29   7.798   6.002  -3.544
  204   HH11  ARG  29          HH11      ARG  29   6.978   3.994  -6.348
  205   HH12  ARG  29          HH12      ARG  29   7.720   5.096  -7.486
  206   HH21  ARG  29          HH21      ARG  29   8.744   7.397  -5.043
  207   HH22  ARG  29          HH22      ARG  29   8.714   7.013  -6.750
  208    H    TYR  30           H        TYR  30   3.620   2.833   0.483
  209    HA   TYR  30           HA       TYR  30   3.143   0.113   1.421
  210    HB2  TYR  30           HB3      TYR  30   1.341   2.522   0.984
  211    HB3  TYR  30           HB2      TYR  30   0.745   0.967   1.578
  212    HD1  TYR  30           HD1      TYR  30   0.996   0.335   3.852
  213    HD2  TYR  30           HD2      TYR  30   2.946   3.839   2.417
  214    HE1  TYR  30           HE1      TYR  30   1.479   1.007   6.162
  215    HE2  TYR  30           HE2      TYR  30   3.442   4.508   4.728
  216    HH   TYR  30           HH       TYR  30   2.352   4.028   7.055
  217    H    VAL  31           H        VAL  31   1.467  -1.337   0.585
  218    HA   VAL  31           HA       VAL  31   0.669  -0.847  -2.239
  219    HB   VAL  31           HB       VAL  31   1.897  -3.492  -1.343
  220   HG11  VAL  31          HG11      VAL  31   0.153  -3.710  -3.087
  221   HG12  VAL  31          HG12      VAL  31   1.770  -4.139  -3.693
  222   HG13  VAL  31          HG13      VAL  31   1.052  -2.564  -4.111
  223   HG21  VAL  31          HG21      VAL  31   3.613  -1.724  -1.553
  224   HG22  VAL  31          HG22      VAL  31   3.784  -2.983  -2.799
  225   HG23  VAL  31          HG23      VAL  31   3.066  -1.409  -3.217
  226    H    CYS  32           H        CYS  32  -1.371  -1.316  -2.635
  227    HA   CYS  32           HA       CYS  32  -2.956  -2.652  -0.508
  228    HB2  CYS  32           HB3      CYS  32  -3.663  -0.895  -2.868
  229    HB3  CYS  32           HB2      CYS  32  -4.889  -1.822  -1.988
  230    H    SER  33           H        SER  33  -3.819  -4.610  -0.715
  231    HA   SER  33           HA       SER  33  -3.422  -6.023  -3.311
  232    HB2  SER  33           HB2      SER  33  -3.734  -7.026  -0.470
  233    HB3  SER  33           HB3      SER  33  -3.702  -8.089  -1.893
  234    HG   SER  33           HG       SER  33  -1.623  -7.834  -0.927
  235    H    VAL  34           H        VAL  34  -5.690  -4.229  -2.354
  236    HA   VAL  34           HA       VAL  34  -7.955  -4.059  -2.391
  237    HB   VAL  34           HB       VAL  34  -7.404  -4.438  -4.796
  238   HG11  VAL  34          HG11      VAL  34  -8.457  -6.615  -5.762
  239   HG12  VAL  34          HG12      VAL  34  -8.112  -7.282  -4.148
  240   HG13  VAL  34          HG13      VAL  34  -6.787  -6.635  -5.145
  241   HG21  VAL  34          HG21      VAL  34  -9.622  -3.682  -4.023
  242   HG22  VAL  34          HG22      VAL  34  -9.698  -4.616  -5.536
  243   HG23  VAL  34          HG23      VAL  34 -10.170  -5.375  -3.997
  Start of MODEL   14
    1    H1   CYS   1           H1       CYS   1 -12.359   1.048  -5.252
    2    H2   CYS   1           H2       CYS   1 -11.370   0.586  -4.016
    3    H3   CYS   1           H3       CYS   1 -12.825   1.289  -3.688
    4    HA   CYS   1           HA       CYS   1 -11.984   3.270  -4.978
    5    HB2  CYS   1           HB2      CYS   1 -10.886   4.180  -2.960
    6    HB3  CYS   1           HB3      CYS   1 -12.420   3.372  -2.604
    7    H    VAL   2           H        VAL   2  -9.352   1.453  -3.307
    8    HA   VAL   2           HA       VAL   2  -7.632   1.899  -5.696
    9    HB   VAL   2           HB       VAL   2  -6.559   2.216  -2.863
   10   HG11  VAL   2          HG11      VAL   2  -5.413   2.280  -5.592
   11   HG12  VAL   2          HG12      VAL   2  -4.654   1.873  -4.035
   12   HG13  VAL   2          HG13      VAL   2  -4.864   3.577  -4.504
   13   HG21  VAL   2          HG21      VAL   2  -8.163   4.043  -3.307
   14   HG22  VAL   2          HG22      VAL   2  -6.486   4.630  -3.201
   15   HG23  VAL   2          HG23      VAL   2  -7.268   4.452  -4.790
   16    H    SER   3           H        SER   3  -8.136  -0.223  -6.238
   17    HA   SER   3           HA       SER   3  -7.531  -2.421  -4.404
   18    HB2  SER   3           HB2      SER   3  -8.350  -2.350  -7.326
   19    HB3  SER   3           HB3      SER   3  -8.125  -3.840  -6.383
   20    HG   SER   3           HG       SER   3 -10.173  -1.967  -6.300
   21    H    SER   4           H        SER   4  -5.998  -0.904  -7.240
   22    HA   SER   4           HA       SER   4  -3.551  -2.504  -6.650
   23    HB2  SER   4           HB2      SER   4  -4.709  -2.006  -9.417
   24    HB3  SER   4           HB3      SER   4  -3.138  -2.764  -9.077
   25    HG   SER   4           HG       SER   4  -4.815  -4.312  -9.421
   26    H    GLY   5           H        GLY   5  -1.712  -1.394  -6.604
   27    HA2  GLY   5           HA2      GLY   5  -0.431   0.414  -7.866
   28    HA3  GLY   5           HA3      GLY   5  -1.824   1.454  -7.511
   29    H    ILE   6           H        ILE   6   0.342   2.569  -6.715
   30    HA   ILE   6           HA       ILE   6   1.056   1.736  -3.974
   31    HB   ILE   6           HB       ILE   6   2.072   4.049  -5.685
   32   HG12  ILE   6          HG12      ILE   6   2.792   1.938  -6.600
   33   HG13  ILE   6          HG13      ILE   6   4.172   2.753  -5.853
   34   HG21  ILE   6          HG21      ILE   6   3.968   4.071  -3.928
   35   HG22  ILE   6          HG22      ILE   6   2.412   4.817  -3.490
   36   HG23  ILE   6          HG23      ILE   6   2.824   3.195  -2.882
   37   HD11  ILE   6          HD11      ILE   6   4.247   0.354  -5.410
   38   HD12  ILE   6          HD12      ILE   6   2.619   0.411  -4.692
   39   HD13  ILE   6          HD13      ILE   6   3.975   1.242  -3.891
   40    H    VAL   7           H        VAL   7   0.762   2.965  -2.142
   41    HA   VAL   7           HA       VAL   7  -1.063   5.292  -2.372
   42    HB   VAL   7           HB       VAL   7  -2.319   4.455  -0.330
   43   HG11  VAL   7          HG11      VAL   7  -3.252   4.476  -2.610
   44   HG12  VAL   7          HG12      VAL   7  -3.874   3.122  -1.636
   45   HG13  VAL   7          HG13      VAL   7  -2.625   2.830  -2.869
   46   HG21  VAL   7          HG21      VAL   7  -0.614   2.613   0.183
   47   HG22  VAL   7          HG22      VAL   7  -2.335   2.168   0.279
   48   HG23  VAL   7          HG23      VAL   7  -1.372   1.695  -1.141
   49    H    ASP   8           H        ASP   8  -0.788   6.885  -0.941
   50    HA   ASP   8           HA       ASP   8   1.570   6.659   0.857
   51    HB2  ASP   8           HB3      ASP   8   0.001   9.034  -0.213
   52    HB3  ASP   8           HB2      ASP   8   1.275   9.175   1.014
   53    H    ALA   9           H        ALA   9  -1.363   5.693   1.147
   54    HA   ALA   9           HA       ALA   9  -1.709   6.650   3.940
   55    HB1  ALA   9           HB1      ALA   9  -3.196   7.892   2.228
   56    HB2  ALA   9           HB2      ALA   9  -4.089   6.357   2.098
   57    HB3  ALA   9           HB3      ALA   9  -3.982   7.194   3.665
   58    H    CYS  10           H        CYS  10  -4.201   5.266   4.317
   59    HA   CYS  10           HA       CYS  10  -3.842   2.437   3.685
   60    HB2  CYS  10           HB3      CYS  10  -3.091   3.536   6.375
   61    HB3  CYS  10           HB2      CYS  10  -3.969   1.999   6.310
   62    H    SER  11           H        SER  11  -5.395   4.968   5.630
   63    HA   SER  11           HA       SER  11  -7.869   3.454   6.000
   64    HB2  SER  11           HB3      SER  11  -8.706   5.618   6.953
   65    HB3  SER  11           HB2      SER  11  -7.229   5.006   7.728
   66    HG   SER  11           HG       SER  11  -7.110   7.259   7.248
   67    H    GLU  12           H        GLU  12  -6.489   5.427   3.560
   68    HA   GLU  12           HA       GLU  12  -9.058   6.235   2.364
   69    HB2  GLU  12           HB2      GLU  12  -6.165   6.604   1.553
   70    HB3  GLU  12           HB3      GLU  12  -7.516   7.087   0.514
   71    HG2  GLU  12           HG2      GLU  12  -8.321   8.604   2.276
   72    HG3  GLU  12           HG3      GLU  12  -6.964   8.121   3.312
   73    H    CYS  13           H        CYS  13  -6.583   3.753   2.018
   74    HA   CYS  13           HA       CYS  13  -7.578   2.780  -0.559
   75    HB2  CYS  13           HB2      CYS  13  -5.218   2.517   0.046
   76    HB3  CYS  13           HB3      CYS  13  -5.666   1.533   1.450
   77    H    CYS  14           H        CYS  14  -8.389   0.581  -0.868
   78    HA   CYS  14           HA       CYS  14 -10.512   0.001   1.088
   79    HB2  CYS  14           HB2      CYS  14  -9.891  -0.953  -1.712
   80    HB3  CYS  14           HB3      CYS  14 -11.182  -1.674  -0.735
   81    H    GLU  15           H        GLU  15  -7.653  -0.596   1.698
   82    HA   GLU  15           HA       GLU  15  -7.864  -3.553   2.074
   83    HB2  GLU  15           HB3      GLU  15  -5.570  -1.734   1.469
   84    HB3  GLU  15           HB2      GLU  15  -5.264  -3.103   2.551
   85    HG2  GLU  15           HG2      GLU  15  -6.673  -3.559  -0.058
   86    HG3  GLU  15           HG3      GLU  15  -4.912  -3.350  -0.033
