*HEADER    MEMBRANE PROTEIN                        12-JUN-06   2HAC              
*TITLE     STRUCTURE OF ZETA-ZETA TRANSMEMBRANE DIMER                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: T-CELL SURFACE GLYCOPROTEIN CD3 ZETA CHAIN;                
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: TRANSMEMBRANE REGION (28-60);                              
*COMPND   5 SYNONYM: T-CELL RECEPTOR T3 ZETA CHAIN;                              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: CD3Z, T3Z, TCRZ;                                               
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID                               
*KEYWDS    TRANSMEMBRANE, ALPHA HELIX                                            
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    J.J.CHOU, K.W.WUCHERPFENNIG, J.R.SCHNELL, M.E.CALL                    
*REVDAT   1   31-OCT-06 2HAC    0                                                


!NOTE: Residue numbers are +3 relative to PDB and publication numbering.
!15N-NOE-80ms:
assign (segid AN1 and resid 4 and name HN )(segid AN1 and resid 3 and name HB# ) 4.10 0.55 0.55 
assign (segid AN1 and resid 4 and name HN )(segid AN1 and resid 3 and name HA )  3.25 0.55 0.55 
assign (segid AN2 and resid 4 and name HN )(segid AN2 and resid 3 and name HB# ) 4.10 0.55 0.55
assign (segid AN2 and resid 4 and name HN )(segid AN2 and resid 3 and name HA )  3.25 0.55 0.55
assign (segid AN1 and resid 5 and name HN )(segid AN1 and resid 3 and name HA )  4.10 0.55 0.55 
assign (segid AN1 and resid 5 and name HN )(segid AN1 and resid 4 and name HD## ) 4.25 0.55 0.55 
assign (segid AN1 and resid 5 and name HN )(segid AN1 and resid 5 and name HB1 ) 2.60 0.55 0.55 
assign (segid AN1 and resid 5 and name HN )(segid AN1 and resid 5 and name HB2 ) 2.60 0.55 0.55 
assign (segid AN2 and resid 5 and name HN )(segid AN2 and resid 3 and name HA )  4.10 0.55 0.55
assign (segid AN2 and resid 5 and name HN )(segid AN2 and resid 4 and name HD## ) 4.25 0.55 0.55
assign (segid AN2 and resid 5 and name HN )(segid AN2 and resid 5 and name HB1 ) 2.60 0.55 0.55
assign (segid AN2 and resid 5 and name HN )(segid AN2 and resid 5 and name HB2 ) 2.60 0.55 0.55
assign (segid AN1 and resid 6 and name HN )(segid AN1 and resid 6 and name HD# ) 3.70 0.55 0.55 
assign (segid AN1 and resid 6 and name HN )(segid AN1 and resid 3 and name HA )  3.80 0.55 0.55 
assign (segid AN1 and resid 6 and name HN )(segid AN1 and resid 5 and name HA )  3.35 0.55 0.55 
assign (segid AN1 and resid 6 and name HN )(segid AN1 and resid 6 and name HA )  3.25 0.55 0.55 
assign (segid AN2 and resid 6 and name HN )(segid AN2 and resid 6 and name HD# ) 3.70 0.55 0.55
assign (segid AN2 and resid 6 and name HN )(segid AN2 and resid 3 and name HA )  3.80 0.55 0.55
assign (segid AN2 and resid 6 and name HN )(segid AN2 and resid 5 and name HA )  3.35 0.55 0.55
assign (segid AN2 and resid 6 and name HN )(segid AN2 and resid 6 and name HA )  3.25 0.55 0.55
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 7 and name HA )  3.05 0.55 0.55 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 6 and name HD# ) 4.65 0.55 0.55 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 6 and name HA )  3.95 0.55 0.55 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 4 and name HA )  3.40 0.55 0.55 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 6 and name HB# ) 3.80 1.10 1.10 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 7 and name HD## ) 3.95 0.55 0.55 
assign (segid AN1 and resid 7 and name HN )(segid AN1 and resid 8 and name HD## ) 4.60 1.10 1.10 
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 7 and name HA )  3.05 0.55 0.55
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 6 and name HD# ) 4.65 0.55 0.55
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 6 and name HA )  3.95 0.55 0.55
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 4 and name HA )  3.40 0.55 0.55
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 6 and name HB# ) 3.80 1.10 1.10
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 7 and name HD## ) 3.95 0.55 0.55
assign (segid AN2 and resid 7 and name HN )(segid AN2 and resid 8 and name HD## ) 4.60 1.10 1.10
assign (segid AN1 and resid 8 and name HN )(segid AN1 and resid 7 and name HD## ) 4.05 1.00 1.00 
assign (segid AN1 and resid 8 and name HN )(segid AN1 and resid 8 and name HD## ) 3.45 1.00 1.00 
assign (segid AN1 and resid 8 and name HN )(segid AN1 and resid 5 and name HA  ) 3.40 0.55 0.55
assign (segid AN2 and resid 8 and name HN )(segid AN2 and resid 7 and name HD## ) 4.05 1.00 1.00
assign (segid AN2 and resid 8 and name HN )(segid AN2 and resid 8 and name HD## ) 3.45 1.00 1.00
assign (segid AN2 and resid 8 and name HN )(segid AN2 and resid 5 and name HA  ) 3.40 0.55 0.55
assign (segid AN1 and resid 9 and name HN )(segid AN1 and resid 6 and name HA )  3.60 0.55 0.55 
assign (segid AN1 and resid 9 and name HN )(segid AN1 and resid 8 and name HA )  3.55 0.55 0.55 
assign (segid AN1 and resid 9 and name HN )(segid AN1 and resid 8 and name HB# ) 3.25 0.75 0.55 
assign (segid AN1 and resid 9 and name HN )(segid AN1 and resid 7 and name HD## ) 5.65 1.00 1.00 
assign (segid AN2 and resid 9 and name HN )(segid AN2 and resid 6 and name HA )  3.60 0.55 0.55
assign (segid AN2 and resid 9 and name HN )(segid AN2 and resid 8 and name HA )  3.55 0.55 0.55
assign (segid AN2 and resid 9 and name HN )(segid AN2 and resid 8 and name HB# ) 3.25 0.75 0.55
assign (segid AN2 and resid 9 and name HN )(segid AN2 and resid 7 and name HD## ) 5.65 1.00 1.00
assign (segid AN1 and resid 10 and name HN )(segid AN1 and resid 6 and name HA )  4.30 0.55 0.55 
assign (segid AN1 and resid 10 and name HN )(segid AN1 and resid 9 and name HA )  3.80 0.55 0.55 
assign (segid AN1 and resid 10 and name HN )(segid AN1 and resid 7 and name HA )  3.55 0.55 0.55 
assign (segid AN1 and resid 10 and name HN )(segid AN1 and resid 9 and name HB# ) 3.35 0.75 0.75 
assign (segid AN1 and resid 10 and name HN )(segid AN1 and resid 8 and name HD1# ) 5.10 0.75 0.75 
assign (segid AN2 and resid 10 and name HN )(segid AN2 and resid 6 and name HA )  4.30 0.55 0.55
assign (segid AN2 and resid 10 and name HN )(segid AN2 and resid 9 and name HA )  3.80 0.55 0.55
assign (segid AN2 and resid 10 and name HN )(segid AN2 and resid 7 and name HA )  3.55 0.55 0.55
assign (segid AN2 and resid 10 and name HN )(segid AN2 and resid 9 and name HB# ) 3.35 0.75 0.75
0ssign (segid AN2 and resid 10 and name HN )(segid AN2 and resid 8 and name HD1# ) 5.10 0.75 0.75
assign (segid AN1 and resid 11 and name HN )(segid AN1 and resid 9 and name HA )  4.15 0.55 0.55
assign (segid AN1 and resid 11 and name HN )(segid AN1 and resid 7 and name HA )  3.70 0.55 0.55
assign (segid AN1 and resid 11 and name HN )(segid AN1 and resid 8 and name HA )  3.30 0.55 0.55
assign (segid AN2 and resid 11 and name HN )(segid AN2 and resid 9 and name HA )  4.15 0.55 0.55
assign (segid AN2 and resid 11 and name HN )(segid AN2 and resid 7 and name HA )  3.70 0.55 0.55
assign (segid AN2 and resid 11 and name HN )(segid AN2 and resid 8 and name HA )  3.30 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 9 and name HA )  3.45 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 8 and name HA )  3.55 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 11 and name HA )  3.45 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 13 and name HB# ) 4.10 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 11 and name HG1# ) 3.80 0.55 0.55
assign (segid AN1 and resid 12 and name HN )(segid AN1 and resid 12 and name HD1# ) 3.60 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 9 and name HA )  3.45 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 8 and name HA )  3.55 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 11 and name HA )  3.45 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 13 and name HB# ) 4.10 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 11 and name HG1# ) 3.80 0.55 0.55
assign (segid AN2 and resid 12 and name HN )(segid AN2 and resid 12 and name HD1# ) 3.60 0.55 0.55
assign (segid AN1 and resid 13 and name HN )(segid AN1 and resid 13 and name HD# )  3.80 0.55 1.00
assign (segid AN1 and resid 13 and name HN )(segid AN1 and resid 11 and name HA )  4.00 0.55 0.55
assign (segid AN1 and resid 13 and name HN )(segid AN1 and resid 10 and name HA# )  3.50 0.55 0.55
assign (segid AN1 and resid 13 and name HN )(segid AN1 and resid 12 and name HD1# ) 4.40 0.55 0.55
assign (segid AN2 and resid 13 and name HN )(segid AN2 and resid 13 and name HD# )  3.80 0.55 1.00
assign (segid AN2 and resid 13 and name HN )(segid AN2 and resid 11 and name HA )  4.00 0.55 0.55
assign (segid AN2 and resid 13 and name HN )(segid AN2 and resid 10 and name HA# )  3.50 0.55 0.55
assign (segid AN2 and resid 13 and name HN )(segid AN2 and resid 12 and name HD1# ) 4.40 0.55 0.55
assign (segid AN1 and resid 14 and name HN )(segid AN1 and resid 13 and name HD# ) 4.30 1.10 0.55
assign (segid AN1 and resid 14 and name HN )(segid AN1 and resid 13 and name HE# ) 4.85 0.55 1.10
assign (segid AN1 and resid 14 and name HN )(segid AN1 and resid 13 and name HA )  3.65 0.55 0.55
assign (segid AN1 and resid 14 and name HN )(segid AN1 and resid 11 and name HA )  3.40 0.55 0.55
assign (segid AN1 and resid 14 and name HN )(segid AN1 and resid 14 and name HG1# ) 2.55 0.55 0.55
assign (segid AN2 and resid 14 and name HN )(segid AN2 and resid 13 and name HD# ) 4.30 1.10 0.55
assign (segid AN2 and resid 14 and name HN )(segid AN2 and resid 13 and name HE# ) 4.85 0.55 1.10
assign (segid AN2 and resid 14 and name HN )(segid AN2 and resid 13 and name HA )  3.65 0.55 0.55
assign (segid AN2 and resid 14 and name HN )(segid AN2 and resid 11 and name HA )  3.40 0.55 0.55
assign (segid AN2 and resid 14 and name HN )(segid AN2 and resid 14 and name HG1# ) 2.55 0.55 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 15 and name HD# ) 3.95 0.55 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 15 and name HE# ) 5.60 0.55 1.10
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 13 and name HA )  4.50 0.55 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 12 and name HA )  3.35 0.55 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 14 and name HA )  3.50 0.55 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 15 and name HB# ) 3.05 1.00 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 14 and name HB )  3.10 1.00 0.55
assign (segid AN1 and resid 15 and name HN )(segid AN1 and resid 14 and name HG1# ) 3.55 0.55 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 15 and name HD# ) 3.95 0.55 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 15 and name HE# ) 5.60 0.55 1.10
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 13 and name HA )  4.50 0.55 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 12 and name HA )  3.35 0.55 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 14 and name HA )  3.50 0.55 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 15 and name HB# ) 3.05 1.00 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 14 and name HB )  3.10 1.00 0.55
assign (segid AN2 and resid 15 and name HN )(segid AN2 and resid 14 and name HG1# ) 3.55 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 13 and name HD# ) 4.65 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 15 and name HD# ) 3.85 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 13 and name HA )  3.50 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 12 and name HA )  3.80 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 15 and name HA )  2.90 0.55 1.10
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 14 and name HA )  3.80 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 12 and name HB# ) 4.40 0.55 0.55
assign (segid AN1 and resid 16 and name HN )(segid AN1 and resid 17 and name HG2# ) 4.35 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 13 and name HD# ) 4.65 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 15 and name HD# ) 3.85 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 13 and name HA )  3.50 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 12 and name HA )  3.80 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 15 and name HA )  2.90 0.55 1.10
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 14 and name HA )  3.80 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 12 and name HB# ) 4.40 0.55 0.55
assign (segid AN2 and resid 16 and name HN )(segid AN2 and resid 17 and name HG2# ) 4.35 0.55 0.55
assign (segid AN1 and resid 17 and name HN )(segid AN1 and resid 16 and name HA# ) 3.70 1.00 0.50
assign (segid AN1 and resid 17 and name HN )(segid AN1 and resid 14 and name HA ) 3.40 0.55 0.55
assign (segid AN2 and resid 17 and name HN )(segid AN2 and resid 16 and name HA# ) 3.70 1.00 0.50
assign (segid AN2 and resid 17 and name HN )(segid AN2 and resid 14 and name HA ) 3.40 0.55 0.55
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 15 and name HA )  3.75 0.55 0.55
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 17 and name HB )  2.90 0.55 0.55
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 14 and name HG2# ) 3.75 0.55 0.55
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 19 and name HD1# ) 5.60 1.00 1.00
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 17 and name HG2# ) 4.20 0.55 0.55
assign (segid AN1 and resid 18 and name HN )(segid AN1 and resid 19 and name HD2# ) 5.60 0.55 0.55
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 15 and name HA )  3.75 0.55 0.55
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 17 and name HB )  2.90 0.55 0.55
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 14 and name HG2# ) 3.75 0.55 0.55
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 19 and name HD1# ) 5.60 1.00 1.00
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 17 and name HG2# ) 4.20 0.55 0.55
assign (segid AN2 and resid 18 and name HN )(segid AN2 and resid 19 and name HD2# ) 5.60 0.55 0.55
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 15 and name HE# ) 4.90 1.00 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 16 and name HA# ) 3.60 0.55 0.55
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 18 and name HA )  3.40 1.00 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 17 and name HG2# ) 4.60 1.00 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 19 and name HD2# ) 3.80 1.00 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 19 and name HD1# ) 4.50 1.00 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN1 and resid 22 and name HD1# ) 4.20 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 15 and name HE# ) 4.90 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 16 and name HA# ) 3.60 0.55 0.55
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 18 and name HA )  3.40 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 17 and name HG2# ) 4.60 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 19 and name HD2# ) 3.80 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 19 and name HD1# ) 4.50 1.00 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN2 and resid 22 and name HD1# ) 4.20 1.00 1.00
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 20 and name HB )  3.15 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 20 and name HA )  3.35 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 19 and name HA )  3.90 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 17 and name HA )  3.45 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 21 and name HB# ) 3.95 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 17 and name HG2# ) 4.85 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 17 and name HG1# ) 5.25 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 19 and name HD1# ) 4.50 1.00 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 19 and name HD2# ) 4.60 0.55 0.55
assign (segid AN1 and resid 20 and name HN )(segid AN1 and resid 22 and name HD1# ) 5.35 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 20 and name HB )  3.15 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 20 and name HA )  3.35 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 19 and name HA )  3.90 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 17 and name HA )  3.45 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 21 and name HB# ) 3.95 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 17 and name HG2# ) 4.85 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 17 and name HG1# ) 5.25 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 19 and name HD1# ) 4.50 1.00 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 19 and name HD2# ) 4.60 0.55 0.55
assign (segid AN2 and resid 20 and name HN )(segid AN2 and resid 22 and name HD1# ) 5.35 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 20 and name HB )  3.35 0.75 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 20 and name HA )  3.80 0.75 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 18 and name HA )  3.50 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 17 and name HA )  3.75 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 22 and name HB# ) 4.35 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 20 and name HG2# ) 4.10 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 17 and name HG1# ) 4.60 0.55 0.55