   87    HA   PRO  16           HA       PRO  16  -8.219  -1.857   6.347
   88    HB2  PRO  16           HB2      PRO  16  -9.902  -4.194   6.937
   89    HB3  PRO  16           HB3      PRO  16 -10.342  -2.463   6.949
   90    HG2  PRO  16           HG2      PRO  16 -11.292  -4.244   5.119
   91    HG3  PRO  16           HG3      PRO  16 -11.084  -2.500   4.794
   92    HD2  PRO  16           HD3      PRO  16  -9.305  -4.808   4.029
   93    HD3  PRO  16           HD2      PRO  16  -9.794  -3.382   3.060
   94    H    ASP  17           H        ASP  17  -6.753  -2.287   7.869
   95    HA   ASP  17           HA       ASP  17  -5.121  -3.322   9.112
   96    HB2  ASP  17           HB2      ASP  17  -7.074  -5.629   8.883
   97    HB3  ASP  17           HB3      ASP  17  -5.625  -5.679   9.905
   98    H    LYS  18           H        LYS  18  -4.924  -3.444   6.124
   99    HA   LYS  18           HA       LYS  18  -2.817  -5.545   6.016
  100    HB2  LYS  18           HB3      LYS  18  -5.021  -5.089   3.985
  101    HB3  LYS  18           HB2      LYS  18  -3.508  -5.918   3.586
  102    HG2  LYS  18           HG2      LYS  18  -3.972  -7.615   5.300
  103    HG3  LYS  18           HG3      LYS  18  -5.492  -6.792   5.707
  104    HD2  LYS  18           HD2      LYS  18  -6.306  -7.162   3.413
  105    HD3  LYS  18           HD3      LYS  18  -4.785  -7.981   3.001
  106    HE2  LYS  18           HE3      LYS  18  -5.252  -9.692   4.718
  107    HE3  LYS  18           HE2      LYS  18  -6.776  -8.870   5.113
  108    HZ1  LYS  18           HZ1      LYS  18  -7.120 -10.709   3.622
  109    HZ2  LYS  18           HZ2      LYS  18  -7.517  -9.294   2.875
  110    HZ3  LYS  18           HZ3      LYS  18  -6.102 -10.055   2.501
  111    H    CYS  19           H        CYS  19  -1.379  -3.831   6.431
  112    HA   CYS  19           HA       CYS  19  -0.784  -2.214   3.995
  113    HB2  CYS  19           HB2      CYS  19  -0.863  -1.290   6.874
  114    HB3  CYS  19           HB3      CYS  19   0.054  -0.426   5.630
  115    H    ILE  20           H        ILE  20   1.206  -2.417   3.278
  116    HA   ILE  20           HA       ILE  20   3.316  -3.337   5.174
  117    HB   ILE  20           HB       ILE  20   4.373  -4.558   3.190
  118   HG12  ILE  20          HG13      ILE  20   2.326  -5.487   1.704
  119   HG13  ILE  20          HG12      ILE  20   1.736  -3.842   1.997
  120   HG21  ILE  20          HG21      ILE  20   3.311  -5.671   5.118
  121   HG22  ILE  20          HG22      ILE  20   3.105  -6.591   3.608
  122   HG23  ILE  20          HG23      ILE  20   1.751  -5.639   4.262
  123   HD11  ILE  20          HD11      ILE  20   2.979  -3.974  -0.105
  124   HD12  ILE  20          HD12      ILE  20   4.411  -4.566   0.770
  125   HD13  ILE  20          HD13      ILE  20   3.808  -2.917   1.063
  126    H    ILE  21           H        ILE  21   5.522  -2.816   4.538
  127    HA   ILE  21           HA       ILE  21   5.581  -0.130   3.277
  128    HB   ILE  21           HB       ILE  21   7.900  -1.452   4.737
  129   HG12  ILE  21          HG12      ILE  21   6.984   0.274   6.589
  130   HG13  ILE  21          HG13      ILE  21   5.438  -0.191   5.859
  131   HG21  ILE  21          HG21      ILE  21   8.397   0.546   3.362
  132   HG22  ILE  21          HG22      ILE  21   7.188   1.469   4.287
  133   HG23  ILE  21          HG23      ILE  21   8.646   0.848   5.099
  134   HD11  ILE  21          HD11      ILE  21   5.959  -1.589   7.797
  135   HD12  ILE  21          HD12      ILE  21   7.494  -2.082   7.043
  136   HD13  ILE  21          HD13      ILE  21   5.946  -2.559   6.305
  137    H    MET  22           H        MET  22   5.715  -0.264   1.166
  138    HA   MET  22           HA       MET  22   6.347  -0.787  -0.963
  139    HB2  MET  22           HB3      MET  22   8.703  -0.562  -1.495
  140    HB3  MET  22           HB2      MET  22   8.206   0.635  -0.294
  141    HG2  MET  22           HG2      MET  22  10.303  -0.030   0.446
  142    HG3  MET  22           HG3      MET  22   9.197  -0.973   1.462
  143    HE1  MET  22           HE1      MET  22  12.239  -3.416   0.956
  144    HE2  MET  22           HE2      MET  22  12.302  -1.645   1.125
  145    HE3  MET  22           HE3      MET  22  11.190  -2.597   2.137
  146    H    LEU  23           H        LEU  23   7.197  -2.259  -2.556
  147    HA   LEU  23           HA       LEU  23   8.103  -4.889  -1.620
  148    HB2  LEU  23           HB2      LEU  23   6.020  -5.730  -1.520
  149    HB3  LEU  23           HB3      LEU  23   5.320  -4.432  -2.494
  150    HG   LEU  23           HG       LEU  23   6.624  -5.774  -4.439
  151   HD11  LEU  23          HD11      LEU  23   7.499  -7.473  -2.882
  152   HD12  LEU  23          HD12      LEU  23   5.833  -7.914  -2.437
  153   HD13  LEU  23          HD13      LEU  23   6.412  -8.185  -4.098
  154   HD21  LEU  23          HD21      LEU  23   4.236  -5.170  -4.395
  155   HD22  LEU  23          HD22      LEU  23   3.911  -6.557  -3.328
  156   HD23  LEU  23          HD23      LEU  23   4.490  -6.829  -4.989
  157    HA   PRO  24           HA       PRO  24   8.855  -4.754  -6.238
  158    HB2  PRO  24           HB2      PRO  24   7.442  -2.913  -7.858
  159    HB3  PRO  24           HB3      PRO  24   6.995  -4.615  -7.560
  160    HG2  PRO  24           HG2      PRO  24   5.592  -2.288  -6.727
  161    HG3  PRO  24           HG3      PRO  24   5.245  -3.984  -6.297
  162    HD2  PRO  24           HD3      PRO  24   6.696  -1.885  -4.748
  163    HD3  PRO  24           HD2      PRO  24   5.730  -3.274  -4.161
  164    H    THR  25           H        THR  25   9.487  -2.428  -4.294
  165    HA   THR  25           HA       THR  25  11.429  -1.075  -6.067
  166    HB   THR  25           HB       THR  25  10.836   1.167  -4.985
  167    HG1  THR  25           HG1      THR  25   9.193   1.211  -3.671
  168   HG21  THR  25          HG21      THR  25   9.900  -0.047  -7.315
  169   HG22  THR  25          HG22      THR  25   9.822   1.686  -6.917
  170   HG23  THR  25          HG23      THR  25   8.436   0.628  -6.560
  171    H    TRP  26           H        TRP  26  12.983   0.302  -4.790
  172    HA   TRP  26           HA       TRP  26  13.813  -1.240  -2.435
  173    HB2  TRP  26           HB2      TRP  26  15.772   0.549  -2.574
  174    HB3  TRP  26           HB3      TRP  26  15.712  -0.877  -3.620
  175    HD1  TRP  26           HD1      TRP  26  14.369  -0.273  -6.129
  176    HE1  TRP  26           HE1      TRP  26  14.745   1.759  -7.653
  177    HE3  TRP  26           HE3      TRP  26  16.618   2.832  -2.735
  178    HZ2  TRP  26           HZ2      TRP  26  15.922   4.303  -7.449
  179    HZ3  TRP  26           HZ3      TRP  26  17.370   5.052  -3.494
  180    HH2  TRP  26           HH2      TRP  26  17.024   5.773  -5.820
  181    HA   PRO  27           HA       PRO  27  13.341   2.996  -0.175
  182    HB2  PRO  27           HB2      PRO  27  11.438   4.655  -1.718
  183    HB3  PRO  27           HB3      PRO  27  13.080   5.061  -1.144
  184    HG2  PRO  27           HG3      PRO  27  12.504   4.714  -3.754
  185    HG3  PRO  27           HG2      PRO  27  14.088   4.274  -3.056
  186    HD2  PRO  27           HD2      PRO  27  11.721   2.498  -3.684
  187    HD3  PRO  27           HD3      PRO  27  13.459   2.249  -4.045
  188    HA   PRO  28           HA       PRO  28   9.507   1.867   1.825
  189    HB2  PRO  28           HB3      PRO  28   9.077   4.641   2.843
  190    HB3  PRO  28           HB2      PRO  28   9.332   3.125   3.754
  191    HG2  PRO  28           HG2      PRO  28  11.226   5.008   3.612
  192    HG3  PRO  28           HG3      PRO  28  11.633   3.268   3.591
  193    HD2  PRO  28           HD3      PRO  28  11.476   5.216   1.296
  194    HD3  PRO  28           HD2      PRO  28  12.713   3.966   1.638
  195    H    ARG  29           H        ARG  29   7.597   1.486   0.951
  196    HA   ARG  29           HA       ARG  29   5.913   3.708  -0.046
  197    HB2  ARG  29           HB2      ARG  29   6.798   1.351  -1.743
  198    HB3  ARG  29           HB3      ARG  29   5.367   2.324  -2.123
  199    HG2  ARG  29           HG2      ARG  29   6.818   4.337  -2.267
  200    HG3  ARG  29           HG3      ARG  29   8.235   3.308  -1.971
  201    HD2  ARG  29           HD2      ARG  29   7.720   2.016  -4.001
  202    HD3  ARG  29           HD3      ARG  29   6.299   3.038  -4.296
  203    HE   ARG  29           HE       ARG  29   8.694   4.624  -4.058
  204   HH11  ARG  29          HH11      ARG  29   6.945   2.525  -6.318
  205   HH12  ARG  29          HH12      ARG  29   7.642   3.289  -7.730
  206   HH21  ARG  29          HH21      ARG  29   9.570   5.581  -5.904
  207   HH22  ARG  29          HH22      ARG  29   9.119   5.010  -7.495
  208    H    TYR  30           H        TYR  30   3.962   1.976  -1.262
  209    HA   TYR  30           HA       TYR  30   3.108   0.027   0.777
  210    HB2  TYR  30           HB2      TYR  30   1.526   2.561   0.212
  211    HB3  TYR  30           HB3      TYR  30   0.851   1.131   1.007
  212    HD1  TYR  30           HD1      TYR  30   1.654   0.500   3.286
  213    HD2  TYR  30           HD2      TYR  30   2.920   4.107   1.405