assign (segid AN1 and resid 21 and name HN )(segid AN1 and resid 22 and name HD1# ) 5.65 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 20 and name HB )  3.35 0.75 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 20 and name HA )  3.80 0.75 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 18 and name HA )  3.50 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 17 and name HA )  3.75 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 22 and name HB# ) 4.35 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 20 and name HG2# ) 4.10 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 17 and name HG1# ) 4.60 0.55 0.55
assign (segid AN2 and resid 21 and name HN )(segid AN2 and resid 22 and name HD1# ) 5.65 0.55 0.55
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 20 and name HA ) 4.65 0.55 0.55
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 19 and name HA )  3.50 0.55 0.55
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 18 and name HA )  4.30 0.55 0.55
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 21 and name HB# ) 3.60 1.10 0.55
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 22 and name HD2# ) 3.85 1.00 1.00
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 22 and name HD1# ) 4.00 1.00 1.00
assign (segid AN1 and resid 22 and name HN )(segid AN1 and resid 19 and name HD1# ) 5.20 1.00 1.00
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 20 and name HA ) 4.65 0.55 0.55
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 19 and name HA )  3.50 0.55 0.55
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 18 and name HA )  4.30 0.55 0.55
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 21 and name HB# ) 3.60 1.10 0.55
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 22 and name HD2# ) 3.85 1.00 1.00
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 22 and name HD1# ) 4.00 1.00 1.00
assign (segid AN2 and resid 22 and name HN )(segid AN2 and resid 19 and name HD1# ) 5.20 1.00 1.00
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 20 and name HA  ) 3.45 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 20 and name HB  ) 4.95 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 19 and name HA  ) 4.10 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 26 and name HG2# ) 5.00 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 22 and name HD2# ) 4.90 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 22 and name HD1# ) 4.50 0.55 0.55
assign (segid AN1 and resid 23 and name HN )(segid AN1 and resid 19 and name HD1# ) 4.10 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 20 and name HA  ) 3.45 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 20 and name HB  ) 4.95 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 19 and name HA  ) 4.10 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 26 and name HG2# ) 5.00 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 22 and name HD2# ) 4.90 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 22 and name HD1# ) 4.50 0.55 0.55
assign (segid AN2 and resid 23 and name HN )(segid AN2 and resid 19 and name HD1# ) 4.10 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 23 and name HA  ) 3.75 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 21 and name HA  ) 3.70 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 22 and name HA  ) 4.20 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 23 and name HB# ) 3.55 1.10 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 24 and name HB# ) 2.95 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 26 and name HG2# ) 5.05 0.55 0.55
assign (segid AN1 and resid 24 and name HN )(segid AN1 and resid 24 and name HD## ) 3.35 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 23 and name HA  ) 3.75 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 21 and name HA  ) 3.70 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 22 and name HA  ) 4.20 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 23 and name HB# ) 3.55 1.10 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 24 and name HB# ) 2.95 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 26 and name HG2# ) 5.05 0.55 0.55
assign (segid AN2 and resid 24 and name HN )(segid AN2 and resid 24 and name HD## ) 3.35 0.55 0.55
assign (segid AN1 and resid 25 and name HN )(segid AN1 and resid 23 and name HA  ) 4.60 0.55 0.55
assign (segid AN1 and resid 25 and name HN )(segid AN1 and resid 22 and name HA  ) 3.30 0.55 0.55
assign (segid AN1 and resid 25 and name HN )(segid AN1 and resid 24 and name HA  ) 3.60 0.55 0.55
assign (segid AN1 and resid 25 and name HN )(segid AN1 and resid 26 and name HG2# ) 4.75 0.55 0.55
assign (segid AN1 and resid 25 and name HN )(segid AN1 and resid 22 and name HD2# ) 5.30 0.55 0.55
assign (segid AN2 and resid 25 and name HN )(segid AN2 and resid 23 and name HA  ) 4.60 0.55 0.55
assign (segid AN2 and resid 25 and name HN )(segid AN2 and resid 22 and name HA  ) 3.30 0.55 0.55
assign (segid AN2 and resid 25 and name HN )(segid AN2 and resid 24 and name HA  ) 3.60 0.55 0.55
assign (segid AN2 and resid 25 and name HN )(segid AN2 and resid 26 and name HG2# ) 4.75 0.55 0.55
assign (segid AN2 and resid 25 and name HN )(segid AN2 and resid 22 and name HD2# ) 5.30 0.55 0.55
assign (segid AN1 and resid 26 and name HN )(segid AN1 and resid 23 and name HA  ) 3.65 0.55 0.55
assign (segid AN1 and resid 26 and name HN )(segid AN1 and resid 25 and name HA  ) 3.30 0.55 0.55
assign (segid AN1 and resid 26 and name HN )(segid AN1 and resid 25 and name HG# ) 4.30 0.55 0.55
assign (segid AN1 and resid 26 and name HN )(segid AN1 and resid 26 and name HG2# ) 3.30 1.10 0.55
assign (segid AN1 and resid 26 and name HN )(segid AN1 and resid 26 and name HG1# ) 3.50 1.10 0.55
assign (segid AN2 and resid 26 and name HN )(segid AN2 and resid 23 and name HA  ) 3.65 0.55 0.55
assign (segid AN2 and resid 26 and name HN )(segid AN2 and resid 25 and name HA  ) 3.30 0.55 0.55
assign (segid AN2 and resid 26 and name HN )(segid AN2 and resid 25 and name HG# ) 4.30 0.55 0.55
assign (segid AN2 and resid 26 and name HN )(segid AN2 and resid 26 and name HG2# ) 3.30 1.10 0.55
assign (segid AN2 and resid 26 and name HN )(segid AN2 and resid 26 and name HG1# ) 3.50 1.10 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 23 and name HA  ) 4.55 0.55 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 25 and name HA  ) 4.25 0.55 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 24 and name HA  ) 3.40 0.55 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 26 and name HB  ) 3.20 0.55 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 26 and name HG2# ) 4.20 0.55 0.55
assign (segid AN1 and resid 27 and name HN )(segid AN1 and resid 26 and name HG1# ) 3.85 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 23 and name HA  ) 4.55 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 25 and name HA  ) 4.25 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 24 and name HA  ) 3.40 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 26 and name HB  ) 3.20 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 26 and name HG2# ) 4.20 0.55 0.55
assign (segid AN2 and resid 27 and name HN )(segid AN2 and resid 26 and name HG1# ) 3.85 0.55 0.55
assign (segid AN1 and resid 28 and name HN )(segid AN1 and resid 29 and name HA  ) 4.15 1.10 1.10
assign (segid AN1 and resid 28 and name HN )(segid AN1 and resid 25 and name HA  ) 3.70 0.55 0.55
assign (segid AN1 and resid 28 and name HN )(segid AN1 and resid 24 and name HB# ) 4.85 0.55 0.55
assign (segid AN2 and resid 28 and name HN )(segid AN2 and resid 29 and name HA  ) 4.15 1.10 1.10
assign (segid AN2 and resid 28 and name HN )(segid AN2 and resid 25 and name HA  ) 3.70 0.55 0.55
assign (segid AN2 and resid 28 and name HN )(segid AN2 and resid 24 and name HB# ) 4.85 0.55 0.55
!13C-NOE-150ms:
assign (segid AN1 and resid  8 and name HD1# )(segid AN1 and resid  7 and name HD1# ) 4.10 1.00 1.00
assign (segid AN1 and resid  8 and name HD1# )(segid AN1 and resid  9 and name HA )  5.00 1.00 1.00
assign (segid AN1 and resid  8 and name HD1# )(segid AN1 and resid  9 and name HB# ) 5.25 1.00 1.00
assign (segid AN1 and resid  8 and name HD1# )(segid AN1 and resid 12 and name HN )  5.10 1.00 1.00
assign (segid AN1 and resid  8 and name HD2# )(segid AN1 and resid  9 and name HA )  5.10 1.00 1.00
assign (segid AN1 and resid  8 and name HD2# )(segid AN1 and resid  9 and name HB# ) 5.10 1.00 1.00
assign (segid AN1 and resid  8 and name HD2# )(segid AN1 and resid 12 and name HN )  5.30 1.00 1.00
assign (segid AN2 and resid  8 and name HD1# )(segid AN2 and resid  7 and name HD1# ) 4.10 1.00 1.00
assign (segid AN2 and resid  8 and name HD1# )(segid AN2 and resid  9 and name HA )  5.00 1.00 1.00
assign (segid AN2 and resid  8 and name HD1# )(segid AN2 and resid  9 and name HB# ) 5.25 1.00 1.00
assign (segid AN2 and resid  8 and name HD1# )(segid AN2 and resid 12 and name HN )  5.10 1.00 1.00
assign (segid AN2 and resid  8 and name HD2# )(segid AN2 and resid  9 and name HA )  5.10 1.00 1.00
assign (segid AN2 and resid  8 and name HD2# )(segid AN2 and resid  9 and name HB# ) 5.10 1.00 1.00
assign (segid AN2 and resid  8 and name HD2# )(segid AN2 and resid 12 and name HN )  5.30 1.00 1.00
assign (segid AN1 and resid 11 and name HG2# )(segid AN1 and resid  8 and name HA ) 4.10 1.00 1.00
assign (segid AN1 and resid 11 and name HG2# )(segid AN1 and resid 12 and name HA ) 4.35 1.00 1.00
assign (segid AN1 and resid 11 and name HD1# )(segid AN1 and resid  8 and name HA ) 4.00 1.00 1.00
assign (segid AN2 and resid 11 and name HG2# )(segid AN2 and resid  8 and name HA ) 4.10 1.00 1.00
assign (segid AN2 and resid 11 and name HG2# )(segid AN2 and resid 12 and name HA ) 4.35 1.00 1.00
assign (segid AN2 and resid 11 and name HD1# )(segid AN2 and resid  8 and name HA ) 4.00 1.00 1.00
assign (segid AN1 and resid 12 and name HD2# )(segid AN2 and resid 13 and name HA )  2.80 1.00 1.00
assign (segid AN2 and resid 12 and name HD2# )(segid AN1 and resid 13 and name HA )  2.80 1.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 19 and name HN ) 5.20 1.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 18 and name HD1# ) 3.45 2.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 17 and name HG2# ) 5.20 1.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 15 and name HB# ) 4.90 1.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 13 and name HD# ) 5.35 1.00 1.00
assign (segid AN1 and resid 14 and name HG2# )(segid AN1 and resid 13 and name HE# ) 5.35 1.00 1.00
assign (segid AN1 and resid 14 and name HD1# )(segid AN1 and resid 17 and name HG2# ) 5.40 1.00 1.00
assign (segid AN1 and resid 14 and name HD1# )(segid AN1 and resid 11 and name HN ) 4.95 1.00 1.00
assign (segid AN1 and resid 14 and name HD1# )(segid AN1 and resid 11 and name HA ) 3.85 1.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 19 and name HN )  5.20 1.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 18 and name HD1# ) 3.45 2.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 17 and name HG2# ) 5.20 1.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 15 and name HB# ) 4.90 1.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 13 and name HD# ) 5.35 1.00 1.00
assign (segid AN2 and resid 14 and name HG2# )(segid AN2 and resid 13 and name HE# ) 5.35 1.00 1.00
assign (segid AN2 and resid 14 and name HD1# )(segid AN2 and resid 17 and name HG2# ) 5.40 1.00 1.00
assign (segid AN2 and resid 14 and name HD1# )(segid AN2 and resid 11 and name HN )  4.95 1.00 1.00
assign (segid AN2 and resid 14 and name HD1# )(segid AN2 and resid 11 and name HA ) 3.85 1.00 1.00
assign (segid AN1 and resid 17 and name HG1# )(segid AN1 and resid 20 and name HG2# ) 4.95 1.00 1.00
assign (segid AN1 and resid 17 and name HG1# )(segid AN1 and resid 21 and name HB# )  4.60 1.50 1.00
assign (segid AN1 and resid 17 and name HG1# )(segid AN1 and resid 16 and name HA# )  4.80 1.00 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 20 and name HG2# ) 4.85 1.00 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 21 and name HB# )  5.10 1.00 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 16 and name HA# )  4.40 1.00 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 13 and name HZ )   3.85 1.50 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 13 and name HD# )  4.25 1.50 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 13 and name HE# )  4.20 1.50 1.00
assign (segid AN1 and resid 17 and name HG2# )(segid AN1 and resid 20 and name HN )   4.50 1.00 1.00
assign (segid AN2 and resid 17 and name HG1# )(segid AN2 and resid 20 and name HG2# ) 4.95 1.00 1.00
assign (segid AN2 and resid 17 and name HG1# )(segid AN2 and resid 21 and name HB# )  4.60 1.50 1.00
assign (segid AN2 and resid 17 and name HG1# )(segid AN2 and resid 16 and name HA# )  4.80 1.00 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 20 and name HG2# ) 4.85 1.00 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 21 and name HB# )  5.10 1.00 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 16 and name HA# )  4.40 1.00 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 13 and name HZ )   3.85 1.50 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 13 and name HD# )  4.25 1.50 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 13 and name HE# )  4.20 1.50 1.00
assign (segid AN2 and resid 17 and name HG2# )(segid AN2 and resid 20 and name HN )   4.50 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 21 and name HB# )  4.40 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 20 and name HN )   4.45 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 19 and name HA )   4.15 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 19 and name HD2# ) 4.60 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 17 and name HN )   5.10 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 15 and name HA )   4.15 1.00 1.00
assign (segid AN1 and resid 18 and name HG2# )(segid AN1 and resid 15 and name HN )   5.50 1.00 1.00
assign (segid AN1 and resid 18 and name HD1# )(segid AN1 and resid 21 and name HB# )  5.20 1.00 1.00
assign (segid AN1 and resid 18 and name HD1# )(segid AN1 and resid 19 and name HD2# ) 5.80 1.00 1.00
assign (segid AN1 and resid 18 and name HD1# )(segid AN1 and resid 17 and name HN )   4.95 1.00 1.00
assign (segid AN1 and resid 18 and name HD1# )(segid AN1 and resid 15 and name HA )   4.15 1.10 1.00
assign (segid AN1 and resid 18 and name HD1# )(segid AN1 and resid 15 and name HN )   4.85 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 21 and name HB# )  4.40 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 20 and name HN )   4.45 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 19 and name HA )   4.15 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 19 and name HD2# ) 4.60 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 17 and name HN )   5.10 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 15 and name HA )   4.15 1.00 1.00
assign (segid AN2 and resid 18 and name HG2# )(segid AN2 and resid 15 and name HN )   5.50 1.00 1.00
assign (segid AN2 and resid 18 and name HD1# )(segid AN2 and resid 21 and name HB# )  5.20 1.00 1.00
assign (segid AN2 and resid 18 and name HD1# )(segid AN2 and resid 19 and name HD2# ) 5.80 1.00 1.00
assign (segid AN2 and resid 18 and name HD1# )(segid AN2 and resid 17 and name HN )   4.95 1.00 1.00
assign (segid AN2 and resid 18 and name HD1# )(segid AN2 and resid 15 and name HA )   4.15 1.10 1.00
assign (segid AN2 and resid 18 and name HD1# )(segid AN2 and resid 15 and name HN )   4.85 1.00 1.00
assign (segid AN1 and resid 19 and name HD1# )(segid AN1 and resid 23 and name HB# ) 3.95 1.00 1.00
assign (segid AN1 and resid 19 and name HD1# )(segid AN1 and resid 22 and name HD1# ) 4.05 1.00 1.00
assign (segid AN1 and resid 19 and name HD1# )(segid AN1 and resid 22 and name HB# ) 3.85 1.00 1.00
assign (segid AN1 and resid 19 and name HD1# )(segid AN1 and resid 18 and name HG2# ) 4.05 1.00 1.00
assign (segid AN1 and resid 19 and name HD1# )(segid AN1 and resid 15 and name HE# ) 4.80 1.00 1.00
assign (segid AN2 and resid 19 and name HD1# )(segid AN2 and resid 23 and name HB# ) 3.95 1.00 1.00
assign (segid AN2 and resid 19 and name HD1# )(segid AN2 and resid 22 and name HD1# ) 4.05 1.00 1.00
assign (segid AN2 and resid 19 and name HD1# )(segid AN2 and resid 22 and name HB# ) 3.85 1.00 1.00
assign (segid AN2 and resid 19 and name HD1# )(segid AN2 and resid 18 and name HG2# ) 4.05 1.00 1.00
assign (segid AN2 and resid 19 and name HD1# )(segid AN2 and resid 15 and name HE# ) 4.80 1.00 1.00
assign (segid AN1 and resid 20 and name HG2# )(segid AN1 and resid 24 and name HD## )  3.25 1.00 1.00
assign (segid AN1 and resid 20 and name HG2# )(segid AN1 and resid 17 and name HG1# )  5.30 1.00 1.00
assign (segid AN2 and resid 20 and name HG2# )(segid AN2 and resid 24 and name HD## )  3.25 1.00 1.00
assign (segid AN2 and resid 20 and name HG2# )(segid AN2 and resid 17 and name HG1# )  5.30 1.00 1.00
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 20 and name HB )    4.00 1.00 1.00
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 18 and name HA )    3.50 1.00 1.00
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 25 and name HD# )   5.25 2.00 1.50
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 22 and name HB# )   4.10 1.00 1.00
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 20 and name HG2# )  4.30 1.00 1.00
assign (segid AN1 and resid 21 and name HB# )(segid AN1 and resid 24 and name HD1# )  4.15 1.00 1.00
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 20 and name HB )    4.00 1.00 1.00
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 18 and name HA )    3.50 1.00 1.00
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 25 and name HD# )   5.25 2.00 1.50
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 22 and name HB# )   4.10 1.00 1.00
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 20 and name HG2# )  4.30 1.00 1.00
assign (segid AN2 and resid 21 and name HB# )(segid AN2 and resid 24 and name HD1# )  4.15 1.00 1.00
assign (segid AN1 and resid 22 and name HD1# )(segid AN1 and resid 19 and name HA )   3.20 1.00 1.00
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 26 and name HN )   5.65 1.00 1.00
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 19 and name HA )   4.60 1.00 1.00
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 18 and name HA )   5.25 1.00 1.00
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 25 and name HD# )  5.15 2.00 1.50
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 25 and name HB# )  5.35 2.00 1.50
assign (segid AN1 and resid 22 and name HD2# )(segid AN1 and resid 21 and name HB# )  4.50 1.00 1.00
assign (segid AN2 and resid 22 and name HD1# )(segid AN2 and resid 19 and name HA )   3.20 1.00 1.00
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 26 and name HN )   5.65 1.00 1.00
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 19 and name HA )   4.60 1.00 1.00
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 18 and name HA )   5.25 1.00 1.00
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 25 and name HD# )  5.15 2.00 1.50
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 25 and name HB# )  5.35 2.00 1.50
assign (segid AN2 and resid 22 and name HD2# )(segid AN2 and resid 21 and name HB# )  4.50 1.00 1.00
assign (segid AN1 and resid 24 and name HD1# )(segid AN1 and resid 23 and name HA )   5.70 1.00 1.00
assign (segid AN1 and resid 24 and name HD1# )(segid AN1 and resid 20 and name HG2# ) 4.25 2.00 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 28 and name HZ )   3.80 1.00 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 28 and name HE# )  3.80 1.00 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 28 and name HD# )  4.00 1.00 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 23 and name HZ )   4.25 1.00 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 23 and name HE# )  3.35 1.50 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 23 and name HD# )  3.60 1.50 1.00
assign (segid AN1 and resid 24 and name HD2# )(segid AN1 and resid 23 and name HA )   4.35 1.00 1.50
assign (segid AN2 and resid 24 and name HD1# )(segid AN2 and resid 23 and name HA )   5.70 1.00 1.00
assign (segid AN2 and resid 24 and name HD1# )(segid AN2 and resid 20 and name HG2# ) 4.25 2.00 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 28 and name HZ )   3.80 1.00 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 28 and name HE# )  3.80 1.00 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 28 and name HD# )  4.00 1.00 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 23 and name HZ )   4.25 1.00 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 23 and name HE# )  3.35 1.50 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 23 and name HD# )  3.60 1.50 1.00
assign (segid AN2 and resid 24 and name HD2# )(segid AN2 and resid 23 and name HA )   4.35 1.00 1.50
assign (segid AN1 and resid 26 and name HG1# )(segid AN1 and resid 28 and name HA )   6.10 1.00 1.00
assign (segid AN1 and resid 26 and name HG1# )(segid AN1 and resid 23 and name HA )   4.50 1.00 1.00
assign (segid AN1 and resid 26 and name HG1# )(segid AN1 and resid 25 and name HD# )  5.00 2.00 1.50
assign (segid AN1 and resid 26 and name HG2# )(segid AN1 and resid 23 and name HA )   4.10 1.00 1.00
assign (segid AN1 and resid 26 and name HG2# )(segid AN1 and resid 25 and name HD# )  5.00 2.00 1.50
assign (segid AN1 and resid 26 and name HG2# )(segid AN1 and resid 22 and name HD2# ) 5.15 1.00 1.00
assign (segid AN2 and resid 26 and name HG1# )(segid AN2 and resid 28 and name HA )   6.10 1.00 1.00
assign (segid AN2 and resid 26 and name HG1# )(segid AN2 and resid 23 and name HA )   4.50 1.00 1.00
assign (segid AN2 and resid 26 and name HG1# )(segid AN2 and resid 25 and name HD# )  5.00 2.00 1.50
assign (segid AN2 and resid 26 and name HG2# )(segid AN2 and resid 23 and name HA )   4.10 1.00 1.00
assign (segid AN2 and resid 26 and name HG2# )(segid AN2 and resid 25 and name HD# )  5.00 2.00 1.50
assign (segid AN2 and resid 26 and name HG2# )(segid AN2 and resid 22 and name HD2# ) 5.15 1.00 1.00
!15N-NOE-200ms on mixed-label dimer:
assign (segid AN1 and resid 12 and name HN )(segid AN2 and resid 12 and name HD1# ) 4.50 0.75 0.75
assign (segid AN1 and resid 12 and name HN )(segid AN2 and resid 12 and name HD2# ) 5.15 0.75 0.75
assign (segid AN2 and resid 12 and name HN )(segid AN1 and resid 12 and name HD1# ) 4.50 0.75 0.75
assign (segid AN2 and resid 12 and name HN )(segid AN1 and resid 12 and name HD2# ) 5.15 0.75 0.75
assign (segid AN1 and resid 13 and name HN )(segid AN2 and resid 12 and name HD1# ) 4.00 0.75 0.75
assign (segid AN1 and resid 13 and name HN )(segid AN2 and resid 12 and name HD2# ) 4.35 0.75 0.75
assign (segid AN2 and resid 13 and name HN )(segid AN1 and resid 12 and name HD1# ) 4.00 0.75 0.75
assign (segid AN2 and resid 13 and name HN )(segid AN1 and resid 12 and name HD2# ) 4.35 0.75 0.75
assign (segid AN1 and resid 14 and name HN )(segid AN2 and resid 12 and name HD1# ) 4.85 0.75 0.75
assign (segid AN1 and resid 14 and name HN )(segid AN2 and resid 12 and name HD2# ) 5.15 0.75 0.75
assign (segid AN2 and resid 14 and name HN )(segid AN1 and resid 12 and name HD1# ) 4.85 0.75 0.75
assign (segid AN2 and resid 14 and name HN )(segid AN1 and resid 12 and name HD2# ) 5.15 0.75 0.75
assign (segid AN1 and resid 15 and name HN )(segid AN2 and resid 12 and name HD2# ) 5.60 0.75 0.75
assign (segid AN2 and resid 15 and name HN )(segid AN1 and resid 12 and name HD2# ) 5.60 0.75 0.75
assign (segid AN1 and resid 19 and name HN )(segid AN2 and resid 19 and name HD1# ) 5.35 0.75 1.00
assign (segid AN1 and resid 19 and name HN )(segid AN2 and resid 19 and name HG ) 4.40 0.75 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN1 and resid 19 and name HD1# ) 5.35 0.75 1.00
assign (segid AN2 and resid 19 and name HN )(segid AN1 and resid 19 and name HG ) 4.40 0.75 1.00
assign (segid AN1 and resid 20 and name HN )(segid AN2 and resid 19 and name HD1# ) 4.65 1.10 0.75
assign (segid AN1 and resid 20 and name HN )(segid AN2 and resid 19 and name HD2# ) 4.05 1.10 0.75
assign (segid AN1 and resid 20 and name HN )(segid AN2 and resid 19 and name HG ) 3.70 0.75 0.75
assign (segid AN2 and resid 20 and name HN )(segid AN1 and resid 19 and name HD1# ) 4.65 1.10 0.75
assign (segid AN2 and resid 20 and name HN )(segid AN1 and resid 19 and name HD2# ) 4.05 1.10 0.75
assign (segid AN2 and resid 20 and name HN )(segid AN1 and resid 19 and name HG ) 3.70 0.75 0.75
assign (segid AN1 and resid 23 and name HN )(segid AN2 and resid 19 and name HD1# ) 4.45 0.75 0.75
assign (segid AN2 and resid 23 and name HN )(segid AN1 and resid 19 and name HD1# ) 4.45 0.75 0.75
assign (segid AN1 and resid 24 and name HN )(segid AN2 and resid 19 and name HD1# ) 5.45 0.75 0.75
assign (segid AN2 and resid 24 and name HN )(segid AN1 and resid 19 and name HD1# ) 5.45 0.75 0.75
assign (segid AN1 and resid 23 and name HN )(segid AN2 and resid 23 and name HD# ) 4.00 0.75 0.75
assign (segid AN1 and resid 23 and name HN )(segid AN2 and resid 23 and name HE# ) 4.05 0.75 0.75
assign (segid AN2 and resid 23 and name HN )(segid AN1 and resid 23 and name HD# ) 4.00 0.75 0.75
assign (segid AN2 and resid 23 and name HN )(segid AN1 and resid 23 and name HE# ) 4.05 0.75 0.75
assign (segid AN1 and resid 22 and name HN )(segid AN2 and resid 23 and name HD# ) 4.55 0.75 1.20
assign (segid AN1 and resid 22 and name HN )(segid AN2 and resid 23 and name HE# ) 4.65 0.75 1.00
assign (segid AN2 and resid 22 and name HN )(segid AN1 and resid 23 and name HD# ) 4.55 0.75 1.20
assign (segid AN2 and resid 22 and name HN )(segid AN1 and resid 23 and name HE# ) 4.65 0.75 1.00
assign (segid AN1 and resid 26 and name HN )(segid AN2 and resid 23 and name HE# ) 5.15 0.75 0.75
assign (segid AN2 and resid 26 and name HN )(segid AN1 and resid 23 and name HE# ) 5.15 0.75 0.75
assign (segid AN1 and resid 27 and name HN )(segid AN2 and resid 26 and name HG1# ) 5.50 0.75 0.75
assign (segid AN1 and resid 27 and name HN )(segid AN2 and resid 26 and name HG2# ) 5.70 0.75 0.75
assign (segid AN2 and resid 27 and name HN )(segid AN1 and resid 26 and name HG1# ) 5.50 0.75 0.75
assign (segid AN2 and resid 27 and name HN )(segid AN1 and resid 26 and name HG2# ) 5.70 0.75 0.75
assign (segid AN1 and resid 19 and name HN )(segid AN2 and resid 15 and name HE# ) 4.40 0.75 0.90
assign (segid AN1 and resid 20 and name HN )(segid AN2 and resid 15 and name HE# ) 3.35 0.75 0.75
assign (segid AN2 and resid 19 and name HN )(segid AN1 and resid 15 and name HE# ) 4.40 0.75 0.90
assign (segid AN2 and resid 20 and name HN )(segid AN1 and resid 15 and name HE# ) 3.35 0.75 0.75
!CHI1 & CHI2
assign (segid AN1 and resid 20 and name  N )
       (segid AN1 and resid 20 and name  CA)
       (segid AN1 and resid 20 and name  CB)
       (segid AN1 and resid 20 and name  CG2)  1.00  180  30.00  2
assign (segid AN2 and resid 20 and name  N )
       (segid AN2 and resid 20 and name  CA)
       (segid AN2 and resid 20 and name  CB)
       (segid AN2 and resid 20 and name  CG2)  1.00  180  30.00  2
assign (segid AN1 and resid  4 and name  N )
       (segid AN1 and resid  4 and name  CA)
       (segid AN1 and resid  4 and name  CB)
       (segid AN1 and resid  4 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid  7 and name  N )
       (segid AN1 and resid  7 and name  CA)
       (segid AN1 and resid  7 and name  CB)
       (segid AN1 and resid  7 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid  8 and name  N )
       (segid AN1 and resid  8 and name  CA)
       (segid AN1 and resid  8 and name  CB)
       (segid AN1 and resid  8 and name  CG)  1.00  -70  30.00  2
assign (segid AN1 and resid 22 and name  N )
       (segid AN1 and resid 22 and name  CA)
       (segid AN1 and resid 22 and name  CB)
       (segid AN1 and resid 22 and name  CG)  1.00  -60  30.00  2
assign (segid AN1 and resid 24 and name  N )
       (segid AN1 and resid 24 and name  CA)
       (segid AN1 and resid 24 and name  CB)
       (segid AN1 and resid 24 and name  CG)  1.00  -60  30.00  2
assign (segid AN1 and resid 25 and name  N )
       (segid AN1 and resid 25 and name  CA)
       (segid AN1 and resid 25 and name  CB)
       (segid AN1 and resid 25 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid  4 and name  N )
       (segid AN2 and resid  4 and name  CA)
       (segid AN2 and resid  4 and name  CB)
       (segid AN2 and resid  4 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid  7 and name  N )
       (segid AN2 and resid  7 and name  CA)
       (segid AN2 and resid  7 and name  CB)
       (segid AN2 and resid  7 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid  8 and name  N )
       (segid AN2 and resid  8 and name  CA)
       (segid AN2 and resid  8 and name  CB)
       (segid AN2 and resid  8 and name  CG)  1.00  -70  30.00  2
assign (segid AN2 and resid 22 and name  N )
       (segid AN2 and resid 22 and name  CA)
       (segid AN2 and resid 22 and name  CB)
       (segid AN2 and resid 22 and name  CG)  1.00  -60  30.00  2
assign (segid AN2 and resid 24 and name  N )
       (segid AN2 and resid 24 and name  CA)
       (segid AN2 and resid 24 and name  CB)
       (segid AN2 and resid 24 and name  CG)  1.00  -60  30.00  2
assign (segid AN2 and resid 25 and name  N )
       (segid AN2 and resid 25 and name  CA)
       (segid AN2 and resid 25 and name  CB)
       (segid AN2 and resid 25 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid  17 and name  N )
       (segid AN1 and resid  17 and name  CA)
       (segid AN1 and resid  17 and name  CB)
       (segid AN1 and resid  17 and name  CG1)  1.00  180  30.00  2
assign (segid AN1 and resid  26 and name  N )
       (segid AN1 and resid  26 and name  CA)
       (segid AN1 and resid  26 and name  CB)
       (segid AN1 and resid  26 and name  CG1)  1.00  180  30.00  2
assign (segid AN2 and resid  17 and name  N )
       (segid AN2 and resid  17 and name  CA)
       (segid AN2 and resid  17 and name  CB)
       (segid AN2 and resid  17 and name  CG1)  1.00  180  30.00  2
assign (segid AN2 and resid  26 and name  N )
       (segid AN2 and resid  26 and name  CA)
       (segid AN2 and resid  26 and name  CB)
       (segid AN2 and resid  26 and name  CG1)  1.00  180  30.00  2
assign (segid AN1 and resid 13 and name  N )
       (segid AN1 and resid 13 and name  CA)
       (segid AN1 and resid 13 and name  CB)
       (segid AN1 and resid 13 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid 15 and name  N )
       (segid AN1 and resid 15 and name  CA)
       (segid AN1 and resid 15 and name  CB)
       (segid AN1 and resid 15 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid 23 and name  N )
       (segid AN1 and resid 23 and name  CA)
       (segid AN1 and resid 23 and name  CB)
       (segid AN1 and resid 23 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid 13 and name  N )
       (segid AN2 and resid 13 and name  CA)
       (segid AN2 and resid 13 and name  CB)
       (segid AN2 and resid 13 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid 15 and name  N )
       (segid AN2 and resid 15 and name  CA)
       (segid AN2 and resid 15 and name  CB)
       (segid AN2 and resid 15 and name  CG)  1.00  180  30.00  2
assign (segid AN2 and resid 23 and name  N )
       (segid AN2 and resid 23 and name  CA)
       (segid AN2 and resid 23 and name  CB)
       (segid AN2 and resid 23 and name  CG)  1.00  180  30.00  2
assign (segid AN1 and resid 11 and name  N )
       (segid AN1 and resid 11 and name  CA)
       (segid AN1 and resid 11 and name  CB)
       (segid AN1 and resid 11 and name  CG1)  1.00  -60  30.00  2
assign (segid AN1 and resid 14 and name  N )
       (segid AN1 and resid 14 and name  CA)
       (segid AN1 and resid 14 and name  CB)
       (segid AN1 and resid 14 and name  CG1)  1.00  -60  30.00  2
assign (segid AN1 and resid 18 and name  N )
       (segid AN1 and resid 18 and name  CA)
       (segid AN1 and resid 18 and name  CB)
       (segid AN1 and resid 18 and name  CG1)  1.00  -60  30.00  2
assign (segid AN2 and resid 11 and name  N )
       (segid AN2 and resid 11 and name  CA)
       (segid AN2 and resid 11 and name  CB)
       (segid AN2 and resid 11 and name  CG1)  1.00  -60  30.00  2
assign (segid AN2 and resid 14 and name  N )
       (segid AN2 and resid 14 and name  CA)
       (segid AN2 and resid 14 and name  CB)
       (segid AN2 and resid 14 and name  CG1)  1.00  -60  30.00  2
assign (segid AN2 and resid 18 and name  N )
       (segid AN2 and resid 18 and name  CA)
       (segid AN2 and resid 18 and name  CB)
       (segid AN2 and resid 18 and name  CG1)  1.00  -60  30.00  2
assign (segid AN1 and resid 11 and name  CA)
       (segid AN1 and resid 11 and name  CB)
       (segid AN1 and resid 11 and name  CG1)
       (segid AN1 and resid 11 and name  CD1)  1.00  180  30.00  2
assign (segid AN2 and resid 11 and name  CA)
       (segid AN2 and resid 11 and name  CB)
       (segid AN2 and resid 11 and name  CG1)
       (segid AN2 and resid 11 and name  CD1)  1.00  180  30.00  2
assign (segid AN1 and resid 12 and name  CA)
       (segid AN1 and resid 12 and name  CB)
       (segid AN1 and resid 12 and name  CG)
       (segid AN1 and resid 12 and name  CD1)  1.00  180  30.00  2
assign (segid AN2 and resid 12 and name  CA)
       (segid AN2 and resid 12 and name  CB)
       (segid AN2 and resid 12 and name  CG)
       (segid AN2 and resid 12 and name  CD1)  1.00  180  30.00  2
assign (segid AN1 and resid 18 and name  CA)
       (segid AN1 and resid 18 and name  CB)
       (segid AN1 and resid 18 and name  CG1)
       (segid AN1 and resid 18 and name  CD1)  1.00  180  30.00  2
assign (segid AN2 and resid 18 and name  CA)
       (segid AN2 and resid 18 and name  CB)
       (segid AN2 and resid 18 and name  CG1)
       (segid AN2 and resid 18 and name  CD1)  1.00  180  30.00  2
assign (segid AN1 and resid 22 and name  CA)
       (segid AN1 and resid 22 and name  CB)
       (segid AN1 and resid 22 and name  CG)
       (segid AN1 and resid 22 and name  CD1)  1.00  180  30.00  2
assign (segid AN2 and resid 22 and name  CA)
       (segid AN2 and resid 22 and name  CB)
       (segid AN2 and resid 22 and name  CG)
       (segid AN2 and resid 22 and name  CD1)  1.00  180  30.00  2
assign (segid AN1 and resid 24 and name  CA)
       (segid AN1 and resid 24 and name  CB)
       (segid AN1 and resid 24 and name  CG)
       (segid AN1 and resid 24 and name  CD1)  1.00  180  30.00  2
assign (segid AN2 and resid 24 and name  CA)
       (segid AN2 and resid 24 and name  CB)
       (segid AN2 and resid 24 and name  CG)
       (segid AN2 and resid 24 and name  CD1)  1.00  180  30.00  2