  214    HE1  TYR  30           HE1      TYR  30   2.399   1.369   5.457
  215    HE2  TYR  30           HE2      TYR  30   3.672   4.975   3.573
  216    HH   TYR  30           HH       TYR  30   2.754   3.754   6.463
  217    H    VAL  31           H        VAL  31   1.585  -1.431  -0.007
  218    HA   VAL  31           HA       VAL  31   0.653  -0.983  -2.808
  219    HB   VAL  31           HB       VAL  31   1.558  -3.721  -1.848
  220   HG11  VAL  31          HG11      VAL  31  -0.017  -3.636  -3.753
  221   HG12  VAL  31          HG12      VAL  31   1.131  -2.605  -4.641
  222   HG13  VAL  31          HG13      VAL  31   1.575  -4.277  -4.223
  223   HG21  VAL  31          HG21      VAL  31   3.516  -2.212  -1.814
  224   HG22  VAL  31          HG22      VAL  31   3.637  -3.447  -3.091
  225   HG23  VAL  31          HG23      VAL  31   3.193  -1.775  -3.509
  226    H    CYS  32           H        CYS  32  -1.414  -1.414  -3.172
  227    HA   CYS  32           HA       CYS  32  -3.024  -2.463  -0.910
  228    HB2  CYS  32           HB2      CYS  32  -3.679  -0.883  -3.402
  229    HB3  CYS  32           HB3      CYS  32  -4.943  -1.649  -2.426
  230    H    SER  33           H        SER  33  -3.826  -4.442  -0.897
  231    HA   SER  33           HA       SER  33  -3.782  -6.001  -3.448
  232    HB2  SER  33           HB2      SER  33  -3.504  -6.862  -0.557
  233    HB3  SER  33           HB3      SER  33  -3.709  -7.998  -1.908
  234    HG   SER  33           HG       SER  33  -1.492  -7.635  -1.380
  235    H    VAL  34           H        VAL  34  -5.890  -4.222  -2.185
  236    HA   VAL  34           HA       VAL  34  -8.125  -4.115  -1.793
  237    HB   VAL  34           HB       VAL  34  -8.021  -4.630  -4.233
  238   HG11  VAL  34          HG11      VAL  34  -9.150  -6.885  -4.866
  239   HG12  VAL  34          HG12      VAL  34  -8.492  -7.446  -3.310
  240   HG13  VAL  34          HG13      VAL  34  -7.396  -6.826  -4.568
  241   HG21  VAL  34          HG21      VAL  34 -10.080  -3.883  -3.099
  242   HG22  VAL  34          HG22      VAL  34 -10.555  -5.585  -2.880
  243   HG23  VAL  34          HG23      VAL  34 -10.402  -4.907  -4.519
  Start of MODEL   15
    1    H1   CYS   1           H1       CYS   1 -12.234   1.172  -5.459
    2    H2   CYS   1           H2       CYS   1 -11.279   0.685  -4.205
    3    H3   CYS   1           H3       CYS   1 -12.703   1.462  -3.904
    4    HA   CYS   1           HA       CYS   1 -11.767   3.382  -5.207
    5    HB2  CYS   1           HB3      CYS   1 -10.620   4.263  -3.194
    6    HB3  CYS   1           HB2      CYS   1 -12.191   3.528  -2.840
    7    H    VAL   2           H        VAL   2  -9.156   1.614  -3.459
    8    HA   VAL   2           HA       VAL   2  -7.473   1.828  -5.906
    9    HB   VAL   2           HB       VAL   2  -6.341   2.349  -3.126
   10   HG11  VAL   2          HG11      VAL   2  -5.264   2.327  -5.914
   11   HG12  VAL   2          HG12      VAL   2  -4.605   3.527  -4.776
   12   HG13  VAL   2          HG13      VAL   2  -4.516   1.791  -4.390
   13   HG21  VAL   2          HG21      VAL   2  -7.934   4.158  -3.676
   14   HG22  VAL   2          HG22      VAL   2  -7.065   4.443  -5.203
   15   HG23  VAL   2          HG23      VAL   2  -6.248   4.730  -3.648
   16    H    SER   3           H        SER   3  -8.007  -0.323  -6.274
   17    HA   SER   3           HA       SER   3  -7.410  -2.369  -4.267
   18    HB2  SER   3           HB2      SER   3  -8.061  -3.944  -6.103
   19    HB3  SER   3           HB3      SER   3  -9.304  -2.743  -5.693
   20    HG   SER   3           HG       SER   3  -8.994  -2.960  -7.970
   21    H    SER   4           H        SER   4  -5.881  -1.111  -7.225
   22    HA   SER   4           HA       SER   4  -3.490  -2.768  -6.554
   23    HB2  SER   4           HB3      SER   4  -3.085  -3.038  -9.017
   24    HB3  SER   4           HB2      SER   4  -4.516  -3.900  -8.410
   25    HG   SER   4           HG       SER   4  -4.936  -2.746 -10.363
   26    H    GLY   5           H        GLY   5  -1.595  -1.757  -6.564
   27    HA2  GLY   5           HA2      GLY   5  -0.212  -0.054  -7.826
   28    HA3  GLY   5           HA3      GLY   5  -1.568   1.060  -7.572
   29    H    ILE   6           H        ILE   6   0.429   2.257  -6.720
   30    HA   ILE   6           HA       ILE   6   1.116   1.484  -3.944
   31    HB   ILE   6           HB       ILE   6   2.198   3.719  -5.714
   32   HG12  ILE   6          HG12      ILE   6   2.927   1.573  -6.529
   33   HG13  ILE   6          HG13      ILE   6   4.292   2.397  -5.766
   34   HG21  ILE   6          HG21      ILE   6   4.042   3.807  -3.916
   35   HG22  ILE   6          HG22      ILE   6   2.878   2.966  -2.865
   36   HG23  ILE   6          HG23      ILE   6   2.477   4.565  -3.536
   37   HD11  ILE   6          HD11      ILE   6   4.291  -0.003  -5.252
   38   HD12  ILE   6          HD12      ILE   6   2.665   0.136  -4.544
   39   HD13  ILE   6          HD13      ILE   6   4.044   0.957  -3.773
   40    H    VAL   7           H        VAL   7   0.702   2.701  -2.166
   41    HA   VAL   7           HA       VAL   7  -1.099   5.041  -2.524
   42    HB   VAL   7           HB       VAL   7  -2.339   4.296  -0.436
   43   HG11  VAL   7          HG11      VAL   7  -3.125   4.117  -2.854
   44   HG12  VAL   7          HG12      VAL   7  -2.723   2.387  -2.741
   45   HG13  VAL   7          HG13      VAL   7  -3.948   3.089  -1.656
   46   HG21  VAL   7          HG21      VAL   7  -0.609   2.505   0.169
   47   HG22  VAL   7          HG22      VAL   7  -1.360   1.508  -1.100
   48   HG23  VAL   7          HG23      VAL   7  -2.324   2.046   0.297
   49    H    ASP   8           H        ASP   8  -0.846   6.712  -1.168
   50    HA   ASP   8           HA       ASP   8   1.547   6.632   0.588
   51    HB2  ASP   8           HB2      ASP   8  -0.157   8.895  -0.507
   52    HB3  ASP   8           HB3      ASP   8   1.133   9.144   0.685
   53    H    ALA   9           H        ALA   9  -1.353   5.576   0.993
   54    HA   ALA   9           HA       ALA   9  -1.637   6.592   3.773
   55    HB1  ALA   9           HB1      ALA   9  -3.234   7.709   2.070
   56    HB2  ALA   9           HB2      ALA   9  -4.058   6.133   2.021
   57    HB3  ALA   9           HB3      ALA   9  -3.939   7.027   3.555
   58    H    CYS  10           H        CYS  10  -4.032   5.107   4.299
   59    HA   CYS  10           HA       CYS  10  -3.562   2.279   3.717
   60    HB2  CYS  10           HB3      CYS  10  -1.908   2.678   5.525
   61    HB3  CYS  10           HB2      CYS  10  -3.203   3.307   6.555
   62    H    SER  11           H        SER  11  -5.176   4.809   5.595
   63    HA   SER  11           HA       SER  11  -7.582   3.173   6.034
   64    HB2  SER  11           HB2      SER  11  -6.997   6.091   6.659
   65    HB3  SER  11           HB3      SER  11  -8.443   5.193   7.172
   66    HG   SER  11           HG       SER  11  -6.807   5.250   8.800
   67    H    GLU  12           H        GLU  12  -6.335   5.368   3.682
   68    HA   GLU  12           HA       GLU  12  -8.950   6.175   2.617
   69    HB2  GLU  12           HB2      GLU  12  -6.100   6.586   1.685
   70    HB3  GLU  12           HB3      GLU  12  -7.501   7.114   0.738
   71    HG2  GLU  12           HG2      GLU  12  -8.217   8.546   2.608
   72    HG3  GLU  12           HG3      GLU  12  -6.812   8.017   3.552
   73    H    CYS  13           H        CYS  13  -6.498   3.719   2.035
   74    HA   CYS  13           HA       CYS  13  -7.545   2.860  -0.548
   75    HB2  CYS  13           HB2      CYS  13  -5.198   2.495   0.097
   76    HB3  CYS  13           HB3      CYS  13  -5.713   1.450   1.431
   77    H    CYS  14           H        CYS  14  -8.405   0.650  -0.914
   78    HA   CYS  14           HA       CYS  14 -10.607   0.144   0.968
   79    HB2  CYS  14           HB2      CYS  14  -9.905  -0.906  -1.779
   80    HB3  CYS  14           HB3      CYS  14 -11.274  -1.527  -0.842
   81    H    GLU  15           H        GLU  15  -7.793  -0.514   1.693
   82    HA   GLU  15           HA       GLU  15  -8.086  -3.455   2.127
   83    HB2  GLU  15           HB2      GLU  15  -5.720  -1.671   1.671
   84    HB3  GLU  15           HB3      GLU  15  -5.513  -3.092   2.709
   85    HG2  GLU  15           HG3      GLU  15  -6.792  -3.390   0.005
   86    HG3  GLU  15           HG2      GLU  15  -5.031  -3.228   0.137
   87    HA   PRO  16           HA       PRO  16  -8.680  -1.621   6.323
   88    HB2  PRO  16           HB2      PRO  16 -10.382  -3.966   6.868
   89    HB3  PRO  16           HB3      PRO  16 -10.820  -2.235   6.856
   90    HG2  PRO  16           HG2      PRO  16 -11.699  -4.002   4.992
   91    HG3  PRO  16           HG3      PRO  16 -11.434  -2.268   4.657
   92    HD2  PRO  16           HD3      PRO  16  -9.664  -4.622   4.021
   93    HD3  PRO  16           HD2      PRO  16 -10.077  -3.206   3.004
   94    H    ASP  17           H        ASP  17  -7.137  -1.957   7.778
   95    HA   ASP  17           HA       ASP  17  -5.543  -2.929   9.114
   96    HB2  ASP  17           HB3      ASP  17  -7.567  -5.189   9.110