assign (segid AN1 and resid  9 and name  N )
       (segid AN1 and resid  9 and name  CA)
       (segid AN1 and resid  9 and name  CB)
       (segid AN1 and resid  9 and name  CG)  1.00  -60  30.00  2
assign (segid AN2 and resid  9 and name  N )
       (segid AN2 and resid  9 and name  CA)
       (segid AN2 and resid  9 and name  CB)
       (segid AN2 and resid  9 and name  CG)  1.00  -60  30.00  2
!RDC: HN
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     5 and name    N and segid AN1)
       ( resid     5 and name   HN and segid AN1)   30.336  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     6 and name    N and segid AN1)
       ( resid     6 and name   HN and segid AN1)   30.000  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     7 and name    N and segid AN1)
       ( resid     7 and name   HN and segid AN1)   24.456  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     9 and name    N and segid AN1)
       ( resid     9 and name   HN and segid AN1)   33.440  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    10 and name    N and segid AN1)
       ( resid    10 and name   HN and segid AN1)   30.416  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    11 and name    N and segid AN1)
       ( resid    11 and name   HN and segid AN1)   28.120  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    12 and name    N and segid AN1)
       ( resid    12 and name   HN and segid AN1)   29.848  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    13 and name    N and segid AN1)
       ( resid    13 and name   HN and segid AN1)   30.776  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    14 and name    N and segid AN1)
       ( resid    14 and name   HN and segid AN1)   28.352  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    15 and name    N and segid AN1)
       ( resid    15 and name   HN and segid AN1)   30.872  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    16 and name    N and segid AN1)
       ( resid    16 and name   HN and segid AN1)   36.784  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    17 and name    N and segid AN1)
       ( resid    17 and name   HN and segid AN1)   27.552  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    18 and name    N and segid AN1)
       ( resid    18 and name   HN and segid AN1)   29.232  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    20 and name    N and segid AN1)
       ( resid    20 and name   HN and segid AN1)   29.592  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    21 and name    N and segid AN1)
       ( resid    21 and name   HN and segid AN1)   26.896  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    22 and name    N and segid AN1)
       ( resid    22 and name   HN and segid AN1)   30.872  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    23 and name    N and segid AN1)
       ( resid    23 and name   HN and segid AN1)   34.840  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    24 and name    N and segid AN1)
       ( resid    24 and name   HN and segid AN1)   30.280  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    25 and name    N and segid AN1)
       ( resid    25 and name   HN and segid AN1)   27.712  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    26 and name    N and segid AN1)
       ( resid    26 and name   HN and segid AN1)   26.928  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    27 and name    N and segid AN1)
       ( resid    27 and name   HN and segid AN1)   30.360  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     5 and name    N and segid AN2)
       ( resid     5 and name   HN and segid AN2)   30.336  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     6 and name    N and segid AN2)
       ( resid     6 and name   HN and segid AN2)   30.000  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     7 and name    N and segid AN2)
       ( resid     7 and name   HN and segid AN2)   24.456  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     9 and name    N and segid AN2)
       ( resid     9 and name   HN and segid AN2)   33.440  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    10 and name    N and segid AN2)
       ( resid    10 and name   HN and segid AN2)   30.416  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    11 and name    N and segid AN2)
       ( resid    11 and name   HN and segid AN2)   28.120  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    12 and name    N and segid AN2)
       ( resid    12 and name   HN and segid AN2)   29.848  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    13 and name    N and segid AN2)
       ( resid    13 and name   HN and segid AN2)   30.776  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    14 and name    N and segid AN2)
       ( resid    14 and name   HN and segid AN2)   28.352  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    15 and name    N and segid AN2)
       ( resid    15 and name   HN and segid AN2)   30.872  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    16 and name    N and segid AN2)
       ( resid    16 and name   HN and segid AN2)   36.784  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    17 and name    N and segid AN2)
       ( resid    17 and name   HN and segid AN2)   27.552  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    18 and name    N and segid AN2)
       ( resid    18 and name   HN and segid AN2)   29.232  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    20 and name    N and segid AN2)
       ( resid    20 and name   HN and segid AN2)   29.592  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    21 and name    N and segid AN2)
       ( resid    21 and name   HN and segid AN2)   26.896  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    22 and name    N and segid AN2)
       ( resid    22 and name   HN and segid AN2)   30.872  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    23 and name    N and segid AN2)
       ( resid    23 and name   HN and segid AN2)   34.840  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    24 and name    N and segid AN2)
       ( resid    24 and name   HN and segid AN2)   30.280  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    25 and name    N and segid AN2)
       ( resid    25 and name   HN and segid AN2)   27.712  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    26 and name    N and segid AN2)
       ( resid    26 and name   HN and segid AN2)   26.928  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    27 and name    N and segid AN2)
       ( resid    27 and name   HN and segid AN2)   30.360  1.00  1.00
!RDC: CaHa
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     5 and name   CA and segid AN1)
       ( resid     5 and name   HA and segid AN1)    1.590  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     8 and name   CA and segid AN1)
       ( resid     8 and name   HA and segid AN1)    6.890  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     9 and name   CA and segid AN1)
       ( resid     9 and name   HA and segid AN1)  -22.820  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    11 and name   CA and segid AN1)
       ( resid    11 and name   HA and segid AN1)  -21.580  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    12 and name   CA and segid AN1)
       ( resid    12 and name   HA and segid AN1)   24.760  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    14 and name   CA and segid AN1)
       ( resid    14 and name   HA and segid AN1)   -3.780  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    15 and name   CA and segid AN1)
       ( resid    15 and name   HA and segid AN1)   -4.350  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    17 and name   CA and segid AN1)
       ( resid    17 and name   HA and segid AN1)   -7.880  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    21 and name   CA and segid AN1)
       ( resid    21 and name   HA and segid AN1)    0.730  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    23 and name   CA and segid AN1)
       ( resid    23 and name   HA and segid AN1)   19.560  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    25 and name   CA and segid AN1)
       ( resid    25 and name   HA and segid AN1)   -7.270  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    26 and name   CA and segid AN1)
       ( resid    26 and name   HA and segid AN1)    7.410  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     5 and name   CA and segid AN2)
       ( resid     5 and name   HA and segid AN2)    1.590  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     8 and name   CA and segid AN2)
       ( resid     8 and name   HA and segid AN2)    6.890  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid     9 and name   CA and segid AN2)
       ( resid     9 and name   HA and segid AN2)  -22.820  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    11 and name   CA and segid AN2)
       ( resid    11 and name   HA and segid AN2)  -21.580  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    12 and name   CA and segid AN2)
       ( resid    12 and name   HA and segid AN2)   24.760  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    14 and name   CA and segid AN2)
       ( resid    14 and name   HA and segid AN2)   -3.780  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    15 and name   CA and segid AN2)
       ( resid    15 and name   HA and segid AN2)   -4.350  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    17 and name   CA and segid AN2)
       ( resid    17 and name   HA and segid AN2)   -7.880  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    21 and name   CA and segid AN2)
       ( resid    21 and name   HA and segid AN2)    0.730  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    23 and name   CA and segid AN2)
       ( resid    23 and name   HA and segid AN2)   19.560  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    25 and name   CA and segid AN2)
       ( resid    25 and name   HA and segid AN2)   -7.270  1.00  1.00
assign ( resid   500 and name   OO and segid SSS)
       ( resid   500 and name    Z and segid SSS)
       ( resid   500 and name    X and segid SSS)
       ( resid   500 and name    Y and segid SSS)
       ( resid    26 and name   CA and segid AN2)
       ( resid    26 and name   HA and segid AN2)    7.410  1.00  1.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ASP  -3          1H        ASP  -3 -23.664   0.270  -4.972
    2    HA   ASP  -3           HA       ASP  -3 -25.920   2.163  -4.810
    3   1HB   ASP  -3          1HB       ASP  -3 -24.593   3.439  -3.142
    4   2HB   ASP  -3          2HB       ASP  -3 -25.104   1.875  -2.510
    5    H    SER  -2           H        SER  -2 -24.035   4.341  -4.603
    6    HA   SER  -2           HA       SER  -2 -23.419   4.785  -7.326
    7   1HB   SER  -2          1HB       SER  -2 -21.956   5.986  -4.959
    8   2HB   SER  -2          2HB       SER  -2 -22.108   6.679  -6.571
    9    HG   SER  -2           HG       SER  -2 -24.230   6.129  -4.759
   10    H    LYS  -1           H        LYS  -1 -21.344   4.780  -8.424
   11    HA   LYS  -1           HA       LYS  -1 -19.676   2.486  -7.640
   12   1HB   LYS  -1          1HB       LYS  -1 -19.420   4.384  -9.995
   13   2HB   LYS  -1          2HB       LYS  -1 -18.560   2.856  -9.795
   14   1HG   LYS  -1          1HG       LYS  -1 -20.878   1.763  -9.603
   15   2HG   LYS  -1          2HG       LYS  -1 -21.522   3.285 -10.217
   16   1HD   LYS  -1          1HD       LYS  -1 -19.458   1.544 -11.601
   17   2HD   LYS  -1          2HD       LYS  -1 -21.153   1.701 -12.063
   18   1HE   LYS  -1          1HE       LYS  -1 -18.972   3.785 -12.217
   19   2HE   LYS  -1          2HE       LYS  -1 -20.000   3.180 -13.516
   20   1HZ   LYS  -1          1HZ       LYS  -1 -21.891   4.109 -12.040
   21   2HZ   LYS  -1          2HZ       LYS  -1 -20.987   5.174 -13.007
   22   3HZ   LYS  -1          3HZ       LYS  -1 -20.663   5.049 -11.343
   23    H    LEU   1           H        LEU   1 -19.750   5.369  -6.344
   24    HA   LEU   1           HA       LEU   1 -17.208   6.564  -6.717
   25   1HB   LEU   1          1HB       LEU   1 -19.104   7.596  -5.455
   26   2HB   LEU   1          2HB       LEU   1 -18.821   6.449  -4.149
   27    HG   LEU   1           HG       LEU   1 -16.480   7.332  -3.947
   28   1HD1  LEU   1          1HD1      LEU   1 -16.299   9.742  -5.018
   29   2HD1  LEU   1          2HD1      LEU   1 -17.476   9.110  -6.166
   30   3HD1  LEU   1          3HD1      LEU   1 -15.908   8.325  -5.986
   31   1HD2  LEU   1          1HD2      LEU   1 -17.163   9.463  -2.866
   32   2HD2  LEU   1          2HD2      LEU   1 -18.266   8.144  -2.472
   33   3HD2  LEU   1          3HD2      LEU   1 -18.728   9.351  -3.671
   34    H    CYS   2           H        CYS   2 -18.219   3.916  -4.571
   35    HA   CYS   2           HA       CYS   2 -15.840   3.668  -3.058
   36   1HB   CYS   2          1HB       CYS   2 -17.781   2.357  -2.462
   37   2HB   CYS   2          2HB       CYS   2 -17.774   1.546  -4.028
   38    H    TYR   3           H        TYR   3 -16.623   2.499  -6.304
   39    HA   TYR   3           HA       TYR   3 -14.354   0.828  -6.692
   40   1HB   TYR   3          1HB       TYR   3 -16.330   0.988  -8.236
   41   2HB   TYR   3          2HB       TYR   3 -15.719   2.550  -8.785
   42    HD1  TYR   3           HD1      TYR   3 -14.100   2.655 -10.502
   43    HD2  TYR   3           HD2      TYR   3 -14.733  -1.040  -8.402
   44    HE1  TYR   3           HE1      TYR   3 -12.581   1.497 -12.082
   45    HE2  TYR   3           HE2      TYR   3 -13.213  -2.197  -9.984
   46    HH   TYR   3           HH       TYR   3 -12.175  -2.003 -12.009
   47    H    LEU   4           H        LEU   4 -14.694   4.308  -6.689
   48    HA   LEU   4           HA       LEU   4 -12.165   4.819  -8.030
   49   1HB   LEU   4          1HB       LEU   4 -13.938   6.506  -8.071
   50   2HB   LEU   4          2HB       LEU   4 -13.920   6.602  -6.313
   51    HG   LEU   4           HG       LEU   4 -11.629   7.473  -6.350
   52   1HD1  LEU   4          1HD1      LEU   4 -10.556   6.487  -8.194
   53   2HD1  LEU   4          2HD1      LEU   4 -10.782   8.145  -8.741
   54   3HD1  LEU   4          3HD1      LEU   4 -11.875   6.876  -9.298
   55   1HD2  LEU   4          1HD2      LEU   4 -13.261   8.981  -8.405
   56   2HD2  LEU   4          2HD2      LEU   4 -12.123   9.643  -7.232
   57   3HD2  LEU   4          3HD2      LEU   4 -13.662   8.975  -6.688
   58    H    LEU   5           H        LEU   5 -13.253   4.708  -4.640
   59    HA   LEU   5           HA       LEU   5 -10.787   5.555  -3.478
   60   1HB   LEU   5          1HB       LEU   5 -13.122   3.927  -2.496
   61   2HB   LEU   5          2HB       LEU   5 -11.687   4.075  -1.488
   62    HG   LEU   5           HG       LEU   5 -13.453   5.793  -0.998
   63   1HD1  LEU   5          1HD1      LEU   5 -10.799   6.119  -0.858
   64   2HD1  LEU   5          2HD1      LEU   5 -11.913   7.434  -0.502
   65   3HD1  LEU   5          3HD1      LEU   5 -11.129   7.352  -2.076
   66   1HD2  LEU   5          1HD2      LEU   5 -14.185   6.027  -3.390
   67   2HD2  LEU   5          2HD2      LEU   5 -12.695   6.915  -3.712
   68   3HD2  LEU   5          3HD2      LEU   5 -13.886   7.567  -2.588
   69    H    ASP   6           H        ASP   6 -12.020   2.271  -4.165
   70    HA   ASP   6           HA       ASP   6  -9.710   0.878  -3.233
   71   1HB   ASP   6          1HB       ASP   6 -11.714   0.139  -5.387
   72   2HB   ASP   6          2HB       ASP   6 -10.522  -0.973  -4.713
   73    H    GLY   7           H        GLY   7 -10.483   2.336  -6.364
   74   1HA   GLY   7          1HA       GLY   7  -8.341   1.253  -7.876
   75   2HA   GLY   7          2HA       GLY   7  -9.101   2.811  -8.200
   76    H    ILE   8           H        ILE   8  -8.452   4.355  -6.080
   77    HA   ILE   8           HA       ILE   8  -5.717   5.029  -6.557
   78    HB   ILE   8           HB       ILE   8  -7.490   5.792  -4.217
   79   1HG1  ILE   8          1HG1      ILE   8  -6.915   7.292  -6.791
   80   2HG1  ILE   8          2HG1      ILE   8  -8.368   6.327  -6.523
   81   1HG2  ILE   8          1HG2      ILE   8  -5.941   7.788  -4.158
   82   2HG2  ILE   8          2HG2      ILE   8  -4.904   6.940  -5.304
   83   3HG2  ILE   8          3HG2      ILE   8  -5.178   6.267  -3.698
   84   1HD1  ILE   8          1HD1      ILE   8  -8.799   7.730  -4.458
   85   2HD1  ILE   8          2HD1      ILE   8  -8.930   8.604  -5.984
   86   3HD1  ILE   8          3HD1      ILE   8  -7.487   8.783  -4.987
   87    H    LEU   9           H        LEU   9  -7.222   3.554  -3.653
   88    HA   LEU   9           HA       LEU   9  -4.811   3.130  -2.229
   89   1HB   LEU   9          1HB       LEU   9  -7.270   1.356  -2.219
   90   2HB   LEU   9          2HB       LEU   9  -6.047   1.447  -0.955
   91    HG   LEU   9           HG       LEU   9  -7.653   3.857  -1.836
   92   1HD1  LEU   9          1HD1      LEU   9  -9.280   2.277  -1.047
   93   2HD1  LEU   9          2HD1      LEU   9  -8.985   3.407   0.275
   94   3HD1  LEU   9          3HD1      LEU   9  -8.251   1.804   0.305