   97    HB3  ASP  17           HB2      ASP  17  -6.112  -5.178  10.125
   98    H    LYS  18           H        LYS  18  -5.476  -3.423   6.103
   99    HA   LYS  18           HA       LYS  18  -3.319  -5.464   6.205
  100    HB2  LYS  18           HB2      LYS  18  -5.667  -5.462   4.289
  101    HB3  LYS  18           HB3      LYS  18  -4.153  -6.310   3.938
  102    HG2  LYS  18           HG3      LYS  18  -5.600  -6.852   6.521
  103    HG3  LYS  18           HG2      LYS  18  -6.183  -7.582   5.012
  104    HD2  LYS  18           HD2      LYS  18  -3.965  -8.583   4.630
  105    HD3  LYS  18           HD3      LYS  18  -3.370  -7.851   6.134
  106    HE2  LYS  18           HE2      LYS  18  -3.902 -10.096   6.674
  107    HE3  LYS  18           HE3      LYS  18  -5.228  -9.116   7.332
  108    HZ1  LYS  18           HZ1      LYS  18  -6.039 -11.058   6.192
  109    HZ2  LYS  18           HZ2      LYS  18  -6.527  -9.698   5.396
  110    HZ3  LYS  18           HZ3      LYS  18  -5.293 -10.610   4.791
  111    H    CYS  19           H        CYS  19  -1.906  -3.706   6.169
  112    HA   CYS  19           HA       CYS  19  -1.623  -2.469   3.466
  113    HB2  CYS  19           HB2      CYS  19  -1.292  -1.162   6.176
  114    HB3  CYS  19           HB3      CYS  19  -0.623  -0.473   4.688
  115    H    ILE  20           H        ILE  20   0.198  -2.998   2.518
  116    HA   ILE  20           HA       ILE  20   2.442  -4.033   4.179
  117    HB   ILE  20           HB       ILE  20   2.326  -4.180   1.144
  118   HG12  ILE  20          HG12      ILE  20   1.566  -6.674   1.824
  119   HG13  ILE  20          HG13      ILE  20   0.769  -5.778   3.128
  120   HG21  ILE  20          HG21      ILE  20   4.465  -4.709   2.277
  121   HG22  ILE  20          HG22      ILE  20   3.639  -5.969   3.224
  122   HG23  ILE  20          HG23      ILE  20   3.773  -6.129   1.456
  123   HD11  ILE  20          HD11      ILE  20  -0.741  -6.117   1.234
  124   HD12  ILE  20          HD12      ILE  20   0.411  -5.297   0.154
  125   HD13  ILE  20          HD13      ILE  20  -0.390  -4.387   1.457
  126    H    ILE  21           H        ILE  21   4.619  -3.372   3.732
  127    HA   ILE  21           HA       ILE  21   4.736  -0.529   2.835
  128    HB   ILE  21           HB       ILE  21   6.867  -1.912   4.509
  129   HG12  ILE  21          HG13      ILE  21   5.613  -0.381   6.348
  130   HG13  ILE  21          HG12      ILE  21   4.219  -0.842   5.357
  131   HG21  ILE  21          HG21      ILE  21   7.467   0.215   3.394
  132   HG22  ILE  21          HG22      ILE  21   6.102   1.014   4.209
  133   HG23  ILE  21          HG23      ILE  21   7.455   0.368   5.167
  134   HD11  ILE  21          HD11      ILE  21   4.519  -2.382   7.234
  135   HD12  ILE  21          HD12      ILE  21   4.757  -3.214   5.678
  136   HD13  ILE  21          HD13      ILE  21   6.164  -2.761   6.670
  137    H    MET  22           H        MET  22   5.297  -0.363   0.823
  138    HA   MET  22           HA       MET  22   6.263  -0.668  -1.223
  139    HB2  MET  22           HB2      MET  22   8.702  -0.512  -1.308
  140    HB3  MET  22           HB3      MET  22   7.990   0.644  -0.177
  141    HG2  MET  22           HG2      MET  22   9.914  -0.119   0.907
  142    HG3  MET  22           HG3      MET  22   8.608  -1.050   1.665
  143    HE1  MET  22           HE1      MET  22  11.608  -3.593   1.644
  144    HE2  MET  22           HE2      MET  22  10.379  -2.772   2.638
  145    HE3  MET  22           HE3      MET  22  11.694  -1.832   1.892
  146    H    LEU  23           H        LEU  23   6.729  -2.032  -2.846
  147    HA   LEU  23           HA       LEU  23   7.789  -4.713  -2.172
  148    HB2  LEU  23           HB2      LEU  23   5.667  -5.498  -2.171
  149    HB3  LEU  23           HB3      LEU  23   5.039  -4.169  -3.151
  150    HG   LEU  23           HG       LEU  23   6.442  -5.438  -5.056
  151   HD11  LEU  23          HD11      LEU  23   7.285  -7.171  -3.519
  152   HD12  LEU  23          HD12      LEU  23   5.611  -7.664  -3.166
  153   HD13  LEU  23          HD13      LEU  23   6.271  -7.864  -4.807
  154   HD21  LEU  23          HD21      LEU  23   4.040  -4.888  -5.101
  155   HD22  LEU  23          HD22      LEU  23   3.700  -6.318  -4.098
  156   HD23  LEU  23          HD23      LEU  23   4.359  -6.518  -5.739
  157    HA   PRO  24           HA       PRO  24   8.628  -4.136  -6.738
  158    HB2  PRO  24           HB2      PRO  24   7.265  -2.110  -8.185
  159    HB3  PRO  24           HB3      PRO  24   6.815  -3.834  -8.095
  160    HG2  PRO  24           HG3      PRO  24   5.377  -1.626  -7.052
  161    HG3  PRO  24           HG2      PRO  24   5.037  -3.358  -6.795
  162    HD2  PRO  24           HD3      PRO  24   6.456  -1.406  -5.031
  163    HD3  PRO  24           HD2      PRO  24   5.472  -2.837  -4.589
  164    H    THR  25           H        THR  25   9.252  -2.030  -4.560
  165    HA   THR  25           HA       THR  25  11.244  -0.532  -6.151
  166    HB   THR  25           HB       THR  25  10.656   1.597  -4.860
  167    HG1  THR  25           HG1      THR  25   9.017   1.495  -3.549
  168   HG21  THR  25          HG21      THR  25   9.786   0.663  -7.323
  169   HG22  THR  25          HG22      THR  25   8.284   1.211  -6.541
  170   HG23  THR  25          HG23      THR  25   9.650   2.336  -6.731
  171    H    TRP  26           H        TRP  26  12.805   0.662  -4.729
  172    HA   TRP  26           HA       TRP  26  13.535  -1.103  -2.496
  173    HB2  TRP  26           HB2      TRP  26  15.577   0.570  -2.461
  174    HB3  TRP  26           HB3      TRP  26  15.451  -0.720  -3.666
  175    HD1  TRP  26           HD1      TRP  26  14.193   0.222  -6.097
  176    HE1  TRP  26           HE1      TRP  26  14.665   2.400  -7.373
  177    HE3  TRP  26           HE3      TRP  26  16.494   2.834  -2.342
  178    HZ2  TRP  26           HZ2      TRP  26  15.929   4.857  -6.864
  179    HZ3  TRP  26           HZ3      TRP  26  17.333   5.097  -2.831
  180    HH2  TRP  26           HH2      TRP  26  17.050   6.094  -5.062
  181    HA   PRO  27           HA       PRO  27  13.196   2.992   0.053
  182    HB2  PRO  27           HB3      PRO  27  11.289   4.751  -1.377
  183    HB3  PRO  27           HB2      PRO  27  12.925   5.128  -0.765
  184    HG2  PRO  27           HG2      PRO  27  12.386   4.962  -3.396
  185    HG3  PRO  27           HG3      PRO  27  13.949   4.430  -2.712
  186    HD2  PRO  27           HD3      PRO  27  11.538   2.763  -3.449
  187    HD3  PRO  27           HD2      PRO  27  13.260   2.495  -3.866
  188    HA   PRO  28           HA       PRO  28   9.365   1.819   2.031
  189    HB2  PRO  28           HB2      PRO  28   8.951   4.534   3.201
  190    HB3  PRO  28           HB3      PRO  28   9.234   2.970   4.019
  191    HG2  PRO  28           HG2      PRO  28  11.116   4.871   3.944
  192    HG3  PRO  28           HG3      PRO  28  11.524   3.135   3.836
  193    HD2  PRO  28           HD2      PRO  28  11.348   5.188   1.632
  194    HD3  PRO  28           HD3      PRO  28  12.573   3.911   1.911
  195    H    ARG  29           H        ARG  29   7.475   1.484   1.108
  196    HA   ARG  29           HA       ARG  29   5.765   3.756   0.284
  197    HB2  ARG  29           HB2      ARG  29   6.682   1.546  -1.584
  198    HB3  ARG  29           HB3      ARG  29   5.218   2.497  -1.882
  199    HG2  ARG  29           HG2      ARG  29   6.592   4.558  -1.907
  200    HG3  ARG  29           HG3      ARG  29   8.049   3.572  -1.665
  201    HD2  ARG  29           HD2      ARG  29   7.605   2.392  -3.774
  202    HD3  ARG  29           HD3      ARG  29   6.136   3.359  -4.015
  203    HE   ARG  29           HE       ARG  29   8.467   5.028  -3.669
  204   HH11  ARG  29          HH11      ARG  29   6.763   3.041  -6.059
  205   HH12  ARG  29          HH12      ARG  29   7.409   3.934  -7.417
  206   HH21  ARG  29          HH21      ARG  29   9.279   6.154  -5.446
  207   HH22  ARG  29          HH22      ARG  29   8.826   5.688  -7.070
  208    H    TYR  30           H        TYR  30   3.828   2.039  -1.045
  209    HA   TYR  30           HA       TYR  30   3.031   0.039   0.984
  210    HB2  TYR  30           HB3      TYR  30   1.387   2.517   0.363
  211    HB3  TYR  30           HB2      TYR  30   0.725   1.061   1.123
  212    HD1  TYR  30           HD1      TYR  30   1.432   0.417   3.410
  213    HD2  TYR  30           HD2      TYR  30   2.752   4.057   1.631
  214    HE1  TYR  30           HE1      TYR  30   2.101   1.253   5.620
  215    HE2  TYR  30           HE2      TYR  30   3.424   4.894   3.838
  216    HH   TYR  30           HH       TYR  30   3.838   3.007   6.475
  217    H    VAL  31           H        VAL  31   1.358  -1.366   0.292
  218    HA   VAL  31           HA       VAL  31   0.671  -1.176  -2.610
  219    HB   VAL  31           HB       VAL  31   1.094  -3.895  -1.392
  220   HG11  VAL  31          HG11      VAL  31   0.068  -3.635  -3.624
  221   HG12  VAL  31          HG12      VAL  31   1.541  -2.814  -4.193
  222   HG13  VAL  31          HG13      VAL  31   1.610  -4.520  -3.690
  223   HG21  VAL  31          HG21      VAL  31   3.465  -3.822  -2.390
  224   HG22  VAL  31          HG22      VAL  31   3.204  -3.045  -0.810
  225   HG23  VAL  31          HG23      VAL  31   3.313  -2.052  -2.283
  226    H    CYS  32           H        CYS  32  -1.355  -1.796  -3.179
  227    HA   CYS  32           HA       CYS  32  -3.181  -2.537  -0.930
  228    HB2  CYS  32           HB2      CYS  32  -3.572  -0.833  -3.387
  229    HB3  CYS  32           HB3      CYS  32  -4.953  -1.565  -2.554
  230    H    SER  33           H        SER  33  -4.552  -4.241  -1.143
  231    HA   SER  33           HA       SER  33  -4.527  -5.728  -3.732
  232    HB2  SER  33           HB2      SER  33  -3.986  -6.852  -0.969
  233    HB3  SER  33           HB3      SER  33  -4.379  -7.855  -2.382
  234    HG   SER  33           HG       SER  33  -2.106  -7.620  -2.063
  235    H    VAL  34           H        VAL  34  -6.405  -3.997  -2.072
  236    HA   VAL  34           HA       VAL  34  -8.575  -3.850  -1.423
  237    HB   VAL  34           HB       VAL  34  -8.773  -4.123  -3.894
  238   HG11  VAL  34          HG11      VAL  34 -10.061  -6.269  -4.604
  239   HG12  VAL  34          HG12      VAL  34  -8.284  -6.295  -4.507
  240   HG13  VAL  34          HG13      VAL  34  -9.257  -7.002  -3.196
  241   HG21  VAL  34          HG21      VAL  34 -10.657  -3.430  -2.462
  242   HG22  VAL  34          HG22      VAL  34 -11.174  -5.130  -2.352
  243   HG23  VAL  34          HG23      VAL  34 -11.180  -4.298  -3.925
  Start of MODEL   16
    1    H1   CYS   1           H1       CYS   1 -10.709   5.899  -3.947
    2    H2   CYS   1           H2       CYS   1 -11.834   5.005  -4.755
    3    H3   CYS   1           H3       CYS   1 -12.102   5.448  -3.189
    4    HA   CYS   1           HA       CYS   1 -10.299   4.103  -2.414
    5    HB2  CYS   1           HB3      CYS   1 -12.742   3.249  -2.993
    6    HB3  CYS   1           HB2      CYS   1 -11.882   2.305  -4.220
    7    H    VAL   2           H        VAL   2  -8.773   2.379  -2.902
    8    HA   VAL   2           HA       VAL   2  -7.763   2.424  -5.708
    9    HB   VAL   2           HB       VAL   2  -5.906   2.486  -3.293
   10   HG11  VAL   2          HG11      VAL   2  -4.997   1.506  -5.375
   11   HG12  VAL   2          HG12      VAL   2  -5.376   3.017  -6.237
   12   HG13  VAL   2          HG13      VAL   2  -4.172   3.018  -4.926
   13   HG21  VAL   2          HG21      VAL   2  -7.163   4.613  -3.390
   14   HG22  VAL   2          HG22      VAL   2  -6.641   4.831  -5.077
   15   HG23  VAL   2          HG23      VAL   2  -5.438   4.832  -3.766
   16    H    SER   3           H        SER   3  -8.779   0.463  -6.026
   17    HA   SER   3           HA       SER   3  -8.625  -1.842  -4.403
   18    HB2  SER   3           HB2      SER   3  -9.164  -3.088  -6.505
   19    HB3  SER   3           HB3      SER   3 -10.226  -1.700  -6.188
   20    HG   SER   3           HG       SER   3  -9.501  -1.783  -8.378
   21    H    SER   4           H        SER   4  -6.466  -0.858  -7.103
   22    HA   SER   4           HA       SER   4  -4.403  -2.692  -5.989
   23    HB2  SER   4           HB2      SER   4  -5.148  -2.549  -8.933
   24    HB3  SER   4           HB3      SER   4  -3.811  -3.490  -8.237
   25    HG   SER   4           HG       SER   4  -5.710  -4.757  -8.572
   26    H    GLY   5           H        GLY   5  -2.257  -2.137  -6.425
   27    HA2  GLY   5           HA3      GLY   5  -0.703  -0.674  -7.703
   28    HA3  GLY   5           HA2      GLY   5  -1.908   0.617  -7.539
   29    H    ILE   6           H        ILE   6   0.135   1.703  -6.752
   30    HA   ILE   6           HA       ILE   6   0.779   1.036  -3.935
   31    HB   ILE   6           HB       ILE   6   2.062   3.042  -5.840
   32   HG12  ILE   6          HG13      ILE   6   2.588   0.784  -6.517
   33   HG13  ILE   6          HG12      ILE   6   4.017   1.534  -5.796
   34   HG21  ILE   6          HG21      ILE   6   3.911   3.068  -4.044
   35   HG22  ILE   6          HG22      ILE   6   2.675   2.407  -2.947
   36   HG23  ILE   6          HG23      ILE   6   2.425   3.992  -3.717
   37   HD11  ILE   6          HD11      ILE   6   3.804  -0.820  -5.130
   38   HD12  ILE   6          HD12      ILE   6   2.211  -0.479  -4.413
   39   HD13  ILE   6          HD13      ILE   6   3.674   0.263  -3.723
   40    H    VAL   7           H        VAL   7   0.514   2.403  -2.243
   41    HA   VAL   7           HA       VAL   7  -0.971   4.928  -2.704
   42    HB   VAL   7           HB       VAL   7  -2.454   4.365  -0.709
   43   HG11  VAL   7          HG11      VAL   7  -3.246   4.419  -3.041
   44   HG12  VAL   7          HG12      VAL   7  -4.105   3.205  -2.063
   45   HG13  VAL   7          HG13      VAL   7  -2.841   2.693  -3.206
   46   HG21  VAL   7          HG21      VAL   7  -1.197   2.401   0.126
   47   HG22  VAL   7          HG22      VAL   7  -2.904   2.018  -0.204
   48   HG23  VAL   7          HG23      VAL   7  -1.640   1.506  -1.348
   49    H    ASP   8           H        ASP   8  -0.737   6.495  -1.131
   50    HA   ASP   8           HA       ASP   8   1.619   6.109   0.631
   51    HB2  ASP   8           HB3      ASP   8   0.065   8.567  -0.252
   52    HB3  ASP   8           HB2      ASP   8   1.361   8.615   0.958
   53    H    ALA   9           H        ALA   9  -1.297   5.134   0.973
   54    HA   ALA   9           HA       ALA   9  -1.535   5.919   3.826
   55    HB1  ALA   9           HB1      ALA   9  -3.058   7.295   2.215
   56    HB2  ALA   9           HB2      ALA   9  -4.013   5.797   2.111
   57    HB3  ALA   9           HB3      ALA   9  -3.768   6.589   3.686
   58    H    CYS  10           H        CYS  10  -3.875   4.593   4.440
   59    HA   CYS  10           HA       CYS  10  -3.665   1.795   3.520
   60    HB2  CYS  10           HB2      CYS  10  -3.063   2.691   6.347
   61    HB3  CYS  10           HB3      CYS  10  -3.649   1.058   5.990
   62    H    SER  11           H        SER  11  -5.152   4.229   5.638
   63    HA   SER  11           HA       SER  11  -7.649   2.717   5.915
   64    HB2  SER  11           HB3      SER  11  -8.424   4.785   7.106
   65    HB3  SER  11           HB2      SER  11  -6.952   4.062   7.789
   66    HG   SER  11           HG       SER  11  -6.788   6.352   7.549
   67    H    GLU  12           H        GLU  12  -6.274   5.031   3.747
   68    HA   GLU  12           HA       GLU  12  -8.872   5.899   2.652
   69    HB2  GLU  12           HB3      GLU  12  -5.992   6.542   1.967
   70    HB3  GLU  12           HB2      GLU  12  -7.357   7.092   0.981
   71    HG2  GLU  12           HG2      GLU  12  -8.286   8.289   2.905
   72    HG3  GLU  12           HG3      GLU  12  -6.936   7.735   3.913
   73    H    CYS  13           H        CYS  13  -6.351   3.545   2.032
   74    HA   CYS  13           HA       CYS  13  -7.153   2.986  -0.723
   75    HB2  CYS  13           HB2      CYS  13  -4.849   2.599   0.398
   76    HB3  CYS  13           HB3      CYS  13  -5.572   1.124   1.061
   77    H    CYS  14           H        CYS  14  -7.795   0.678  -1.344
   78    HA   CYS  14           HA       CYS  14 -10.297   0.050  -0.025
   79    HB2  CYS  14           HB2      CYS  14  -8.767  -1.472  -2.151
   80    HB3  CYS  14           HB3      CYS  14 -10.443  -1.777  -1.674
   81    H    GLU  15           H        GLU  15  -7.114  -0.809   0.731
   82    HA   GLU  15           HA       GLU  15  -8.017  -3.306   2.106
   83    HB2  GLU  15           HB2      GLU  15  -6.121  -3.254   0.262
   84    HB3  GLU  15           HB3      GLU  15  -5.118  -2.679   1.604
   85    HG2  GLU  15           HG2      GLU  15  -5.509  -4.683   2.855
   86    HG3  GLU  15           HG3      GLU  15  -6.757  -5.225   1.716
   87    HA   PRO  16           HA       PRO  16  -6.917  -0.311   5.474
   88    HB2  PRO  16           HB3      PRO  16  -9.491  -0.637   6.722
   89    HB3  PRO  16           HB2      PRO  16  -8.903   0.775   5.802
   90    HG2  PRO  16           HG2      PRO  16 -10.970  -0.931   5.032
   91    HG3  PRO  16           HG3      PRO  16 -10.081   0.186   3.961
   92    HD2  PRO  16           HD3      PRO  16  -9.717  -2.768   4.364
   93    HD3  PRO  16           HD2      PRO  16  -9.591  -1.799   2.861
   94    H    ASP  17           H        ASP  17  -8.228  -3.545   5.469
   95    HA   ASP  17           HA       ASP  17  -7.803  -3.988   8.347
   96    HB2  ASP  17           HB2      ASP  17  -8.706  -5.776   6.077
   97    HB3  ASP  17           HB3      ASP  17  -8.444  -6.370   7.727
   98    H    LYS  18           H        LYS  18  -6.246  -4.892   5.269
   99    HA   LYS  18           HA       LYS  18  -3.881  -5.785   6.851
  100    HB2  LYS  18           HB3      LYS  18  -5.184  -7.231   4.525
  101    HB3  LYS  18           HB2      LYS  18  -3.513  -7.532   5.033
  102    HG2  LYS  18           HG3      LYS  18  -4.301  -8.200   7.264
  103    HG3  LYS  18           HG2      LYS  18  -5.977  -7.897   6.761
  104    HD2  LYS  18           HD2      LYS  18  -5.763  -9.610   5.006
  105    HD3  LYS  18           HD3      LYS  18  -4.088  -9.921   5.509
  106    HE2  LYS  18           HE2      LYS  18  -5.387 -11.618   6.525