   95   1HD2  LEU   9          1HD2      LEU   9  -7.028   4.539   0.563
   96   2HD2  LEU   9          2HD2      LEU   9  -5.715   4.518  -0.609
   97   3HD2  LEU   9          3HD2      LEU   9  -5.893   3.191   0.539
   98    H    PHE  10           H        PHE  10  -6.480   1.005  -4.563
   99    HA   PHE  10           HA       PHE  10  -4.662  -1.183  -4.339
  100   1HB   PHE  10          1HB       PHE  10  -6.905  -1.216  -5.506
  101   2HB   PHE  10          2HB       PHE  10  -6.148  -0.351  -6.844
  102    HD1  PHE  10           HD1      PHE  10  -4.664  -1.453  -8.371
  103    HD2  PHE  10           HD2      PHE  10  -6.108  -3.499  -4.883
  104    HE1  PHE  10           HE1      PHE  10  -3.792  -3.597  -9.267
  105    HE2  PHE  10           HE2      PHE  10  -5.236  -5.643  -5.777
  106    HZ   PHE  10           HZ       PHE  10  -4.078  -5.691  -7.970
  107    H    ILE  11           H        ILE  11  -4.771   1.390  -6.842
  108    HA   ILE  11           HA       ILE  11  -2.368   0.693  -8.146
  109    HB   ILE  11           HB       ILE  11  -3.586   3.436  -7.696
  110   1HG1  ILE  11          1HG1      ILE  11  -3.652   1.657 -10.148
  111   2HG1  ILE  11          2HG1      ILE  11  -4.924   1.649  -8.926
  112   1HG2  ILE  11          1HG2      ILE  11  -1.340   2.486  -9.489
  113   2HG2  ILE  11          2HG2      ILE  11  -1.297   3.792  -8.304
  114   3HG2  ILE  11          3HG2      ILE  11  -2.228   3.979  -9.790
  115   1HD1  ILE  11          1HD1      ILE  11  -5.377   3.169 -10.896
  116   2HD1  ILE  11          2HD1      ILE  11  -4.015   4.156 -10.364
  117   3HD1  ILE  11          3HD1      ILE  11  -5.429   3.972  -9.327
  118    H    TYR  12           H        TYR  12  -2.899   2.648  -5.237
  119    HA   TYR  12           HA       TYR  12  -0.232   3.593  -4.903
  120   1HB   TYR  12          1HB       TYR  12  -2.103   4.448  -3.561
  121   2HB   TYR  12          2HB       TYR  12  -2.294   2.869  -2.799
  122    HD1  TYR  12           HD1      TYR  12  -0.793   2.114  -1.070
  123    HD2  TYR  12           HD2      TYR  12  -0.064   5.810  -3.135
  124    HE1  TYR  12           HE1      TYR  12   0.926   2.715   0.616
  125    HE2  TYR  12           HE2      TYR  12   1.654   6.412  -1.449
  126    HH   TYR  12           HH       TYR  12   2.363   5.895   0.714
  127    H    GLY  13           H        GLY  13  -1.788   0.567  -3.850
  128   1HA   GLY  13          1HA       GLY  13   0.439  -0.426  -2.363
  129   2HA   GLY  13          2HA       GLY  13  -0.828  -1.428  -3.071
  130    H    VAL  14           H        VAL  14  -0.424  -0.727  -5.802
  131    HA   VAL  14           HA       VAL  14   1.716  -2.523  -6.474
  132    HB   VAL  14           HB       VAL  14   0.189  -0.535  -8.181
  133   1HG1  VAL  14          1HG1      VAL  14   2.215  -1.024  -9.347
  134   2HG1  VAL  14          2HG1      VAL  14   0.997  -2.093 -10.042
  135   3HG1  VAL  14          3HG1      VAL  14   2.161  -2.722  -8.876
  136   1HG2  VAL  14          1HG2      VAL  14  -1.047  -2.557  -8.896
  137   2HG2  VAL  14          2HG2      VAL  14  -1.199  -2.300  -7.159
  138   3HG2  VAL  14          3HG2      VAL  14  -0.096  -3.531  -7.775
  139    H    ILE  15           H        ILE  15   1.436   1.038  -6.748
  140    HA   ILE  15           HA       ILE  15   4.081   1.404  -7.794
  141    HB   ILE  15           HB       ILE  15   2.365   3.331  -6.198
  142   1HG1  ILE  15          1HG1      ILE  15   2.705   3.052  -9.200
  143   2HG1  ILE  15          2HG1      ILE  15   1.342   2.384  -8.302
  144   1HG2  ILE  15          1HG2      ILE  15   4.791   3.732  -7.974
  145   2HG2  ILE  15          2HG2      ILE  15   4.668   4.092  -6.252
  146   3HG2  ILE  15          3HG2      ILE  15   3.753   5.044  -7.418
  147   1HD1  ILE  15          1HD1      ILE  15   0.778   4.648  -7.482
  148   2HD1  ILE  15          2HD1      ILE  15   0.759   4.582  -9.245
  149   3HD1  ILE  15          3HD1      ILE  15   2.126   5.312  -8.404
  150    H    LEU  16           H        LEU  16   2.809   1.490  -4.460
  151    HA   LEU  16           HA       LEU  16   5.319   2.223  -3.273
  152   1HB   LEU  16          1HB       LEU  16   2.811   2.109  -2.314
  153   2HB   LEU  16          2HB       LEU  16   3.355   0.539  -1.747
  154    HG   LEU  16           HG       LEU  16   3.780   2.101   0.021
  155   1HD1  LEU  16          1HD1      LEU  16   6.481   1.872  -1.296
  156   2HD1  LEU  16          2HD1      LEU  16   5.630   0.446  -0.706
  157   3HD1  LEU  16          3HD1      LEU  16   6.067   1.736   0.410
  158   1HD2  LEU  16          1HD2      LEU  16   5.564   3.843  -1.665
  159   2HD2  LEU  16          2HD2      LEU  16   4.662   4.237  -0.206
  160   3HD2  LEU  16          3HD2      LEU  16   3.820   4.093  -1.744
  161    H    THR  17           H        THR  17   3.801  -0.914  -3.967
  162    HA   THR  17           HA       THR  17   5.821  -2.504  -2.683
  163    HB   THR  17           HB       THR  17   4.107  -3.280  -5.061
  164    HG1  THR  17           HG1      THR  17   3.547  -3.595  -2.305
  165   1HG2  THR  17          1HG2      THR  17   5.964  -4.826  -4.467
  166   2HG2  THR  17          2HG2      THR  17   4.379  -5.545  -4.182
  167   3HG2  THR  17          3HG2      THR  17   5.324  -4.928  -2.827
  168    H    ALA  18           H        ALA  18   5.495  -1.213  -5.972
  169    HA   ALA  18           HA       ALA  18   7.658  -2.615  -7.167
  170   1HB   ALA  18          1HB       ALA  18   6.108  -1.303  -8.515
  171   2HB   ALA  18          2HB       ALA  18   7.743  -0.687  -8.759
  172   3HB   ALA  18          3HB       ALA  18   6.620   0.182  -7.713
  173    H    LEU  19           H        LEU  19   7.643   0.561  -5.523
  174    HA   LEU  19           HA       LEU  19  10.447   1.054  -5.793
  175   1HB   LEU  19          1HB       LEU  19   8.634   1.934  -3.527
  176   2HB   LEU  19          2HB       LEU  19  10.153   2.687  -4.003
  177    HG   LEU  19           HG       LEU  19   7.775   2.438  -5.864
  178   1HD1  LEU  19          1HD1      LEU  19   7.456   4.891  -5.348
  179   2HD1  LEU  19          2HD1      LEU  19   8.586   4.690  -4.009
  180   3HD1  LEU  19          3HD1      LEU  19   7.059   3.808  -4.014
  181   1HD2  LEU  19          1HD2      LEU  19  10.403   3.941  -5.929
  182   2HD2  LEU  19          2HD2      LEU  19   9.037   4.418  -6.936
  183   3HD2  LEU  19          3HD2      LEU  19   9.756   2.822  -7.128
  184    H    PHE  20           H        PHE  20   8.595  -0.751  -3.373
  185    HA   PHE  20           HA       PHE  20  10.746  -1.123  -1.521
  186   1HB   PHE  20          1HB       PHE  20   8.397  -1.610  -0.946
  187   2HB   PHE  20          2HB       PHE  20   8.384  -2.938  -2.107
  188    HD1  PHE  20           HD1      PHE  20   9.372  -5.056  -1.592
  189    HD2  PHE  20           HD2      PHE  20   9.896  -1.721   1.062
  190    HE1  PHE  20           HE1      PHE  20  10.316  -6.575   0.127
  191    HE2  PHE  20           HE2      PHE  20  10.839  -3.238   2.782
  192    HZ   PHE  20           HZ       PHE  20  11.050  -5.664   2.314
  193    H    LEU  21           H        LEU  21   9.549  -3.270  -4.130
  194    HA   LEU  21           HA       LEU  21  11.638  -5.210  -3.817
  195   1HB   LEU  21          1HB       LEU  21  10.063  -4.513  -6.314
  196   2HB   LEU  21          2HB       LEU  21  10.963  -6.003  -6.045
  197    HG   LEU  21           HG       LEU  21   8.712  -5.091  -4.235
  198   1HD1  LEU  21          1HD1      LEU  21   7.377  -6.858  -5.470
  199   2HD1  LEU  21          2HD1      LEU  21   8.658  -6.875  -6.682
  200   3HD1  LEU  21          3HD1      LEU  21   7.725  -5.404  -6.405
  201   1HD2  LEU  21          1HD2      LEU  21  10.296  -7.650  -4.578
  202   2HD2  LEU  21          2HD2      LEU  21   8.712  -7.649  -3.806
  203   3HD2  LEU  21          3HD2      LEU  21  10.031  -6.715  -3.109
  204    H    ARG  22           H        ARG  22  11.352  -2.310  -5.850
  205    HA   ARG  22           HA       ARG  22  13.693  -2.661  -7.400
  206   1HB   ARG  22          1HB       ARG  22  11.914  -0.841  -7.628
  207   2HB   ARG  22          2HB       ARG  22  12.746   0.004  -6.323
  208   1HG   ARG  22          1HG       ARG  22  14.866  -0.157  -7.683
  209   2HG   ARG  22          2HG       ARG  22  13.895  -0.765  -9.018
  210   1HD   ARG  22          1HD       ARG  22  13.720   1.937  -7.682
  211   2HD   ARG  22          2HD       ARG  22  14.118   1.606  -9.362
  212    HE   ARG  22           HE       ARG  22  11.490   1.988  -8.268
  213   1HH1  ARG  22          1HH1      ARG  22  13.194  -0.070 -10.459
  214   2HH1  ARG  22          2HH1      ARG  22  11.753  -0.657 -11.217
  215   1HH2  ARG  22          1HH2      ARG  22   9.624   1.244  -9.259
  216   2HH2  ARG  22          2HH2      ARG  22   9.738   0.091 -10.546
  217    H    VAL  23           H        VAL  23  13.295  -1.179  -4.181
  218    HA   VAL  23           HA       VAL  23  16.121  -0.560  -3.916
  219    HB   VAL  23           HB       VAL  23  13.917  -0.770  -1.844
  220   1HG1  VAL  23          1HG1      VAL  23  16.769   0.236  -1.691
  221   2HG1  VAL  23          2HG1      VAL  23  16.020  -1.024  -0.711
  222   3HG1  VAL  23          3HG1      VAL  23  15.537   0.658  -0.501
  223   1HG2  VAL  23          1HG2      VAL  23  13.691   0.982  -3.659
  224   2HG2  VAL  23          2HG2      VAL  23  15.206   1.677  -3.086
  225   3HG2  VAL  23          3HG2      VAL  23  13.798   1.636  -2.025
  226    H    LYS  24           H        LYS  24  14.052  -3.281  -3.043
  227    HA   LYS  24           HA       LYS  24  15.737  -4.631  -1.235
  228   1HB   LYS  24          1HB       LYS  24  13.414  -5.334  -1.894
  229   2HB   LYS  24          2HB       LYS  24  14.080  -5.936  -3.413
  230   1HG   LYS  24          1HG       LYS  24  15.592  -7.434  -2.141
  231   2HG   LYS  24          2HG       LYS  24  14.875  -6.858  -0.636
  232   1HD   LYS  24          1HD       LYS  24  12.630  -7.615  -1.525
  233   2HD   LYS  24          2HD       LYS  24  13.493  -8.380  -2.860
  234   1HE   LYS  24          1HE       LYS  24  14.696  -9.826  -1.351
  235   2HE   LYS  24          2HE       LYS  24  14.084  -8.955   0.055
  236   1HZ   LYS  24          1HZ       LYS  24  11.817  -9.630  -1.205
  237   2HZ   LYS  24          2HZ       LYS  24  12.523 -10.538   0.045
  238   3HZ   LYS  24          3HZ       LYS  24  12.797 -10.963  -1.576
  239    H    PHE  25           H        PHE  25  15.811  -4.605  -4.790
  240    HA   PHE  25           HA       PHE  25  18.281  -6.277  -4.754
  241   1HB   PHE  25          1HB       PHE  25  16.505  -5.323  -7.020
  242   2HB   PHE  25          2HB       PHE  25  17.964  -6.290  -7.239
  243    HD1  PHE  25           HD1      PHE  25  18.101  -8.588  -6.248
  244    HD2  PHE  25           HD2      PHE  25  14.461  -6.308  -6.253
  245    HE1  PHE  25           HE1      PHE  25  16.808 -10.650  -5.775
  246    HE2  PHE  25           HE2      PHE  25  13.168  -8.370  -5.780
  247    HZ   PHE  25           HZ       PHE  25  14.342 -10.542  -5.540
  248    H    SER  26           H        SER  26  20.234  -5.280  -4.885
  249    HA   SER  26           HA       SER  26  20.498  -2.433  -5.066
  250   1HB   SER  26          1HB       SER  26  22.631  -4.517  -5.612
  251   2HB   SER  26          2HB       SER  26  22.894  -2.836  -5.156
  252    HG   SER  26           HG       SER  26  23.037  -4.059  -3.310
  253    H    ARG  27           H        ARG  27  20.708  -5.016  -7.469
  254    HA   ARG  27           HA       ARG  27  21.839  -3.560  -9.614
  255   1HB   ARG  27          1HB       ARG  27  19.611  -5.594  -9.893
  256   2HB   ARG  27          2HB       ARG  27  20.865  -5.208 -11.071
  257   1HG   ARG  27          1HG       ARG  27  21.316  -6.471  -8.348
  258   2HG   ARG  27          2HG       ARG  27  21.406  -7.302  -9.901
  259   1HD   ARG  27          1HD       ARG  27  23.183  -5.504 -10.517
  260   2HD   ARG  27          2HD       ARG  27  23.264  -5.209  -8.778
  261    HE   ARG  27           HE       ARG  27  23.541  -7.953  -8.987
  262   1HH1  ARG  27          1HH1      ARG  27  25.044  -5.179 -10.381
  263   2HH1  ARG  27          2HH1      ARG  27  26.589  -5.941 -10.558
  264   1HH2  ARG  27          1HH2      ARG  27  25.551  -8.962  -9.209
  265   2HH2  ARG  27          2HH2      ARG  27  26.877  -8.083  -9.896
  266    H    SER  28           H        SER  28  18.526  -3.610  -8.378
  267    HA   SER  28           HA       SER  28  16.661  -2.303  -8.962
  268   1HB   SER  28          1HB       SER  28  18.287  -0.568  -8.123
  269   2HB   SER  28          2HB       SER  28  18.789  -0.310  -9.791
  270    HG   SER  28           HG       SER  28  17.099   0.904 -10.002
  271    H    ALA  29           H        ALA  29  18.069  -3.977 -11.091
  272    HA   ALA  29           HA       ALA  29  17.892  -2.592 -13.595
  273   1HB   ALA  29          1HB       ALA  29  17.658  -5.542 -12.937
  274   2HB   ALA  29          2HB       ALA  29  19.114  -4.686 -13.443
  275   3HB   ALA  29          3HB       ALA  29  17.780  -4.899 -14.575
  276    H    ASP  30           H        ASP  30  15.512  -4.228 -11.590
  277    HA   ASP  30           HA       ASP  30  13.353  -3.010 -13.140
  278   1HB   ASP  30          1HB       ASP  30  13.952  -5.133 -14.399
  279   2HB   ASP  30          2HB       ASP  30  13.434  -6.033 -12.973
  280   1H    ASP  -3          1H        ASP  -3 -23.530  -6.050   5.428
  281    HA   ASP  -3           HA       ASP  -3 -24.575  -6.661   2.937
  282   1HB   ASP  -3          1HB       ASP  -3 -26.683  -6.432   5.108
  283   2HB   ASP  -3          2HB       ASP  -3 -27.000  -6.330   3.376
  284    H    SER  -2           H        SER  -2 -23.311  -4.760   5.147
  285    HA   SER  -2           HA       SER  -2 -24.189  -2.281   3.778
  286   1HB   SER  -2          1HB       SER  -2 -24.758  -1.122   5.793
  287   2HB   SER  -2          2HB       SER  -2 -25.634  -2.649   5.851
  288    HG   SER  -2           HG       SER  -2 -24.533  -2.175   7.814
  289    H    LYS  -1           H        LYS  -1 -22.652  -0.511   4.147
  290    HA   LYS  -1           HA       LYS  -1 -20.426   0.244   4.189
  291   1HB   LYS  -1          1HB       LYS  -1 -20.509  -1.441   6.711
  292   2HB   LYS  -1          2HB       LYS  -1 -19.208  -0.319   6.307
  293   1HG   LYS  -1          1HG       LYS  -1 -20.927   1.509   6.140
  294   2HG   LYS  -1          2HG       LYS  -1 -22.126   0.366   6.748
  295   1HD   LYS  -1          1HD       LYS  -1 -20.725   0.024   8.779
  296   2HD   LYS  -1          2HD       LYS  -1 -19.605   1.251   8.182
  297   1HE   LYS  -1          1HE       LYS  -1 -21.339   2.947   8.253
  298   2HE   LYS  -1          2HE       LYS  -1 -22.555   1.742   8.678
  299   1HZ   LYS  -1          1HZ       LYS  -1 -20.171   2.036  10.368
  300   2HZ   LYS  -1          2HZ       LYS  -1 -21.731   1.511  10.786
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.430   3.162  10.518
  302    H    LEU   1           H        LEU   1 -21.057  -2.341   2.811
  303    HA   LEU   1           HA       LEU   1 -19.017  -4.267   3.223
  304   1HB   LEU   1          1HB       LEU   1 -21.025  -4.585   1.761
  305   2HB   LEU   1          2HB       LEU   1 -20.309  -3.481   0.592
  306    HG   LEU   1           HG       LEU   1 -18.308  -5.023   0.475
  307   1HD1  LEU   1          1HD1      LEU   1 -20.088  -6.636   2.302
  308   2HD1  LEU   1          2HD1      LEU   1 -18.357  -6.329   2.431
  309   3HD1  LEU   1          3HD1      LEU   1 -18.962  -7.448   1.215
  310   1HD2  LEU   1          1HD2      LEU   1 -20.980  -6.270  -0.238
  311   2HD2  LEU   1          2HD2      LEU   1 -19.428  -6.620  -0.997
  312   3HD2  LEU   1          3HD2      LEU   1 -20.164  -5.029  -1.190
  313    H    CYS   2           H        CYS   2 -19.059  -1.328   1.224
  314    HA   CYS   2           HA       CYS   2 -16.516  -1.704  -0.012
  315   1HB   CYS   2          1HB       CYS   2 -18.099   0.010  -0.779
  316   2HB   CYS   2          2HB       CYS   2 -17.926   0.873   0.750
  317    H    TYR   3           H        TYR   3 -17.433  -0.474   3.158
  318    HA   TYR   3           HA       TYR   3 -14.973   0.739   3.897
  319   1HB   TYR   3          1HB       TYR   3 -17.135   0.816   5.204
  320   2HB   TYR   3          2HB       TYR   3 -16.803  -0.834   5.731
  321    HD1  TYR   3           HD1      TYR   3 -15.072   2.489   5.483
  322    HD2  TYR   3           HD2      TYR   3 -15.634  -1.122   7.743
  323    HE1  TYR   3           HE1      TYR   3 -13.588   3.371   7.263
  324    HE2  TYR   3           HE2      TYR   3 -14.150  -0.240   9.521
  325    HH   TYR   3           HH       TYR   3 -12.104   1.656   9.434
  326    H    LEU   4           H        LEU   4 -15.939  -2.630   3.713
  327    HA   LEU   4           HA       LEU   4 -13.708  -3.677   5.223
  328   1HB   LEU   4          1HB       LEU   4 -15.790  -4.969   4.815
  329   2HB   LEU   4          2HB       LEU   4 -15.414  -5.012   3.096
  330    HG   LEU   4           HG       LEU   4 -13.272  -6.205   3.646
  331   1HD1  LEU   4          1HD1      LEU   4 -14.420  -5.958   6.425