  107    HE3  LYS  18           HE3      LYS  18  -5.027 -10.458   7.819
  108    HZ1  LYS  18           HZ1      LYS  18  -7.321 -11.138   7.848
  109    HZ2  LYS  18           HZ2      LYS  18  -7.550 -10.612   6.302
  110    HZ3  LYS  18           HZ3      LYS  18  -7.220  -9.529   7.501
  111    H    CYS  19           H        CYS  19  -3.100  -3.666   6.457
  112    HA   CYS  19           HA       CYS  19  -2.373  -3.051   3.640
  113    HB2  CYS  19           HB3      CYS  19  -3.495  -1.316   5.068
  114    HB3  CYS  19           HB2      CYS  19  -2.068  -1.329   6.117
  115    H    ILE  20           H        ILE  20  -0.423  -3.436   2.886
  116    HA   ILE  20           HA       ILE  20   1.740  -4.151   4.802
  117    HB   ILE  20           HB       ILE  20   2.000  -4.439   1.798
  118   HG12  ILE  20          HG13      ILE  20   1.062  -6.835   3.273
  119   HG13  ILE  20          HG12      ILE  20  -0.151  -5.562   3.056
  120   HG21  ILE  20          HG21      ILE  20   3.975  -4.801   3.249
  121   HG22  ILE  20          HG22      ILE  20   3.084  -6.064   4.131
  122   HG23  ILE  20          HG23      ILE  20   3.483  -6.293   2.412
  123   HD11  ILE  20          HD11      ILE  20  -0.261  -7.207   1.248
  124   HD12  ILE  20          HD12      ILE  20   0.215  -5.608   0.629
  125   HD13  ILE  20          HD13      ILE  20   1.440  -6.882   0.837
  126    H    ILE  21           H        ILE  21   3.846  -3.284   4.601
  127    HA   ILE  21           HA       ILE  21   3.833  -0.519   3.486
  128    HB   ILE  21           HB       ILE  21   5.874  -1.582   5.476
  129   HG12  ILE  21          HG12      ILE  21   4.306  -0.070   7.058
  130   HG13  ILE  21          HG13      ILE  21   3.062  -0.707   5.969
  131   HG21  ILE  21          HG21      ILE  21   6.402   0.517   4.274
  132   HG22  ILE  21          HG22      ILE  21   4.889   1.231   4.880
  133   HG23  ILE  21          HG23      ILE  21   6.180   0.782   6.020
  134   HD11  ILE  21          HD11      ILE  21   3.290  -2.100   7.968
  135   HD12  ILE  21          HD12      ILE  21   3.772  -3.003   6.512
  136   HD13  ILE  21          HD13      ILE  21   5.015  -2.354   7.608
  137    H    MET  22           H        MET  22   4.532  -0.554   1.490
  138    HA   MET  22           HA       MET  22   5.733  -0.963  -0.409
  139    HB2  MET  22           HB2      MET  22   8.111  -0.477  -0.314
  140    HB3  MET  22           HB3      MET  22   7.176   0.669   0.652
  141    HG2  MET  22           HG2      MET  22   9.045   0.273   1.968
  142    HG3  MET  22           HG3      MET  22   7.845  -0.828   2.670
  143    HE1  MET  22           HE1      MET  22  11.191  -2.847   3.058
  144    HE2  MET  22           HE2      MET  22   9.755  -2.202   3.888
  145    HE3  MET  22           HE3      MET  22  10.970  -1.088   3.216
  146    H    LEU  23           H        LEU  23   6.330  -2.512  -1.770
  147    HA   LEU  23           HA       LEU  23   7.669  -4.916  -0.656
  148    HB2  LEU  23           HB2      LEU  23   5.700  -5.988  -0.684
  149    HB3  LEU  23           HB3      LEU  23   4.938  -4.805  -1.753
  150    HG   LEU  23           HG       LEU  23   6.521  -6.052  -3.549
  151   HD11  LEU  23          HD11      LEU  23   7.451  -7.599  -1.872
  152   HD12  LEU  23          HD12      LEU  23   5.812  -8.204  -1.529
  153   HD13  LEU  23          HD13      LEU  23   6.538  -8.460  -3.134
  154   HD21  LEU  23          HD21      LEU  23   4.086  -5.706  -3.697
  155   HD22  LEU  23          HD22      LEU  23   4.555  -7.344  -4.210
  156   HD23  LEU  23          HD23      LEU  23   3.829  -7.088  -2.605
  157    HA   PRO  24           HA       PRO  24   8.768  -4.883  -5.223
  158    HB2  PRO  24           HB2      PRO  24   7.329  -3.095  -6.943
  159    HB3  PRO  24           HB3      PRO  24   7.098  -4.858  -6.780
  160    HG2  PRO  24           HG2      PRO  24   5.262  -2.874  -6.047
  161    HG3  PRO  24           HG3      PRO  24   5.219  -4.591  -5.560
  162    HD2  PRO  24           HD2      PRO  24   6.212  -2.202  -4.033
  163    HD3  PRO  24           HD3      PRO  24   5.374  -3.675  -3.451
  164    H    THR  25           H        THR  25   9.085  -2.516  -3.268
  165    HA   THR  25           HA       THR  25  11.075  -1.045  -4.881
  166    HB   THR  25           HB       THR  25  10.226   1.160  -3.880
  167    HG1  THR  25           HG1      THR  25   8.690   0.599  -2.445
  168   HG21  THR  25          HG21      THR  25   8.585   1.526  -5.682
  169   HG22  THR  25          HG22      THR  25   8.494  -0.230  -5.955
  170   HG23  THR  25          HG23      THR  25  10.014   0.642  -6.270
  171    H    TRP  26           H        TRP  26  12.479   0.353  -3.535
  172    HA   TRP  26           HA       TRP  26  13.075  -1.038  -1.014
  173    HB2  TRP  26           HB2      TRP  26  15.069   0.697  -1.084
  174    HB3  TRP  26           HB3      TRP  26  15.073  -0.774  -2.068
  175    HD1  TRP  26           HD1      TRP  26  13.980  -0.270  -4.709
  176    HE1  TRP  26           HE1      TRP  26  14.518   1.686  -6.282
  177    HE3  TRP  26           HE3      TRP  26  15.952   2.966  -1.266
  178    HZ2  TRP  26           HZ2      TRP  26  15.704   4.227  -6.085
  179    HZ3  TRP  26           HZ3      TRP  26  16.795   5.143  -2.052
  180    HH2  TRP  26           HH2      TRP  26  16.672   5.762  -4.429
  181    HA   PRO  27           HA       PRO  27  12.448   3.390   0.842
  182    HB2  PRO  27           HB2      PRO  27  10.618   4.835  -0.996
  183    HB3  PRO  27           HB3      PRO  27  12.181   5.363  -0.309
  184    HG2  PRO  27           HG2      PRO  27  11.905   4.789  -2.916
  185    HG3  PRO  27           HG3      PRO  27  13.405   4.420  -2.015
  186    HD2  PRO  27           HD3      PRO  27  11.114   2.578  -2.715
  187    HD3  PRO  27           HD2      PRO  27  12.874   2.314  -2.925
  188    HA   PRO  28           HA       PRO  28   8.506   2.407   2.705
  189    HB2  PRO  28           HB2      PRO  28   7.888   5.276   3.284
  190    HB3  PRO  28           HB3      PRO  28   8.119   3.908   4.410
  191    HG2  PRO  28           HG2      PRO  28   9.957   5.828   4.167
  192    HG3  PRO  28           HG3      PRO  28  10.415   4.118   4.410
  193    HD2  PRO  28           HD3      PRO  28  10.390   5.741   1.869
  194    HD3  PRO  28           HD2      PRO  28  11.632   4.599   2.472
  195    H    ARG  29           H        ARG  29   6.792   1.754   1.631
  196    HA   ARG  29           HA       ARG  29   4.981   3.700   0.345
  197    HB2  ARG  29           HB2      ARG  29   6.426   1.496  -1.133
  198    HB3  ARG  29           HB3      ARG  29   4.814   2.014  -1.654
  199    HG2  ARG  29           HG3      ARG  29   5.979   3.461  -2.947
  200    HG3  ARG  29           HG2      ARG  29   6.062   4.422  -1.456
  201    HD2  ARG  29           HD2      ARG  29   8.227   3.255  -0.922
  202    HD3  ARG  29           HD3      ARG  29   8.163   2.522  -2.538
  203    HE   ARG  29           HE       ARG  29   8.297   5.473  -2.050
  204   HH11  ARG  29          HH11      ARG  29   9.191   2.613  -3.948
  205   HH12  ARG  29          HH12      ARG  29  10.164   3.536  -5.071
  206   HH21  ARG  29          HH21      ARG  29   9.560   6.622  -3.520
  207   HH22  ARG  29          HH22      ARG  29  10.371   5.793  -4.830
  208    H    TYR  30           H        TYR  30   3.314   1.750  -0.912
  209    HA   TYR  30           HA       TYR  30   2.534  -0.243   1.109
  210    HB2  TYR  30           HB3      TYR  30   0.690   2.086   0.435
  211    HB3  TYR  30           HB2      TYR  30   0.212   0.623   1.310
  212    HD1  TYR  30           HD1      TYR  30   1.182   0.184   3.597
  213    HD2  TYR  30           HD2      TYR  30   1.767   3.887   1.572
  214    HE1  TYR  30           HE1      TYR  30   1.818   1.244   5.719
  215    HE2  TYR  30           HE2      TYR  30   2.402   4.948   3.692
  216    HH   TYR  30           HH       TYR  30   1.776   3.687   6.642
  217    H    VAL  31           H        VAL  31   0.896  -1.705   0.334
  218    HA   VAL  31           HA       VAL  31   0.264  -1.443  -2.570
  219    HB   VAL  31           HB       VAL  31   1.126  -4.095  -1.347
  220   HG11  VAL  31          HG11      VAL  31  -0.347  -4.212  -3.332
  221   HG12  VAL  31          HG12      VAL  31   1.280  -4.855  -3.659
  222   HG13  VAL  31          HG13      VAL  31   0.828  -3.237  -4.246
  223   HG21  VAL  31          HG21      VAL  31   3.051  -2.545  -1.347
  224   HG22  VAL  31          HG22      VAL  31   3.260  -3.883  -2.501
  225   HG23  VAL  31          HG23      VAL  31   2.808  -2.265  -3.088
  226    H    CYS  32           H        CYS  32  -1.667  -2.215  -3.222
  227    HA   CYS  32           HA       CYS  32  -3.427  -3.474  -1.164
  228    HB2  CYS  32           HB2      CYS  32  -4.073  -1.217  -3.083
  229    HB3  CYS  32           HB3      CYS  32  -5.320  -2.176  -2.270
  230    H    SER  33           H        SER  33  -3.429  -5.520  -1.868
  231    HA   SER  33           HA       SER  33  -3.707  -6.090  -4.766
  232    HB2  SER  33           HB2      SER  33  -3.082  -7.815  -2.358
  233    HB3  SER  33           HB3      SER  33  -3.315  -8.465  -3.995
  234    HG   SER  33           HG       SER  33  -1.099  -8.038  -3.515
  235    H    VAL  34           H        VAL  34  -5.886  -5.099  -2.910
  236    HA   VAL  34           HA       VAL  34  -7.806  -7.310  -2.847
  237    HB   VAL  34           HB       VAL  34  -9.396  -5.407  -2.100
  238   HG11  VAL  34          HG11      VAL  34  -8.414  -7.114  -0.622
  239   HG12  VAL  34          HG12      VAL  34  -6.984  -6.079  -0.394
  240   HG13  VAL  34          HG13      VAL  34  -8.578  -5.537   0.186
  241   HG21  VAL  34          HG21      VAL  34  -8.016  -3.517  -2.896
  242   HG22  VAL  34          HG22      VAL  34  -8.343  -3.421  -1.149
  243   HG23  VAL  34          HG23      VAL  34  -6.750  -3.963  -1.728
  Start of MODEL   17
    1    H1   CYS   1           H1       CYS   1 -10.819   5.026  -5.591
    2    H2   CYS   1           H2       CYS   1 -11.574   3.782  -6.367
    3    H3   CYS   1           H3       CYS   1 -12.245   4.436  -5.009
    4    HA   CYS   1           HA       CYS   1 -10.448   3.668  -3.651
    5    HB2  CYS   1           HB2      CYS   1 -12.526   2.235  -4.434
    6    HB3  CYS   1           HB3      CYS   1 -11.294   1.279  -5.272
    7    H    VAL   2           H        VAL   2  -8.643   2.084  -3.514
    8    HA   VAL   2           HA       VAL   2  -6.999   2.074  -6.009
    9    HB   VAL   2           HB       VAL   2  -5.879   2.439  -3.195
   10   HG11  VAL   2          HG11      VAL   2  -4.336   1.420  -4.838
   11   HG12  VAL   2          HG12      VAL   2  -4.575   2.818  -5.913
   12   HG13  VAL   2          HG13      VAL   2  -3.799   3.037  -4.325
   13   HG21  VAL   2          HG21      VAL   2  -7.225   4.410  -3.840
   14   HG22  VAL   2          HG22      VAL   2  -6.263   4.565  -5.329
   15   HG23  VAL   2          HG23      VAL   2  -5.488   4.785  -3.742
   16    H    SER   3           H        SER   3  -7.869  -0.007  -6.384
   17    HA   SER   3           HA       SER   3  -7.799  -2.208  -4.613
   18    HB2  SER   3           HB3      SER   3  -7.560  -2.182  -7.641
   19    HB3  SER   3           HB2      SER   3  -7.939  -3.606  -6.648
   20    HG   SER   3           HG       SER   3  -9.829  -2.571  -7.474
   21    H    SER   4           H        SER   4  -5.338  -1.224  -7.047
   22    HA   SER   4           HA       SER   4  -3.294  -2.665  -5.445
   23    HB2  SER   4           HB3      SER   4  -4.094  -4.204  -7.279
   24    HB3  SER   4           HB2      SER   4  -3.509  -3.008  -8.455
   25    HG   SER   4           HG       SER   4  -1.951  -4.649  -8.009
   26    H    GLY   5           H        GLY   5  -1.245  -1.835  -5.561
   27    HA2  GLY   5           HA2      GLY   5   0.258  -0.382  -7.047
   28    HA3  GLY   5           HA3      GLY   5  -1.058   0.806  -6.944
   29    H    ILE   6           H        ILE   6   0.343   2.334  -6.011
   30    HA   ILE   6           HA       ILE   6   1.315   1.675  -3.275
   31    HB   ILE   6           HB       ILE   6   2.032   4.013  -5.093
   32   HG12  ILE   6          HG13      ILE   6   3.081   2.075  -5.978
   33   HG13  ILE   6          HG12      ILE   6   4.320   2.959  -5.080
   34   HG21  ILE   6          HG21      ILE   6   3.898   4.345  -3.333
   35   HG22  ILE   6          HG22      ILE   6   2.864   3.376  -2.256
   36   HG23  ILE   6          HG23      ILE   6   2.257   4.907  -2.932
   37   HD11  ILE   6          HD11      ILE   6   4.510   0.529  -4.749
   38   HD12  ILE   6          HD12      ILE   6   2.864   0.492  -4.073
   39   HD13  ILE   6          HD13      ILE   6   4.156   1.373  -3.222
   40    H    VAL   7           H        VAL   7   0.834   2.916  -1.515
   41    HA   VAL   7           HA       VAL   7  -1.188   5.052  -1.832
   42    HB   VAL   7           HB       VAL   7  -2.515   4.116   0.108
   43   HG11  VAL   7          HG11      VAL   7  -2.730   3.675  -2.614
   44   HG12  VAL   7          HG12      VAL   7  -2.938   2.052  -1.913
   45   HG13  VAL   7          HG13      VAL   7  -3.994   3.388  -1.394
   46   HG21  VAL   7          HG21      VAL   7  -0.861   2.467   0.928
   47   HG22  VAL   7          HG22      VAL   7  -2.440   1.723   0.581
   48   HG23  VAL   7          HG23      VAL   7  -1.089   1.516  -0.559
   49    H    ASP   8           H        ASP   8  -1.107   6.643  -0.356
   50    HA   ASP   8           HA       ASP   8   1.207   6.598   1.494
   51    HB2  ASP   8           HB2      ASP   8  -0.657   8.798   0.544
   52    HB3  ASP   8           HB3      ASP   8   0.577   9.045   1.794
   53    H    ALA   9           H        ALA   9  -1.691   5.358   1.653
   54    HA   ALA   9           HA       ALA   9  -2.006   5.823   4.550
   55    HB1  ALA   9           HB1      ALA   9  -3.442   7.503   3.201
   56    HB2  ALA   9           HB2      ALA   9  -4.442   6.092   2.778
   57    HB3  ALA   9           HB3      ALA   9  -4.240   6.561   4.483
   58    H    CYS  10           H        CYS  10  -4.568   4.551   4.729
   59    HA   CYS  10           HA       CYS  10  -4.338   1.888   3.497
   60    HB2  CYS  10           HB3      CYS  10  -2.866   1.634   5.444
   61    HB3  CYS  10           HB2      CYS  10  -4.128   2.280   6.505
   62    H    SER  11           H        SER  11  -5.922   4.110   5.771
   63    HA   SER  11           HA       SER  11  -8.471   2.698   5.766
   64    HB2  SER  11           HB2      SER  11  -7.759   5.520   6.642
   65    HB3  SER  11           HB3      SER  11  -9.298   4.693   6.968
   66    HG   SER  11           HG       SER  11  -7.811   4.532   8.726
   67    H    GLU  12           H        GLU  12  -6.903   5.057   3.766
   68    HA   GLU  12           HA       GLU  12  -9.397   5.944   2.463
   69    HB2  GLU  12           HB2      GLU  12  -6.469   6.595   2.054
   70    HB3  GLU  12           HB3      GLU  12  -7.733   7.173   0.955
   71    HG2  GLU  12           HG2      GLU  12  -8.829   8.328   2.832
   72    HG3  GLU  12           HG3      GLU  12  -7.561   7.749   3.930
   73    H    CYS  13           H        CYS  13  -6.812   3.628   2.032
   74    HA   CYS  13           HA       CYS  13  -7.387   3.090  -0.790
   75    HB2  CYS  13           HB2      CYS  13  -5.136   2.805   0.347
   76    HB3  CYS  13           HB3      CYS  13  -5.809   1.385   1.166
   77    H    CYS  14           H        CYS  14  -7.797   0.677  -1.416
   78    HA   CYS  14           HA       CYS  14 -10.402  -0.058  -0.458
   79    HB2  CYS  14           HB2      CYS  14  -8.422  -1.754  -2.002
   80    HB3  CYS  14           HB3      CYS  14 -10.162  -2.041  -1.862
   81    H    GLU  15           H        GLU  15  -7.199  -0.868   0.613
   82    HA   GLU  15           HA       GLU  15  -8.237  -3.083   2.315
   83    HB2  GLU  15           HB2      GLU  15  -5.438  -2.279   1.467
   84    HB3  GLU  15           HB3      GLU  15  -5.748  -3.479   2.733
   85    HG2  GLU  15           HG3      GLU  15  -6.929  -3.763  -0.034
   86    HG3  GLU  15           HG2      GLU  15  -5.277  -4.295   0.329
   87    HA   PRO  16           HA       PRO  16  -7.981   0.391   5.350
   88    HB2  PRO  16           HB3      PRO  16 -10.065  -1.085   6.833
   89    HB3  PRO  16           HB2      PRO  16 -10.131   0.556   6.134
   90    HG2  PRO  16           HG2      PRO  16 -11.553  -1.526   5.146
   91    HG3  PRO  16           HG3      PRO  16 -10.937  -0.197   4.124
   92    HD2  PRO  16           HD2      PRO  16  -9.819  -2.971   4.514
   93    HD3  PRO  16           HD3      PRO  16 -10.001  -2.009   3.013
   94    H    ASP  17           H        ASP  17  -8.203  -3.105   6.015
   95    HA   ASP  17           HA       ASP  17  -6.308  -2.717   8.297
   96    HB2  ASP  17           HB2      ASP  17  -8.705  -4.560   8.114
   97    HB3  ASP  17           HB3      ASP  17  -7.417  -4.765   9.317
   98    H    LYS  18           H        LYS  18  -7.244  -4.517   5.456
   99    HA   LYS  18           HA       LYS  18  -5.155  -6.567   5.912
  100    HB2  LYS  18           HB2      LYS  18  -7.350  -6.219   3.861
  101    HB3  LYS  18           HB3      LYS  18  -6.078  -7.438   3.674
  102    HG2  LYS  18           HG2      LYS  18  -6.745  -8.455   5.816
  103    HG3  LYS  18           HG3      LYS  18  -8.020  -7.232   5.999
  104    HD2  LYS  18           HD3      LYS  18  -9.071  -8.029   3.908
  105    HD3  LYS  18           HD2      LYS  18  -7.799  -9.257   3.744
  106    HE2  LYS  18           HE2      LYS  18  -9.595  -9.069   6.174
  107    HE3  LYS  18           HE3      LYS  18 -10.008 -10.040   4.747
  108    HZ1  LYS  18           HZ1      LYS  18  -8.923 -11.352   6.429
  109    HZ2  LYS  18           HZ2      LYS  18  -7.596 -10.372   6.410
  110    HZ3  LYS  18           HZ3      LYS  18  -7.973 -11.275   5.083
  111    H    CYS  19           H        CYS  19  -4.556  -3.653   5.356
  112    HA   CYS  19           HA       CYS  19  -3.315  -3.698   2.687
  113    HB2  CYS  19           HB2      CYS  19  -2.682  -1.417   3.130
  114    HB3  CYS  19           HB3      CYS  19  -4.380  -1.641   3.575
  115    H    ILE  20           H        ILE  20  -1.071  -3.427   2.284
  116    HA   ILE  20           HA       ILE  20   0.609  -4.678   4.401