  332   2HD1  LEU   4          2HD1      LEU   4 -12.766  -5.683   5.881
  333   3HD1  LEU   4          3HD1      LEU   4 -13.385  -7.326   6.012
  334   1HD2  LEU   4          1HD2      LEU   4 -15.319  -7.421   2.967
  335   2HD2  LEU   4          2HD2      LEU   4 -15.809  -7.524   4.658
  336   3HD2  LEU   4          3HD2      LEU   4 -14.359  -8.363   4.109
  337    H    LEU   5           H        LEU   5 -14.323  -3.171   1.749
  338    HA   LEU   5           HA       LEU   5 -11.849  -4.293   0.843
  339   1HB   LEU   5          1HB       LEU   5 -13.820  -2.338  -0.338
  340   2HB   LEU   5          2HB       LEU   5 -12.310  -2.695  -1.176
  341    HG   LEU   5           HG       LEU   5 -12.884  -5.129  -1.078
  342   1HD1  LEU   5          1HD1      LEU   5 -14.358  -5.252   0.799
  343   2HD1  LEU   5          2HD1      LEU   5 -15.353  -5.604  -0.613
  344   3HD1  LEU   5          3HD1      LEU   5 -15.419  -4.008   0.136
  345   1HD2  LEU   5          1HD2      LEU   5 -14.886  -3.263  -2.386
  346   2HD2  LEU   5          2HD2      LEU   5 -14.738  -4.979  -2.768
  347   3HD2  LEU   5          3HD2      LEU   5 -13.396  -3.883  -3.099
  348    H    ASP   6           H        ASP   6 -12.782  -0.926   1.581
  349    HA   ASP   6           HA       ASP   6 -10.245   0.232   0.972
  350   1HB   ASP   6          1HB       ASP   6 -12.412   1.092   2.911
  351   2HB   ASP   6          2HB       ASP   6 -11.011   2.083   2.507
  352    H    GLY   7           H        GLY   7 -11.513  -1.279   3.910
  353   1HA   GLY   7          1HA       GLY   7  -9.411  -0.523   5.675
  354   2HA   GLY   7          2HA       GLY   7 -10.413  -1.961   5.865
  355    H    ILE   8           H        ILE   8  -9.767  -3.506   3.712
  356    HA   ILE   8           HA       ILE   8  -7.236  -4.607   4.452
  357    HB   ILE   8           HB       ILE   8  -8.756  -4.995   1.856
  358   1HG1  ILE   8          1HG1      ILE   8  -8.873  -6.596   4.433
  359   2HG1  ILE   8          2HG1      ILE   8 -10.095  -5.424   3.940
  360   1HG2  ILE   8          1HG2      ILE   8  -6.659  -6.660   3.284
  361   2HG2  ILE   8          2HG2      ILE   8  -6.467  -5.836   1.737
  362   3HG2  ILE   8          3HG2      ILE   8  -7.573  -7.202   1.876
  363   1HD1  ILE   8          1HD1      ILE   8 -10.957  -7.500   3.199
  364   2HD1  ILE   8          2HD1      ILE   8  -9.380  -8.050   2.633
  365   3HD1  ILE   8          3HD1      ILE   8 -10.246  -6.795   1.749
  366    H    LEU   9           H        LEU   9  -8.147  -2.778   1.502
  367    HA   LEU   9           HA       LEU   9  -5.505  -2.666   0.435
  368   1HB   LEU   9          1HB       LEU   9  -7.710  -0.612   0.097
  369   2HB   LEU   9          2HB       LEU   9  -6.341  -0.866  -0.982
  370    HG   LEU   9           HG       LEU   9  -8.375  -3.027  -0.364
  371   1HD1  LEU   9          1HD1      LEU   9  -8.291  -1.181  -2.767
  372   2HD1  LEU   9          2HD1      LEU   9  -9.437  -1.033  -1.435
  373   3HD1  LEU   9          3HD1      LEU   9  -9.464  -2.463  -2.466
  374   1HD2  LEU   9          1HD2      LEU   9  -6.384  -3.993  -1.251
  375   2HD2  LEU   9          2HD2      LEU   9  -6.160  -2.678  -2.402
  376   3HD2  LEU   9          3HD2      LEU   9  -7.462  -3.842  -2.634
  377    H    PHE  10           H        PHE  10  -7.236  -0.441   2.616
  378    HA   PHE  10           HA       PHE  10  -5.212   1.569   2.691
  379   1HB   PHE  10          1HB       PHE  10  -7.507   1.879   3.593
  380   2HB   PHE  10          2HB       PHE  10  -7.121   0.769   4.908
  381    HD1  PHE  10           HD1      PHE  10  -6.014   3.949   3.289
  382    HD2  PHE  10           HD2      PHE  10  -6.030   1.555   6.854
  383    HE1  PHE  10           HE1      PHE  10  -4.985   5.821   4.549
  384    HE2  PHE  10           HE2      PHE  10  -5.001   3.427   8.115
  385    HZ   PHE  10           HZ       PHE  10  -4.478   5.560   6.962
  386    H    ILE  11           H        ILE  11  -5.810  -1.128   4.976
  387    HA   ILE  11           HA       ILE  11  -3.536  -0.691   6.607
  388    HB   ILE  11           HB       ILE  11  -4.933  -3.280   5.868
  389   1HG1  ILE  11          1HG1      ILE  11  -5.110  -1.615   8.392
  390   2HG1  ILE  11          2HG1      ILE  11  -6.226  -1.429   7.041
  391   1HG2  ILE  11          1HG2      ILE  11  -2.796  -3.924   6.702
  392   2HG2  ILE  11          2HG2      ILE  11  -3.880  -4.030   8.088
  393   3HG2  ILE  11          3HG2      ILE  11  -2.801  -2.646   7.917
  394   1HD1  ILE  11          1HD1      ILE  11  -7.169  -2.951   8.727
  395   2HD1  ILE  11          2HD1      ILE  11  -5.745  -3.984   8.603
  396   3HD1  ILE  11          3HD1      ILE  11  -6.838  -3.821   7.228
  397    H    TYR  12           H        TYR  12  -3.862  -2.397   3.526
  398    HA   TYR  12           HA       TYR  12  -1.275  -3.598   3.471
  399   1HB   TYR  12          1HB       TYR  12  -3.040  -4.170   1.846
  400   2HB   TYR  12          2HB       TYR  12  -2.931  -2.551   1.156
  401    HD1  TYR  12           HD1      TYR  12  -1.019  -1.873  -0.195
  402    HD2  TYR  12           HD2      TYR  12  -1.227  -5.798   1.539
  403    HE1  TYR  12           HE1      TYR  12   0.853  -2.612  -1.648
  404    HE2  TYR  12           HE2      TYR  12   0.643  -6.538   0.087
  405    HH   TYR  12           HH       TYR  12   2.384  -5.730  -1.221
  406    H    GLY  13           H        GLY  13  -2.387  -0.374   2.451
  407   1HA   GLY  13          1HA       GLY  13   0.136   0.456   1.357
  408   2HA   GLY  13          2HA       GLY  13  -1.150   1.541   1.883
  409    H    VAL  14           H        VAL  14  -1.255   0.679   4.621
  410    HA   VAL  14           HA       VAL  14   0.859   2.302   5.710
  411    HB   VAL  14           HB       VAL  14  -1.035   0.373   7.084
  412   1HG1  VAL  14          1HG1      VAL  14   0.839   2.506   8.138
  413   2HG1  VAL  14          2HG1      VAL  14   0.816   0.793   8.557
  414   3HG1  VAL  14          3HG1      VAL  14  -0.496   1.847   9.084
  415   1HG2  VAL  14          1HG2      VAL  14  -2.167   2.195   5.868
  416   2HG2  VAL  14          2HG2      VAL  14  -1.135   3.379   6.670
  417   3HG2  VAL  14          3HG2      VAL  14  -2.296   2.439   7.609
  418    H    ILE  15           H        ILE  15   0.310  -1.238   5.723
  419    HA   ILE  15           HA       ILE  15   2.667  -1.857   7.221
  420    HB   ILE  15           HB       ILE  15   1.180  -3.536   5.179
  421   1HG1  ILE  15          1HG1      ILE  15   1.041  -3.534   8.212
  422   2HG1  ILE  15          2HG1      ILE  15  -0.123  -2.707   7.177
  423   1HG2  ILE  15          1HG2      ILE  15   3.286  -4.220   7.250
  424   2HG2  ILE  15          2HG2      ILE  15   3.380  -4.473   5.508
  425   3HG2  ILE  15          3HG2      ILE  15   2.263  -5.430   6.477
  426   1HD1  ILE  15          1HD1      ILE  15  -0.713  -4.832   6.102
  427   2HD1  ILE  15          2HD1      ILE  15  -0.924  -4.959   7.849
  428   3HD1  ILE  15          3HD1      ILE  15   0.490  -5.675   7.076
  429    H    LEU  16           H        LEU  16   2.123  -1.447   3.731
  430    HA   LEU  16           HA       LEU  16   4.780  -2.323   3.004
  431   1HB   LEU  16          1HB       LEU  16   2.453  -1.775   1.611
  432   2HB   LEU  16          2HB       LEU  16   3.440  -0.389   1.182
  433    HG   LEU  16           HG       LEU  16   3.917  -1.973  -0.493
  434   1HD1  LEU  16          1HD1      LEU  16   6.195  -2.158  -0.373
  435   2HD1  LEU  16          2HD1      LEU  16   6.186  -2.821   1.257
  436   3HD1  LEU  16          3HD1      LEU  16   5.967  -1.090   1.006
  437   1HD2  LEU  16          1HD2      LEU  16   4.291  -4.333  -0.126
  438   2HD2  LEU  16          2HD2      LEU  16   2.810  -3.883   0.714
  439   3HD2  LEU  16          3HD2      LEU  16   4.302  -4.113   1.622
  440    H    THR  17           H        THR  17   3.302   0.895   3.455
  441    HA   THR  17           HA       THR  17   5.604   2.434   2.838
  442    HB   THR  17           HB       THR  17   3.537   3.112   4.947
  443    HG1  THR  17           HG1      THR  17   2.215   3.647   3.353
  444   1HG2  THR  17          1HG2      THR  17   5.345   4.752   3.156
  445   2HG2  THR  17          2HG2      THR  17   5.385   4.665   4.917
  446   3HG2  THR  17          3HG2      THR  17   4.023   5.436   4.102
  447    H    ALA  18           H        ALA  18   4.594   0.923   5.895
  448    HA   ALA  18           HA       ALA  18   6.602   2.060   7.558
  449   1HB   ALA  18          1HB       ALA  18   6.262  -0.020   8.958
  450   2HB   ALA  18          2HB       ALA  18   5.201  -0.624   7.684
  451   3HB   ALA  18          3HB       ALA  18   4.775   0.844   8.563
  452    H    LEU  19           H        LEU  19   6.628  -1.036   5.764
  453    HA   LEU  19           HA       LEU  19   9.329  -1.716   6.464
  454   1HB   LEU  19          1HB       LEU  19   7.760  -2.504   3.989
  455   2HB   LEU  19          2HB       LEU  19   9.193  -3.322   4.608
  456    HG   LEU  19           HG       LEU  19   6.631  -2.990   6.199
  457   1HD1  LEU  19          1HD1      LEU  19   6.091  -5.278   5.609
  458   2HD1  LEU  19          2HD1      LEU  19   7.599  -5.446   4.709
  459   3HD1  LEU  19          3HD1      LEU  19   6.334  -4.368   4.118
  460   1HD2  LEU  19          1HD2      LEU  19   9.224  -4.494   6.602
  461   2HD2  LEU  19          2HD2      LEU  19   7.744  -5.022   7.399
  462   3HD2  LEU  19          3HD2      LEU  19   8.391  -3.417   7.721
  463    H    PHE  20           H        PHE  20   7.966   0.319   3.935
  464    HA   PHE  20           HA       PHE  20  10.351   0.484   2.338
  465   1HB   PHE  20          1HB       PHE  20   8.150   1.189   1.483
  466   2HB   PHE  20          2HB       PHE  20   8.101   2.492   2.670
  467    HD1  PHE  20           HD1      PHE  20   9.936   1.193  -0.293
  468    HD2  PHE  20           HD2      PHE  20   9.290   4.535   2.327
  469    HE1  PHE  20           HE1      PHE  20  11.221   2.649  -1.834
  470    HE2  PHE  20           HE2      PHE  20  10.576   5.991   0.786
  471    HZ   PHE  20           HZ       PHE  20  11.540   5.049  -1.295
  472    H    LEU  21           H        LEU  21   9.041   2.703   4.832
  473    HA   LEU  21           HA       LEU  21  11.282   4.479   4.796
  474   1HB   LEU  21          1HB       LEU  21   9.407   3.844   7.092
  475   2HB   LEU  21          2HB       LEU  21  10.445   5.261   6.980
  476    HG   LEU  21           HG       LEU  21   8.339   4.587   4.907
  477   1HD1  LEU  21          1HD1      LEU  21   8.155   6.381   7.346
  478   2HD1  LEU  21          2HD1      LEU  21   7.205   4.928   7.031
  479   3HD1  LEU  21          3HD1      LEU  21   6.978   6.363   6.031
  480   1HD2  LEU  21          1HD2      LEU  21  10.098   6.981   5.489
  481   2HD2  LEU  21          2HD2      LEU  21   8.597   7.158   4.582
  482   3HD2  LEU  21          3HD2      LEU  21   9.879   6.122   3.965
  483    H    ARG  22           H        ARG  22  10.643   1.527   6.665
  484    HA   ARG  22           HA       ARG  22  12.817   1.718   8.472
  485   1HB   ARG  22          1HB       ARG  22  10.992  -0.030   8.511
  486   2HB   ARG  22          2HB       ARG  22  11.822  -0.838   7.182
  487   1HG   ARG  22          1HG       ARG  22  13.890  -0.918   8.627
  488   2HG   ARG  22          2HG       ARG  22  12.906  -0.319   9.962
  489   1HD   ARG  22          1HD       ARG  22  13.059  -2.775  10.034
  490   2HD   ARG  22          2HD       ARG  22  11.399  -2.263   9.722
  491    HE   ARG  22           HE       ARG  22  12.455  -2.620   7.191
  492   1HH1  ARG  22          1HH1      ARG  22  12.251  -4.477  10.087
  493   2HH1  ARG  22          2HH1      ARG  22  12.178  -5.999   9.265
  494   1HH2  ARG  22          1HH2      ARG  22  12.356  -4.598   6.098
  495   2HH2  ARG  22          2HH2      ARG  22  12.236  -6.067   7.006
  496    H    VAL  23           H        VAL  23  12.715   0.405   5.157
  497    HA   VAL  23           HA       VAL  23  15.474  -0.423   5.138
  498    HB   VAL  23           HB       VAL  23  13.611   0.309   2.859
  499   1HG1  VAL  23          1HG1      VAL  23  16.351  -0.977   2.916
  500   2HG1  VAL  23          2HG1      VAL  23  15.857   0.469   2.034
  501   3HG1  VAL  23          3HG1      VAL  23  15.259  -1.114   1.539
  502   1HG2  VAL  23          1HG2      VAL  23  12.986  -1.634   4.372
  503   2HG2  VAL  23          2HG2      VAL  23  14.483  -2.415   3.863
  504   3HG2  VAL  23          3HG2      VAL  23  13.225  -2.064   2.678
  505    H    LYS  24           H        LYS  24  13.824   2.595   4.326
  506    HA   LYS  24           HA       LYS  24  16.018   3.917   3.077
  507   1HB   LYS  24          1HB       LYS  24  13.598   4.705   3.195
  508   2HB   LYS  24          2HB       LYS  24  13.946   5.251   4.836
  509   1HG   LYS  24          1HG       LYS  24  15.912   6.544   3.842
  510   2HG   LYS  24          2HG       LYS  24  15.217   6.197   2.259
  511   1HD   LYS  24          1HD       LYS  24  13.788   7.618   4.527
  512   2HD   LYS  24          2HD       LYS  24  14.470   8.400   3.101
  513   1HE   LYS  24          1HE       LYS  24  12.975   6.786   1.738
  514   2HE   LYS  24          2HE       LYS  24  12.122   6.510   3.258
  515   1HZ   LYS  24          1HZ       LYS  24  10.998   8.354   2.839
  516   2HZ   LYS  24          2HZ       LYS  24  11.975   8.729   1.500
  517   3HZ   LYS  24          3HZ       LYS  24  12.430   9.237   3.056
  518    H    PHE  25           H        PHE  25  15.040   3.724   6.500
  519    HA   PHE  25           HA       PHE  25  17.517   5.163   7.297
  520   1HB   PHE  25          1HB       PHE  25  15.130   4.164   8.881
  521   2HB   PHE  25          2HB       PHE  25  16.523   4.975   9.598
  522    HD1  PHE  25           HD1      PHE  25  17.128   7.315   8.793
  523    HD2  PHE  25           HD2      PHE  25  13.394   5.413   7.846
  524    HE1  PHE  25           HE1      PHE  25  16.151   9.520   8.218
  525    HE2  PHE  25           HE2      PHE  25  12.417   7.618   7.271
  526    HZ   PHE  25           HZ       PHE  25  13.796   9.672   7.456
  527    H    SER  26           H        SER  26  19.296   4.043   7.945
  528    HA   SER  26           HA       SER  26  19.356   1.168   7.851
  529   1HB   SER  26          1HB       SER  26  21.656   1.362   8.413
  530   2HB   SER  26          2HB       SER  26  21.300   2.817   7.486
  531    HG   SER  26           HG       SER  26  20.863   3.790   9.617
  532    H    ARG  27           H        ARG  27  19.892  -0.254   9.691
  533    HA   ARG  27           HA       ARG  27  18.144   0.133  11.927
  534   1HB   ARG  27          1HB       ARG  27  19.063  -2.074  11.016
  535   2HB   ARG  27          2HB       ARG  27  20.553  -1.697  11.882
  536   1HG   ARG  27          1HG       ARG  27  19.356  -1.612  14.000
  537   2HG   ARG  27          2HG       ARG  27  17.814  -1.839  13.174
  538   1HD   ARG  27          1HD       ARG  27  18.487  -3.987  14.050
  539   2HD   ARG  27          2HD       ARG  27  18.703  -4.036  12.300
  540    HE   ARG  27           HE       ARG  27  21.172  -3.206  13.265
  541   1HH1  ARG  27          1HH1      ARG  27  18.999  -5.825  13.820
  542   2HH1  ARG  27          2HH1      ARG  27  20.250  -6.951  14.227
  543   1HH2  ARG  27          1HH2      ARG  27  22.818  -4.661  13.797
  544   2HH2  ARG  27          2HH2      ARG  27  22.413  -6.292  14.216
  545    H    SER  28           H        SER  28  18.579   0.864  14.024
  546    HA   SER  28           HA       SER  28  20.620   2.808  14.387
  547   1HB   SER  28          1HB       SER  28  19.908   2.917  16.661
  548   2HB   SER  28          2HB       SER  28  18.466   2.514  15.735
  549    HG   SER  28           HG       SER  28  19.340   0.224  16.217
  550    H    ALA  29           H        ALA  29  22.383   2.652  16.082
  551    HA   ALA  29           HA       ALA  29  24.181   0.523  15.461
  552   1HB   ALA  29          1HB       ALA  29  25.601   1.447  17.205
  553   2HB   ALA  29          2HB       ALA  29  24.234   2.307  17.914
  554   3HB   ALA  29          3HB       ALA  29  24.851   2.783  16.331
  555    H    ASP  30           H        ASP  30  24.813  -1.296  16.722
  556    HA   ASP  30           HA       ASP  30  22.777  -2.756  18.006
  557   1HB   ASP  30          1HB       ASP  30  25.776  -2.931  18.424
  558   2HB   ASP  30          2HB       ASP  30  24.615  -4.157  18.934
  Start of MODEL    2
    1   1H    ASP  -3          1H        ASP  -3 -24.087  -0.737  -5.723
    2    HA   ASP  -3           HA       ASP  -3 -25.020   0.489  -7.740
    3   1HB   ASP  -3          1HB       ASP  -3 -26.655   1.649  -5.463
    4   2HB   ASP  -3          2HB       ASP  -3 -26.501   2.390  -7.057
    5    H    SER  -2           H        SER  -2 -24.864   3.245  -7.263
    6    HA   SER  -2           HA       SER  -2 -23.184   4.854  -6.911
    7   1HB   SER  -2          1HB       SER  -2 -22.949   3.312  -4.309
    8   2HB   SER  -2          2HB       SER  -2 -22.306   4.926  -4.600
    9    HG   SER  -2           HG       SER  -2 -24.418   5.644  -4.943
   10    H    LYS  -1           H        LYS  -1 -21.722   4.128  -8.537
   11    HA   LYS  -1           HA       LYS  -1 -19.802   2.006  -7.985