  117    HB   ILE  20           HB       ILE  20   1.488  -4.285   1.521
  118   HG12  ILE  20          HG12      ILE  20   0.794  -6.886   1.508
  119   HG13  ILE  20          HG13      ILE  20  -0.463  -6.273   2.595
  120   HG21  ILE  20          HG21      ILE  20   3.188  -4.922   3.205
  121   HG22  ILE  20          HG22      ILE  20   2.227  -6.364   3.612
  122   HG23  ILE  20          HG23      ILE  20   2.938  -6.197   1.988
  123   HD11  ILE  20          HD11      ILE  20  -0.910  -6.393   0.030
  124   HD12  ILE  20          HD12      ILE  20  -1.431  -4.956   0.942
  125   HD13  ILE  20          HD13      ILE  20   0.060  -4.902  -0.030
  126    H    ILE  21           H        ILE  21   2.717  -3.871   4.827
  127    HA   ILE  21           HA       ILE  21   2.775  -0.929   4.854
  128    HB   ILE  21           HB       ILE  21   5.047  -2.569   5.969
  129   HG12  ILE  21          HG12      ILE  21   3.453  -2.484   8.147
  130   HG13  ILE  21          HG13      ILE  21   2.219  -2.725   6.898
  131   HG21  ILE  21          HG21      ILE  21   4.327  -0.756   7.875
  132   HG22  ILE  21          HG22      ILE  21   5.495  -0.434   6.571
  133   HG23  ILE  21          HG23      ILE  21   3.800   0.082   6.396
  134   HD11  ILE  21          HD11      ILE  21   2.957  -4.858   7.839
  135   HD12  ILE  21          HD12      ILE  21   3.406  -4.738   6.122
  136   HD13  ILE  21          HD13      ILE  21   4.637  -4.491   7.383
  137    H    MET  22           H        MET  22   4.952   0.151   4.508
  138    HA   MET  22           HA       MET  22   5.688   0.055   1.795
  139    HB2  MET  22           HB2      MET  22   7.205   1.099   4.205
  140    HB3  MET  22           HB3      MET  22   7.680   1.411   2.528
  141    HG2  MET  22           HG3      MET  22   5.486   2.522   2.153
  142    HG3  MET  22           HG2      MET  22   5.092   2.258   3.862
  143    HE1  MET  22           HE1      MET  22   6.034   6.176   3.059
  144    HE2  MET  22           HE2      MET  22   5.574   5.010   1.796
  145    HE3  MET  22           HE3      MET  22   4.655   5.080   3.319
  146    H    LEU  23           H        LEU  23   6.665  -1.472   0.667
  147    HA   LEU  23           HA       LEU  23   9.125  -2.701   1.724
  148    HB2  LEU  23           HB2      LEU  23   7.867  -4.414   2.528
  149    HB3  LEU  23           HB3      LEU  23   6.551  -4.157   1.380
  150    HG   LEU  23           HG       LEU  23   8.292  -5.137  -0.356
  151   HD11  LEU  23          HD11      LEU  23  10.171  -5.220   1.240
  152   HD12  LEU  23          HD12      LEU  23   9.757  -6.835   0.618
  153   HD13  LEU  23          HD13      LEU  23   9.250  -6.355   2.255
  154   HD21  LEU  23          HD21      LEU  23   6.115  -6.119   0.248
  155   HD22  LEU  23          HD22      LEU  23   6.862  -6.883   1.671
  156   HD23  LEU  23          HD23      LEU  23   7.369  -7.364   0.034
  157    HA   PRO  24           HA       PRO  24   8.745  -3.849  -3.026
  158    HB2  PRO  24           HB3      PRO  24   6.666  -1.890  -3.946
  159    HB3  PRO  24           HB2      PRO  24   6.942  -3.580  -4.459
  160    HG2  PRO  24           HG3      PRO  24   4.897  -2.949  -2.895
  161    HG3  PRO  24           HG2      PRO  24   5.830  -4.446  -2.610
  162    HD2  PRO  24           HD2      PRO  24   5.968  -1.799  -1.159
  163    HD3  PRO  24           HD3      PRO  24   5.975  -3.464  -0.499
  164    H    THR  25           H        THR  25   9.425  -2.642  -5.050
  165    HA   THR  25           HA       THR  25  10.925  -1.211  -6.029
  166    HB   THR  25           HB       THR  25  10.498   1.253  -5.810
  167    HG1  THR  25           HG1      THR  25   8.729   1.912  -4.551
  168   HG21  THR  25          HG21      THR  25   8.263   1.203  -6.846
  169   HG22  THR  25          HG22      THR  25   8.050  -0.477  -6.299
  170   HG23  THR  25          HG23      THR  25   9.313  -0.082  -7.489
  171    H    TRP  26           H        TRP  26  12.495   0.782  -5.634
  172    HA   TRP  26           HA       TRP  26  14.341  -0.082  -3.616
  173    HB2  TRP  26           HB2      TRP  26  15.242   2.433  -4.238
  174    HB3  TRP  26           HB3      TRP  26  15.666   0.943  -5.093
  175    HD1  TRP  26           HD1      TRP  26  13.760   0.405  -7.242
  176    HE1  TRP  26           HE1      TRP  26  12.900   2.067  -9.004
  177    HE3  TRP  26           HE3      TRP  26  14.917   4.758  -4.819
  178    HZ2  TRP  26           HZ2      TRP  26  12.811   4.858  -9.336
  179    HZ3  TRP  26           HZ3      TRP  26  14.435   6.895  -5.943
  180    HH2  TRP  26           HH2      TRP  26  13.393   6.942  -8.172
  181    HA   PRO  27           HA       PRO  27  13.007   3.586  -0.905
  182    HB2  PRO  27           HB2      PRO  27  10.699   5.032  -1.859
  183    HB3  PRO  27           HB3      PRO  27  12.395   5.589  -1.834
  184    HG2  PRO  27           HG3      PRO  27  10.891   5.078  -4.115
  185    HG3  PRO  27           HG2      PRO  27  12.672   5.179  -4.043
  186    HD2  PRO  27           HD2      PRO  27  10.892   2.752  -4.072
  187    HD3  PRO  27           HD3      PRO  27  12.486   3.018  -4.847
  188    HA   PRO  28           HA       PRO  28   9.592   1.536   1.164
  189    HB2  PRO  28           HB2      PRO  28   9.014   3.791   2.968
  190    HB3  PRO  28           HB3      PRO  28   9.825   2.242   3.331
  191    HG2  PRO  28           HG3      PRO  28  11.107   4.639   3.326
  192    HG3  PRO  28           HG2      PRO  28  11.911   3.092   2.940
  193    HD2  PRO  28           HD3      PRO  28  10.870   5.225   1.080
  194    HD3  PRO  28           HD2      PRO  28  12.405   4.303   1.000
  195    H    ARG  29           H        ARG  29   7.687   1.207   0.183
  196    HA   ARG  29           HA       ARG  29   5.684   3.402   0.125
  197    HB2  ARG  29           HB2      ARG  29   6.603   1.820  -2.294
  198    HB3  ARG  29           HB3      ARG  29   5.076   2.717  -2.245
  199    HG2  ARG  29           HG3      ARG  29   6.271   4.814  -1.933
  200    HG3  ARG  29           HG2      ARG  29   7.817   3.948  -1.817
  201    HD2  ARG  29           HD2      ARG  29   7.432   3.093  -4.144
  202    HD3  ARG  29           HD3      ARG  29   6.009   4.151  -4.244
  203    HE   ARG  29           HE       ARG  29   8.278   5.692  -3.456
  204   HH11  ARG  29          HH11      ARG  29   6.989   4.017  -6.303
  205   HH12  ARG  29          HH12      ARG  29   7.808   5.078  -7.427
  206   HH21  ARG  29          HH21      ARG  29   9.315   7.038  -4.940
  207   HH22  ARG  29          HH22      ARG  29   9.118   6.779  -6.658
  208    H    TYR  30           H        TYR  30   3.659   2.767   0.553
  209    HA   TYR  30           HA       TYR  30   3.127   0.073   1.480
  210    HB2  TYR  30           HB2      TYR  30   1.456   2.552   1.048
  211    HB3  TYR  30           HB3      TYR  30   0.705   1.019   1.516
  212    HD1  TYR  30           HD1      TYR  30   1.035   0.113   3.754
  213    HD2  TYR  30           HD2      TYR  30   2.865   3.787   2.619
  214    HE1  TYR  30           HE1      TYR  30   1.484   0.614   6.114
  215    HE2  TYR  30           HE2      TYR  30   3.325   4.287   4.980
  216    HH   TYR  30           HH       TYR  30   3.631   2.854   7.142
  217    H    VAL  31           H        VAL  31   1.239  -1.243   0.746
  218    HA   VAL  31           HA       VAL  31   0.537  -0.935  -2.114
  219    HB   VAL  31           HB       VAL  31   0.924  -3.737  -1.728
  220   HG11  VAL  31          HG11      VAL  31   0.858  -2.501  -3.859
  221   HG12  VAL  31          HG12      VAL  31   2.438  -1.778  -3.474
  222   HG13  VAL  31          HG13      VAL  31   2.300  -3.535  -3.720
  223   HG21  VAL  31          HG21      VAL  31   3.357  -3.906  -1.499
  224   HG22  VAL  31          HG22      VAL  31   3.457  -2.156  -1.190
  225   HG23  VAL  31          HG23      VAL  31   2.618  -3.218  -0.033
  226    H    CYS  32           H        CYS  32  -1.365  -1.934  -2.740
  227    HA   CYS  32           HA       CYS  32  -3.015  -3.015  -0.490
  228    HB2  CYS  32           HB2      CYS  32  -3.732  -1.125  -2.734
  229    HB3  CYS  32           HB3      CYS  32  -4.968  -2.067  -1.885
  230    H    SER  33           H        SER  33  -3.828  -4.975  -0.759
  231    HA   SER  33           HA       SER  33  -3.606  -6.230  -3.456
  232    HB2  SER  33           HB2      SER  33  -2.403  -7.224  -1.470
  233    HB3  SER  33           HB3      SER  33  -3.995  -7.600  -0.778
  234    HG   SER  33           HG       SER  33  -3.110  -9.360  -1.978
  235    H    VAL  34           H        VAL  34  -5.770  -4.488  -2.170
  236    HA   VAL  34           HA       VAL  34  -8.027  -4.283  -2.039
  237    HB   VAL  34           HB       VAL  34  -7.625  -4.468  -4.508
  238   HG11  VAL  34          HG11      VAL  34  -8.859  -6.520  -5.560
  239   HG12  VAL  34          HG12      VAL  34  -7.141  -6.634  -5.106
  240   HG13  VAL  34          HG13      VAL  34  -8.391  -7.328  -4.045
  241   HG21  VAL  34          HG21      VAL  34  -9.748  -3.689  -3.525
  242   HG22  VAL  34          HG22      VAL  34  -9.964  -4.483  -5.103
  243   HG23  VAL  34          HG23      VAL  34 -10.375  -5.353  -3.605