   12   1HB   LYS  -1          1HB       LYS  -1 -19.809   4.110 -10.175
   13   2HB   LYS  -1          2HB       LYS  -1 -18.809   2.658 -10.141
   14   1HG   LYS  -1          1HG       LYS  -1 -20.854   1.260 -10.133
   15   2HG   LYS  -1          2HG       LYS  -1 -21.840   2.720 -10.208
   16   1HD   LYS  -1          1HD       LYS  -1 -20.844   3.325 -12.357
   17   2HD   LYS  -1          2HD       LYS  -1 -19.768   1.930 -12.276
   18   1HE   LYS  -1          1HE       LYS  -1 -22.797   1.839 -12.410
   19   2HE   LYS  -1          2HE       LYS  -1 -21.687   1.421 -13.715
   20   1HZ   LYS  -1          1HZ       LYS  -1 -20.736  -0.139 -11.822
   21   2HZ   LYS  -1          2HZ       LYS  -1 -21.998  -0.629 -12.849
   22   3HZ   LYS  -1          3HZ       LYS  -1 -22.344  -0.056 -11.287
   23    H    LEU   1           H        LEU   1 -20.040   4.847  -6.526
   24    HA   LEU   1           HA       LEU   1 -17.538   6.152  -6.886
   25   1HB   LEU   1          1HB       LEU   1 -19.490   7.098  -5.631
   26   2HB   LEU   1          2HB       LEU   1 -19.163   5.955  -4.332
   27    HG   LEU   1           HG       LEU   1 -16.848   6.930  -4.141
   28   1HD1  LEU   1          1HD1      LEU   1 -16.360   7.999  -6.163
   29   2HD1  LEU   1          2HD1      LEU   1 -16.794   9.369  -5.148
   30   3HD1  LEU   1          3HD1      LEU   1 -17.964   8.719  -6.295
   31   1HD2  LEU   1          1HD2      LEU   1 -18.671   7.609  -2.631
   32   2HD2  LEU   1          2HD2      LEU   1 -19.176   8.844  -3.784
   33   3HD2  LEU   1          3HD2      LEU   1 -17.613   8.977  -2.977
   34    H    CYS   2           H        CYS   2 -18.482   3.409  -4.859
   35    HA   CYS   2           HA       CYS   2 -16.155   3.207  -3.261
   36   1HB   CYS   2          1HB       CYS   2 -18.037   1.787  -2.778
   37   2HB   CYS   2          2HB       CYS   2 -17.987   1.074  -4.390
   38    H    TYR   3           H        TYR   3 -16.732   2.240  -6.604
   39    HA   TYR   3           HA       TYR   3 -14.384   0.654  -6.960
   40   1HB   TYR   3          1HB       TYR   3 -16.303   0.819  -8.582
   41   2HB   TYR   3          2HB       TYR   3 -15.716   2.419  -9.035
   42    HD1  TYR   3           HD1      TYR   3 -14.646  -1.154  -8.761
   43    HD2  TYR   3           HD2      TYR   3 -14.015   2.648 -10.660
   44    HE1  TYR   3           HE1      TYR   3 -13.020  -2.199 -10.314
   45    HE2  TYR   3           HE2      TYR   3 -12.389   1.601 -12.213
   46    HH   TYR   3           HH       TYR   3 -11.194  -0.247 -12.650
   47    H    LEU   4           H        LEU   4 -14.871   4.104  -6.772
   48    HA   LEU   4           HA       LEU   4 -12.352   4.825  -8.015
   49   1HB   LEU   4          1HB       LEU   4 -14.315   6.373  -7.836
   50   2HB   LEU   4          2HB       LEU   4 -14.060   6.437  -6.096
   51    HG   LEU   4           HG       LEU   4 -11.724   7.277  -6.533
   52   1HD1  LEU   4          1HD1      LEU   4 -11.155   6.664  -8.720
   53   2HD1  LEU   4          2HD1      LEU   4 -11.569   8.361  -8.930
   54   3HD1  LEU   4          3HD1      LEU   4 -12.732   7.111  -9.369
   55   1HD2  LEU   4          1HD2      LEU   4 -13.479   8.847  -5.945
   56   2HD2  LEU   4          2HD2      LEU   4 -14.070   8.871  -7.607
   57   3HD2  LEU   4          3HD2      LEU   4 -12.497   9.568  -7.221
   58    H    LEU   5           H        LEU   5 -13.450   4.418  -4.644
   59    HA   LEU   5           HA       LEU   5 -11.024   5.260  -3.405
   60   1HB   LEU   5          1HB       LEU   5 -13.278   3.439  -2.564
   61   2HB   LEU   5          2HB       LEU   5 -11.854   3.603  -1.539
   62    HG   LEU   5           HG       LEU   5 -12.193   6.098  -1.581
   63   1HD1  LEU   5          1HD1      LEU   5 -13.481   6.373  -3.594
   64   2HD1  LEU   5          2HD1      LEU   5 -14.528   6.827  -2.250
   65   3HD1  LEU   5          3HD1      LEU   5 -14.718   5.253  -3.024
   66   1HD2  LEU   5          1HD2      LEU   5 -14.227   6.026  -0.085
   67   2HD2  LEU   5          2HD2      LEU   5 -12.977   4.855   0.338
   68   3HD2  LEU   5          3HD2      LEU   5 -14.420   4.330  -0.531
   69    H    ASP   6           H        ASP   6 -12.094   2.003  -4.421
   70    HA   ASP   6           HA       ASP   6  -9.751   0.629  -3.548
   71   1HB   ASP   6          1HB       ASP   6 -11.719   0.034  -5.771
   72   2HB   ASP   6          2HB       ASP   6 -10.419  -1.068  -5.316
   73    H    GLY   7           H        GLY   7 -10.489   2.327  -6.572
   74   1HA   GLY   7          1HA       GLY   7  -8.199   1.483  -8.041
   75   2HA   GLY   7          2HA       GLY   7  -9.073   2.989  -8.321
   76    H    ILE   8           H        ILE   8  -8.664   4.362  -5.963
   77    HA   ILE   8           HA       ILE   8  -5.981   5.330  -6.311
   78    HB   ILE   8           HB       ILE   8  -7.882   5.782  -3.990
   79   1HG1  ILE   8          1HG1      ILE   8  -7.430   7.419  -6.508
   80   2HG1  ILE   8          2HG1      ILE   8  -8.810   6.353  -6.246
   81   1HG2  ILE   8          1HG2      ILE   8  -5.594   6.440  -3.447
   82   2HG2  ILE   8          2HG2      ILE   8  -6.553   7.890  -3.733
   83   3HG2  ILE   8          3HG2      ILE   8  -5.449   7.305  -4.977
   84   1HD1  ILE   8          1HD1      ILE   8  -9.228   7.704  -4.094
   85   2HD1  ILE   8          2HD1      ILE   8  -9.592   8.505  -5.623
   86   3HD1  ILE   8          3HD1      ILE   8  -8.101   8.885  -4.761
   87    H    LEU   9           H        LEU   9  -7.462   3.512  -3.596
   88    HA   LEU   9           HA       LEU   9  -5.018   3.192  -2.152
   89   1HB   LEU   9          1HB       LEU   9  -7.395   1.311  -2.171
   90   2HB   LEU   9          2HB       LEU   9  -6.187   1.463  -0.898
   91    HG   LEU   9           HG       LEU   9  -7.948   3.768  -1.780
   92   1HD1  LEU   9          1HD1      LEU   9  -8.347   1.832   0.518
   93   2HD1  LEU   9          2HD1      LEU   9  -9.355   1.941  -0.924
   94   3HD1  LEU   9          3HD1      LEU   9  -9.309   3.279   0.223
   95   1HD2  LEU   9          1HD2      LEU   9  -6.043   4.584  -0.601
   96   2HD2  LEU   9          2HD2      LEU   9  -6.089   3.257   0.558
   97   3HD2  LEU   9          3HD2      LEU   9  -7.323   4.514   0.606
   98    H    PHE  10           H        PHE  10  -6.583   1.151  -4.614
   99    HA   PHE  10           HA       PHE  10  -4.741  -1.029  -4.437
  100   1HB   PHE  10          1HB       PHE  10  -6.893  -1.196  -5.628
  101   2HB   PHE  10          2HB       PHE  10  -6.314  -0.052  -6.840
  102    HD1  PHE  10           HD1      PHE  10  -5.548  -3.355  -5.272
  103    HD2  PHE  10           HD2      PHE  10  -5.046  -0.803  -8.690
  104    HE1  PHE  10           HE1      PHE  10  -4.480  -5.221  -6.508
  105    HE2  PHE  10           HE2      PHE  10  -3.978  -2.670  -9.927
  106    HZ   PHE  10           HZ       PHE  10  -3.695  -4.879  -8.834
  107    H    ILE  11           H        ILE  11  -4.820   1.688  -6.780
  108    HA   ILE  11           HA       ILE  11  -2.386   1.061  -8.082
  109    HB   ILE  11           HB       ILE  11  -3.672   3.755  -7.551
  110   1HG1  ILE  11          1HG1      ILE  11  -3.618   2.099 -10.084
  111   2HG1  ILE  11          2HG1      ILE  11  -4.912   1.970  -8.893
  112   1HG2  ILE  11          1HG2      ILE  11  -2.274   4.422  -9.583
  113   2HG2  ILE  11          2HG2      ILE  11  -1.350   2.943  -9.315
  114   3HG2  ILE  11          3HG2      ILE  11  -1.382   4.200  -8.078
  115   1HD1  ILE  11          1HD1      ILE  11  -4.079   4.565 -10.218
  116   2HD1  ILE  11          2HD1      ILE  11  -5.469   4.316  -9.162
  117   3HD1  ILE  11          3HD1      ILE  11  -5.429   3.569 -10.759
  118    H    TYR  12           H        TYR  12  -3.001   2.821  -5.085
  119    HA   TYR  12           HA       TYR  12  -0.355   3.822  -4.676
  120   1HB   TYR  12          1HB       TYR  12  -2.262   4.593  -3.331
  121   2HB   TYR  12          2HB       TYR  12  -2.439   2.981  -2.636
  122    HD1  TYR  12           HD1      TYR  12  -0.215   5.942  -2.853
  123    HD2  TYR  12           HD2      TYR  12  -0.990   2.202  -0.885
  124    HE1  TYR  12           HE1      TYR  12   1.473   6.501  -1.125
  125    HE2  TYR  12           HE2      TYR  12   0.700   2.761   0.845
  126    HH   TYR  12           HH       TYR  12   2.465   4.158   1.302
  127    H    GLY  13           H        GLY  13  -1.875   0.731  -3.770
  128   1HA   GLY  13          1HA       GLY  13   0.359  -0.276  -2.287
  129   2HA   GLY  13          2HA       GLY  13  -0.904  -1.268  -3.016
  130    H    VAL  14           H        VAL  14  -0.481  -0.435  -5.732
  131    HA   VAL  14           HA       VAL  14   1.653  -2.237  -6.448
  132    HB   VAL  14           HB       VAL  14   0.179  -0.200  -8.143
  133   1HG1  VAL  14          1HG1      VAL  14   1.930  -2.573  -8.839
  134   2HG1  VAL  14          2HG1      VAL  14   2.208  -0.882  -9.258
  135   3HG1  VAL  14          3HG1      VAL  14   0.874  -1.766  -9.999
  136   1HG2  VAL  14          1HG2      VAL  14  -0.300  -3.175  -7.784
  137   2HG2  VAL  14          2HG2      VAL  14  -1.262  -2.065  -8.760
  138   3HG2  VAL  14          3HG2      VAL  14  -1.254  -1.914  -7.002
  139    H    ILE  15           H        ILE  15   1.359   1.329  -6.631
  140    HA   ILE  15           HA       ILE  15   3.988   1.741  -7.698
  141    HB   ILE  15           HB       ILE  15   2.251   3.591  -6.036
  142   1HG1  ILE  15          1HG1      ILE  15   2.684   3.490  -9.036
  143   2HG1  ILE  15          2HG1      ILE  15   1.313   2.733  -8.225
  144   1HG2  ILE  15          1HG2      ILE  15   4.753   4.067  -7.677
  145   2HG2  ILE  15          2HG2      ILE  15   4.510   4.410  -5.964
  146   3HG2  ILE  15          3HG2      ILE  15   3.665   5.364  -7.182
  147   1HD1  ILE  15          1HD1      ILE  15   2.021   5.680  -8.149
  148   2HD1  ILE  15          2HD1      ILE  15   0.687   4.938  -7.267
  149   3HD1  ILE  15          3HD1      ILE  15   0.675   4.958  -9.031
  150    H    LEU  16           H        LEU  16   2.766   1.573  -4.365
  151    HA   LEU  16           HA       LEU  16   5.301   2.321  -3.187
  152   1HB   LEU  16          1HB       LEU  16   2.810   2.245  -2.198
  153   2HB   LEU  16          2HB       LEU  16   3.316   0.646  -1.676
  154    HG   LEU  16           HG       LEU  16   3.804   2.166   0.122
  155   1HD1  LEU  16          1HD1      LEU  16   5.570   0.446  -0.638
  156   2HD1  LEU  16          2HD1      LEU  16   6.086   1.708   0.477
  157   3HD1  LEU  16          3HD1      LEU  16   6.475   1.835  -1.237
  158   1HD2  LEU  16          1HD2      LEU  16   4.739   4.274  -0.076
  159   2HD2  LEU  16          2HD2      LEU  16   3.938   4.179  -1.640
  160   3HD2  LEU  16          3HD2      LEU  16   5.668   3.863  -1.515
  161    H    THR  17           H        THR  17   3.742  -0.783  -3.939
  162    HA   THR  17           HA       THR  17   5.744  -2.415  -2.676
  163    HB   THR  17           HB       THR  17   3.995  -3.132  -5.046
  164    HG1  THR  17           HG1      THR  17   2.729  -4.021  -3.186
  165   1HG2  THR  17          1HG2      THR  17   5.648  -4.819  -4.708
  166   2HG2  THR  17          2HG2      THR  17   4.184  -5.418  -3.927
  167   3HG2  THR  17          3HG2      THR  17   5.483  -4.728  -2.954
  168    H    ALA  18           H        ALA  18   5.400  -1.158  -5.986
  169    HA   ALA  18           HA       ALA  18   7.560  -2.572  -7.166
  170   1HB   ALA  18          1HB       ALA  18   5.925  -1.215  -8.448
  171   2HB   ALA  18          2HB       ALA  18   7.587  -0.777  -8.842
  172   3HB   ALA  18          3HB       ALA  18   6.634   0.252  -7.774
  173    H    LEU  19           H        LEU  19   7.555   0.624  -5.562
  174    HA   LEU  19           HA       LEU  19  10.366   1.094  -5.872
  175   1HB   LEU  19          1HB       LEU  19   8.505   2.082  -3.689
  176   2HB   LEU  19          2HB       LEU  19  10.077   2.770  -4.089
  177    HG   LEU  19           HG       LEU  19   7.780   2.572  -6.059
  178   1HD1  LEU  19          1HD1      LEU  19   7.634   5.080  -5.648
  179   2HD1  LEU  19          2HD1      LEU  19   8.637   4.819  -4.222
  180   3HD1  LEU  19          3HD1      LEU  19   7.048   4.062  -4.332
  181   1HD2  LEU  19          1HD2      LEU  19   9.776   2.808  -7.300
  182   2HD2  LEU  19          2HD2      LEU  19  10.523   3.845  -6.086
  183   3HD2  LEU  19          3HD2      LEU  19   9.234   4.472  -7.112
  184    H    PHE  20           H        PHE  20   8.515  -0.690  -3.459
  185    HA   PHE  20           HA       PHE  20  10.649  -0.965  -1.558
  186   1HB   PHE  20          1HB       PHE  20   8.314  -1.454  -0.966
  187   2HB   PHE  20          2HB       PHE  20   8.293  -2.795  -2.113
  188    HD1  PHE  20           HD1      PHE  20   9.244  -4.916  -1.566
  189    HD2  PHE  20           HD2      PHE  20   9.859  -1.541   1.018
  190    HE1  PHE  20           HE1      PHE  20  10.201  -6.415   0.163
  191    HE2  PHE  20           HE2      PHE  20  10.816  -3.040   2.747
  192    HZ   PHE  20           HZ       PHE  20  10.987  -5.476   2.319
  193    H    LEU  21           H        LEU  21   9.505  -3.173  -4.138
  194    HA   LEU  21           HA       LEU  21  11.552  -5.130  -3.737
  195   1HB   LEU  21          1HB       LEU  21  10.091  -4.427  -6.299
  196   2HB   LEU  21          2HB       LEU  21  10.951  -5.931  -5.983
  197    HG   LEU  21           HG       LEU  21   8.651  -4.953  -4.270
  198   1HD1  LEU  21          1HD1      LEU  21   8.657  -6.738  -6.714
  199   2HD1  LEU  21          2HD1      LEU  21   7.714  -5.271  -6.448
  200   3HD1  LEU  21          3HD1      LEU  21   7.343  -6.735  -5.538
  201   1HD2  LEU  21          1HD2      LEU  21  10.198  -7.544  -4.520
  202   2HD2  LEU  21          2HD2      LEU  21   8.584  -7.508  -3.816
  203   3HD2  LEU  21          3HD2      LEU  21   9.887  -6.589  -3.072
  204    H    ARG  22           H        ARG  22  11.416  -2.253  -5.830
  205    HA   ARG  22           HA       ARG  22  13.794  -2.671  -7.285
  206   1HB   ARG  22          1HB       ARG  22  12.168  -0.789  -7.643
  207   2HB   ARG  22          2HB       ARG  22  12.830  -0.005  -6.209
  208   1HG   ARG  22          1HG       ARG  22  15.078  -0.012  -7.260
  209   2HG   ARG  22          2HG       ARG  22  14.384  -0.745  -8.706
  210   1HD   ARG  22          1HD       ARG  22  13.562   1.933  -7.544
  211   2HD   ARG  22          2HD       ARG  22  14.607   1.712  -8.948
  212    HE   ARG  22           HE       ARG  22  12.324   0.291  -9.603
  213   1HH1  ARG  22          1HH1      ARG  22  13.057   3.483  -8.522
  214   2HH1  ARG  22          2HH1      ARG  22  11.716   4.211  -9.341
  215   1HH2  ARG  22          1HH2      ARG  22  10.572   1.224 -10.682
  216   2HH2  ARG  22          2HH2      ARG  22  10.310   2.933 -10.566
  217    H    VAL  23           H        VAL  23  13.359  -1.325  -4.019
  218    HA   VAL  23           HA       VAL  23  16.197  -0.771  -3.684
  219    HB   VAL  23           HB       VAL  23  13.962  -1.018  -1.648
  220   1HG1  VAL  23          1HG1      VAL  23  15.602   0.352  -0.252
  221   2HG1  VAL  23          2HG1      VAL  23  16.833  -0.082  -1.438
  222   3HG1  VAL  23          3HG1      VAL  23  16.034  -1.340  -0.495
  223   1HG2  VAL  23          1HG2      VAL  23  15.270   1.398  -2.943
  224   2HG2  VAL  23          2HG2      VAL  23  14.026   1.454  -1.694
  225   3HG2  VAL  23          3HG2      VAL  23  13.645   0.803  -3.287
  226    H    LYS  24           H        LYS  24  14.040  -3.464  -2.991
  227    HA   LYS  24           HA       LYS  24  15.647  -4.948  -1.207
  228   1HB   LYS  24          1HB       LYS  24  13.282  -5.481  -1.980
  229   2HB   LYS  24          2HB       LYS  24  14.001  -6.152  -3.444
  230   1HG   LYS  24          1HG       LYS  24  15.323  -7.726  -2.088
  231   2HG   LYS  24          2HG       LYS  24  14.626  -7.050  -0.615
  232   1HD   LYS  24          1HD       LYS  24  12.337  -7.636  -1.601
  233   2HD   LYS  24          2HD       LYS  24  13.211  -8.589  -2.799
  234   1HE   LYS  24          1HE       LYS  24  14.332  -9.812  -0.908
  235   2HE   LYS  24          2HE       LYS  24  13.270  -8.955   0.208
  236   1HZ   LYS  24          1HZ       LYS  24  11.380  -9.849  -1.153
  237   2HZ   LYS  24          2HZ       LYS  24  12.243 -11.006  -0.256
  238   3HZ   LYS  24          3HZ       LYS  24  12.502 -10.858  -1.929
  239    H    PHE  25           H        PHE  25  15.918  -4.531  -4.694
  240    HA   PHE  25           HA       PHE  25  18.189  -6.473  -4.781
  241   1HB   PHE  25          1HB       PHE  25  16.645  -5.082  -6.993
  242   2HB   PHE  25          2HB       PHE  25  17.984  -6.201  -7.251
  243    HD1  PHE  25           HD1      PHE  25  17.792  -8.567  -6.284
  244    HD2  PHE  25           HD2      PHE  25  14.446  -5.895  -6.644
  245    HE1  PHE  25           HE1      PHE  25  16.236 -10.488  -6.089
  246    HE2  PHE  25           HE2      PHE  25  12.891  -7.817  -6.449
  247    HZ   PHE  25           HZ       PHE  25  13.786 -10.113  -6.171
  248    H    SER  26           H        SER  26  20.235  -5.790  -5.627
  249    HA   SER  26           HA       SER  26  20.681  -2.955  -6.234
  250   1HB   SER  26          1HB       SER  26  22.198  -2.524  -4.393
  251   2HB   SER  26          2HB       SER  26  20.664  -3.068  -3.720
  252    HG   SER  26           HG       SER  26  22.693  -4.080  -2.922
  253    H    ARG  27           H        ARG  27  23.046  -2.595  -6.762
  254    HA   ARG  27           HA       ARG  27  24.030  -4.848  -8.338
  255   1HB   ARG  27          1HB       ARG  27  25.318  -2.161  -7.770
  256   2HB   ARG  27          2HB       ARG  27  25.808  -3.296  -9.025
  257   1HG   ARG  27          1HG       ARG  27  23.024  -2.109  -8.866
  258   2HG   ARG  27          2HG       ARG  27  24.323  -1.381  -9.808
  259   1HD   ARG  27          1HD       ARG  27  24.553  -3.731 -10.905
  260   2HD   ARG  27          2HD       ARG  27  22.951  -4.033 -10.234
  261    HE   ARG  27           HE       ARG  27  22.669  -1.608 -11.537
  262   1HH1  ARG  27          1HH1      ARG  27  23.837  -4.753 -12.329
  263   2HH1  ARG  27          2HH1      ARG  27  23.376  -4.650 -13.995
  264   1HH2  ARG  27          1HH2      ARG  27  22.063  -1.454 -13.708
  265   2HH2  ARG  27          2HH2      ARG  27  22.371  -2.782 -14.776
  266    H    SER  28           H        SER  28  26.019  -5.960  -7.984
  267    HA   SER  28           HA       SER  28  26.657  -6.557  -5.270
  268   1HB   SER  28          1HB       SER  28  28.514  -6.929  -7.630
  269   2HB   SER  28          2HB       SER  28  28.464  -7.872  -6.143
  270    HG   SER  28           HG       SER  28  26.555  -8.758  -6.773
  271    H    ALA  29           H        ALA  29  27.942  -4.178  -7.518
  272    HA   ALA  29           HA       ALA  29  30.353  -3.509  -6.198
  273   1HB   ALA  29          1HB       ALA  29  30.237  -1.402  -7.353
  274   2HB   ALA  29          2HB       ALA  29  28.484  -1.519  -7.511
  275   3HB   ALA  29          3HB       ALA  29  29.527  -2.610  -8.424
  276    H    ASP  30           H        ASP  30  30.824  -2.048  -4.513
  277    HA   ASP  30           HA       ASP  30  30.420  -1.087  -2.404
  278   1HB   ASP  30          1HB       ASP  30  28.107   0.042  -4.010
  279   2HB   ASP  30          2HB       ASP  30  28.610   0.640  -2.429
  280   1H    ASP  -3          1H        ASP  -3 -23.818   1.788  -2.592
  281    HA   ASP  -3           HA       ASP  -3 -26.183   1.896  -1.318
  282   1HB   ASP  -3          1HB       ASP  -3 -24.844  -0.684  -2.158
  283   2HB   ASP  -3          2HB       ASP  -3 -26.556  -0.272  -2.255
  284    H    SER  -2           H        SER  -2 -23.259   0.428  -0.063
  285    HA   SER  -2           HA       SER  -2 -24.582   0.044   2.546
  286   1HB   SER  -2          1HB       SER  -2 -23.966  -2.306   2.736
  287   2HB   SER  -2          2HB       SER  -2 -24.969  -2.095   1.303
  288    HG   SER  -2           HG       SER  -2 -23.305  -3.156   0.477
  289    H    LYS  -1           H        LYS  -1 -22.895  -0.578   4.222
  290    HA   LYS  -1           HA       LYS  -1 -20.431   0.943   3.679
  291   1HB   LYS  -1          1HB       LYS  -1 -21.432  -0.436   6.190
  292   2HB   LYS  -1          2HB       LYS  -1 -19.975   0.556   6.096
  293   1HG   LYS  -1          1HG       LYS  -1 -21.448   2.430   5.210
  294   2HG   LYS  -1          2HG       LYS  -1 -22.836   1.436   5.654
  295   1HD   LYS  -1          1HD       LYS  -1 -21.952   1.326   7.991
  296   2HD   LYS  -1          2HD       LYS  -1 -20.668   2.440   7.520
  297   1HE   LYS  -1          1HE       LYS  -1 -23.624   3.051   7.239
  298   2HE   LYS  -1          2HE       LYS  -1 -22.633   3.576   8.600
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.251   4.254   6.297
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.020   5.304   7.388
  301   3HZ   LYS  -1          3HZ       LYS  -1 -22.860   4.722   6.031
  302    H    LEU   1           H        LEU   1 -21.218  -2.060   2.827
  303    HA   LEU   1           HA       LEU   1 -19.167  -3.702   3.972
  304   1HB   LEU   1          1HB       LEU   1 -21.177  -4.509   2.640
  305   2HB   LEU   1          2HB       LEU   1 -20.339  -3.965   1.190
  306    HG   LEU   1           HG       LEU   1 -18.353  -5.436   2.077
  307   1HD1  LEU   1          1HD1      LEU   1 -20.723  -6.558   3.605
  308   2HD1  LEU   1          2HD1      LEU   1 -19.194  -5.989   4.273
  309   3HD1  LEU   1          3HD1      LEU   1 -19.240  -7.461   3.308
  310   1HD2  LEU   1          1HD2      LEU   1 -20.924  -6.492   0.880
  311   2HD2  LEU   1          2HD2      LEU   1 -19.479  -7.492   1.038
  312   3HD2  LEU   1          3HD2      LEU   1 -19.441  -6.038   0.041
  313    H    CYS   2           H        CYS   2 -19.238  -1.535   1.184
  314    HA   CYS   2           HA       CYS   2 -16.789  -2.243  -0.028
  315   1HB   CYS   2          1HB       CYS   2 -18.201  -0.660  -1.142
  316   2HB   CYS   2          2HB       CYS   2 -18.180   0.432   0.243
  317    H    TYR   3           H        TYR   3 -17.417  -0.478   2.931
  318    HA   TYR   3           HA       TYR   3 -14.884   0.786   3.243
  319   1HB   TYR   3          1HB       TYR   3 -16.975   1.106   4.681
  320   2HB   TYR   3          2HB       TYR   3 -16.512  -0.380   5.513
  321    HD1  TYR   3           HD1      TYR   3 -14.636  -0.443   7.025
  322    HD2  TYR   3           HD2      TYR   3 -15.486   3.097   4.745
  323    HE1  TYR   3           HE1      TYR   3 -13.023   0.835   8.409
  324    HE2  TYR   3           HE2      TYR   3 -13.873   4.376   6.129
  325    HH   TYR   3           HH       TYR   3 -11.609   3.423   7.661
  326    H    LEU   4           H        LEU   4 -15.866  -2.545   3.600
  327    HA   LEU   4           HA       LEU   4 -13.636  -3.402   5.217
  328   1HB   LEU   4          1HB       LEU   4 -15.781  -4.701   4.838
  329   2HB   LEU   4          2HB       LEU   4 -15.202  -5.051   3.212
  330    HG   LEU   4           HG       LEU   4 -13.053  -5.940   4.409
  331   1HD1  LEU   4          1HD1      LEU   4 -13.447  -5.191   6.661
  332   2HD1  LEU   4          2HD1      LEU   4 -13.654  -6.939   6.667
  333   3HD1  LEU   4          3HD1      LEU   4 -15.067  -5.888   6.677
  334   1HD2  LEU   4          1HD2      LEU   4 -14.125  -8.165   4.707
  335   2HD2  LEU   4          2HD2      LEU   4 -14.634  -7.383   3.211
  336   3HD2  LEU   4          3HD2      LEU   4 -15.709  -7.396   4.609
  337    H    LEU   5           H        LEU   5 -14.208  -3.254   1.708
  338    HA   LEU   5           HA       LEU   5 -11.727  -4.478   0.952
  339   1HB   LEU   5          1HB       LEU   5 -13.670  -2.632  -0.438
  340   2HB   LEU   5          2HB       LEU   5 -12.148  -3.069  -1.214
  341    HG   LEU   5           HG       LEU   5 -12.736  -5.483  -0.900
  342   1HD1  LEU   5          1HD1      LEU   5 -15.279  -4.236   0.161
  343   2HD1  LEU   5          2HD1      LEU   5 -14.242  -5.423   0.953
  344   3HD1  LEU   5          3HD1      LEU   5 -15.220  -5.894  -0.437
  345   1HD2  LEU   5          1HD2      LEU   5 -14.256  -5.562  -2.751
  346   2HD2  LEU   5          2HD2      LEU   5 -13.283  -4.109  -2.980
  347   3HD2  LEU   5          3HD2      LEU   5 -14.926  -3.980  -2.353
  348    H    ASP   6           H        ASP   6 -12.661  -1.064   1.396
  349    HA   ASP   6           HA       ASP   6 -10.125   0.046   0.707
  350   1HB   ASP   6          1HB       ASP   6 -12.236   1.066   2.635
  351   2HB   ASP   6          2HB       ASP   6 -10.879   2.019   2.034
  352    H    GLY   7           H        GLY   7 -11.395  -1.236   3.754
  353   1HA   GLY   7          1HA       GLY   7  -9.298  -0.374   5.467
  354   2HA   GLY   7          2HA       GLY   7 -10.284  -1.812   5.737
  355    H    ILE   8           H        ILE   8  -9.642  -3.502   3.740
  356    HA   ILE   8           HA       ILE   8  -7.095  -4.523   4.493
  357    HB   ILE   8           HB       ILE   8  -8.651  -5.045   1.938
  358   1HG1  ILE   8          1HG1      ILE   8  -8.631  -6.546   4.578
  359   2HG1  ILE   8          2HG1      ILE   8  -9.912  -5.447   4.066
  360   1HG2  ILE   8          1HG2      ILE   8  -7.398  -7.207   1.976
  361   2HG2  ILE   8          2HG2      ILE   8  -6.464  -6.610   3.347
  362   3HG2  ILE   8          3HG2      ILE   8  -6.331  -5.819   1.777
  363   1HD1  ILE   8          1HD1      ILE   8 -10.694  -7.601   3.451
  364   2HD1  ILE   8          2HD1      ILE   8  -9.114  -8.089   2.838
  365   3HD1  ILE   8          3HD1      ILE   8 -10.079  -6.910   1.950
  366    H    LEU   9           H        LEU   9  -8.044  -2.766   1.509
  367    HA   LEU   9           HA       LEU   9  -5.399  -2.658   0.424
  368   1HB   LEU   9          1HB       LEU   9  -7.637  -0.645   0.050
  369   2HB   LEU   9          2HB       LEU   9  -6.255  -0.876  -1.016
  370    HG   LEU   9           HG       LEU   9  -8.235  -3.083  -0.396
  371   1HD1  LEU   9          1HD1      LEU   9  -9.148  -2.539  -2.696
  372   2HD1  LEU   9          2HD1      LEU   9  -8.227  -1.036  -2.628
  373   3HD1  LEU   9          3HD1      LEU   9  -9.510  -1.339  -1.455
  374   1HD2  LEU   9          1HD2      LEU   9  -6.218  -3.998  -1.279
  375   2HD2  LEU   9          2HD2      LEU   9  -6.032  -2.681  -2.437
  376   3HD2  LEU   9          3HD2      LEU   9  -7.301  -3.882  -2.662
  377    H    PHE  10           H        PHE  10  -7.152  -0.483   2.616
  378    HA   PHE  10           HA       PHE  10  -5.171   1.584   2.665
  379   1HB   PHE  10          1HB       PHE  10  -7.482   1.858   3.548
  380   2HB   PHE  10          2HB       PHE  10  -7.084   0.763   4.873
  381    HD1  PHE  10           HD1      PHE  10  -5.947   3.928   3.229
  382    HD2  PHE  10           HD2      PHE  10  -6.096   1.606   6.839
  383    HE1  PHE  10           HE1      PHE  10  -4.958   5.822   4.487
  384    HE2  PHE  10           HE2      PHE  10  -5.106   3.500   8.098
  385    HZ   PHE  10           HZ       PHE  10  -4.537   5.608   6.922
  386    H    ILE  11           H        ILE  11  -5.774  -1.056   5.015
  387    HA   ILE  11           HA       ILE  11  -3.510  -0.604   6.638
  388    HB   ILE  11           HB       ILE  11  -4.888  -3.203   5.902
  389   1HG1  ILE  11          1HG1      ILE  11  -5.050  -1.563   8.442
  390   2HG1  ILE  11          2HG1      ILE  11  -6.168  -1.348   7.095
  391   1HG2  ILE  11          1HG2      ILE  11  -2.748  -3.852   6.716
  392   2HG2  ILE  11          2HG2      ILE  11  -3.817  -3.957   8.114
  393   3HG2  ILE  11          3HG2      ILE  11  -2.737  -2.575   7.932
  394   1HD1  ILE  11          1HD1      ILE  11  -6.895  -2.952   8.982
  395   2HD1  ILE  11          2HD1      ILE  11  -5.693  -4.064   8.329
  396   3HD1  ILE  11          3HD1      ILE  11  -7.045  -3.537   7.326
  397    H    TYR  12           H        TYR  12  -3.810  -2.395   3.597
  398    HA   TYR  12           HA       TYR  12  -1.227  -3.556   3.520
  399   1HB   TYR  12          1HB       TYR  12  -3.000  -4.063   1.872
  400   2HB   TYR  12          2HB       TYR  12  -2.844  -2.437   1.210
  401    HD1  TYR  12           HD1      TYR  12  -1.068  -1.865  -0.288
  402    HD2  TYR  12           HD2      TYR  12  -1.060  -5.655   1.735
  403    HE1  TYR  12           HE1      TYR  12   0.791  -2.635  -1.740
  404    HE2  TYR  12           HE2      TYR  12   0.799  -6.425   0.285
  405    HH   TYR  12           HH       TYR  12   2.678  -5.274  -1.066
  406    H    GLY  13           H        GLY  13  -2.321  -0.332   2.460
  407   1HA   GLY  13          1HA       GLY  13   0.226   0.530   1.475
  408   2HA   GLY  13          2HA       GLY  13  -1.080   1.602   1.979
  409    H    VAL  14           H        VAL  14  -1.264   0.739   4.701
  410    HA   VAL  14           HA       VAL  14   0.796   2.354   5.876
  411    HB   VAL  14           HB       VAL  14  -1.160   0.384   7.093
  412   1HG1  VAL  14          1HG1      VAL  14   0.850   2.250   8.371
  413   2HG1  VAL  14          2HG1      VAL  14   0.622   0.527   8.672
  414   3HG1  VAL  14          3HG1      VAL  14  -0.584   1.686   9.230
  415   1HG2  VAL  14          1HG2      VAL  14  -2.436   2.341   7.651
  416   2HG2  VAL  14          2HG2      VAL  14  -1.987   2.507   5.953
  417   3HG2  VAL  14          3HG2      VAL  14  -1.112   3.411   7.189
  418    H    ILE  15           H        ILE  15   0.322  -1.191   5.810
  419    HA   ILE  15           HA       ILE  15   2.697  -1.784   7.304
  420    HB   ILE  15           HB       ILE  15   1.253  -3.493   5.256
  421   1HG1  ILE  15          1HG1      ILE  15   0.986  -3.408   8.277
  422   2HG1  ILE  15          2HG1      ILE  15  -0.143  -2.633   7.164
  423   1HG2  ILE  15          1HG2      ILE  15   3.213  -4.172   7.471
  424   2HG2  ILE  15          2HG2      ILE  15   3.481  -4.366   5.739
  425   3HG2  ILE  15          3HG2      ILE  15   2.287  -5.366   6.563
  426   1HD1  ILE  15          1HD1      ILE  15  -0.953  -4.865   7.864
  427   2HD1  ILE  15          2HD1      ILE  15   0.513  -5.594   7.208
  428   3HD1  ILE  15          3HD1      ILE  15  -0.639  -4.807   6.130
  429    H    LEU  16           H        LEU  16   2.118  -1.360   3.823
  430    HA   LEU  16           HA       LEU  16   4.770  -2.228   3.065
  431   1HB   LEU  16          1HB       LEU  16   2.412  -1.654   1.711
  432   2HB   LEU  16          2HB       LEU  16   3.431  -0.308   1.239
  433    HG   LEU  16           HG       LEU  16   3.821  -1.954  -0.409
  434   1HD1  LEU  16          1HD1      LEU  16   5.922  -1.085   1.069
  435   2HD1  LEU  16          2HD1      LEU  16   6.095  -2.123  -0.339
  436   3HD1  LEU  16          3HD1      LEU  16   6.120  -2.825   1.276
  437   1HD2  LEU  16          1HD2      LEU  16   4.134  -4.308   0.010
  438   2HD2  LEU  16          2HD2      LEU  16   2.708  -3.804   0.912
  439   3HD2  LEU  16          3HD2      LEU  16   4.239  -4.046   1.748
  440    H    THR  17           H        THR  17   3.290   0.984   3.542
  441    HA   THR  17           HA       THR  17   5.566   2.540   2.878
  442    HB   THR  17           HB       THR  17   3.544   3.181   5.042
  443    HG1  THR  17           HG1      THR  17   3.050   2.595   2.581
  444   1HG2  THR  17          1HG2      THR  17   5.224   4.904   3.199
  445   2HG2  THR  17          2HG2      THR  17   5.449   4.715   4.938
  446   3HG2  THR  17          3HG2      THR  17   4.003   5.512   4.317
  447    H    ALA  18           H        ALA  18   4.658   0.981   5.938
  448    HA   ALA  18           HA       ALA  18   6.719   2.137   7.545
  449   1HB   ALA  18          1HB       ALA  18   6.341   0.181   9.040
  450   2HB   ALA  18          2HB       ALA  18   5.351  -0.560   7.783
  451   3HB   ALA  18          3HB       ALA  18   4.831   0.944   8.543
  452    H    LEU  19           H        LEU  19   6.656  -0.979   5.778
  453    HA   LEU  19           HA       LEU  19   9.338  -1.728   6.467
  454   1HB   LEU  19          1HB       LEU  19   7.743  -2.460   3.992
  455   2HB   LEU  19          2HB       LEU  19   9.171  -3.305   4.582
  456    HG   LEU  19           HG       LEU  19   6.616  -2.973   6.183
  457   1HD1  LEU  19          1HD1      LEU  19   6.382  -5.461   5.658
  458   2HD1  LEU  19          2HD1      LEU  19   7.606  -5.217   4.413
  459   3HD1  LEU  19          3HD1      LEU  19   6.067  -4.361   4.316
  460   1HD2  LEU  19          1HD2      LEU  19   8.355  -3.395   7.725
  461   2HD2  LEU  19          2HD2      LEU  19   9.225  -4.442   6.606
  462   3HD2  LEU  19          3HD2      LEU  19   7.747  -5.010   7.379
  463    H    PHE  20           H        PHE  20   8.042   0.300   3.884
  464    HA   PHE  20           HA       PHE  20  10.441   0.416   2.322
  465   1HB   PHE  20          1HB       PHE  20   8.284   1.198   1.442
  466   2HB   PHE  20          2HB       PHE  20   8.239   2.479   2.654
  467    HD1  PHE  20           HD1      PHE  20   9.624   4.450   2.462
  468    HD2  PHE  20           HD2      PHE  20   9.945   1.255  -0.390
  469    HE1  PHE  20           HE1      PHE  20  10.962   5.914   0.974
  470    HE2  PHE  20           HE2      PHE  20  11.283   2.719  -1.879
  471    HZ   PHE  20           HZ       PHE  20  11.792   5.048  -1.198
  472    H    LEU  21           H        LEU  21   9.200   2.609   4.865
  473    HA   LEU  21           HA       LEU  21  11.512   4.314   4.838
  474   1HB   LEU  21          1HB       LEU  21   9.542   3.780   7.080
  475   2HB   LEU  21          2HB       LEU  21  10.663   5.136   7.009
  476    HG   LEU  21           HG       LEU  21   8.623   4.599   4.835
  477   1HD1  LEU  21          1HD1      LEU  21   7.304   6.444   5.959
  478   2HD1  LEU  21          2HD1      LEU  21   8.367   6.261   7.355
  479   3HD1  LEU  21          3HD1      LEU  21   7.340   4.921   6.846
  480   1HD2  LEU  21          1HD2      LEU  21   8.979   7.151   4.582
  481   2HD2  LEU  21          2HD2      LEU  21  10.288   6.104   4.047
  482   3HD2  LEU  21          3HD2      LEU  21  10.400   6.931   5.599
  483    H    ARG  22           H        ARG  22  10.670   1.444   6.774
  484    HA   ARG  22           HA       ARG  22  12.833   1.534   8.593
  485   1HB   ARG  22          1HB       ARG  22  10.930  -0.108   8.663
  486   2HB   ARG  22          2HB       ARG  22  11.683  -0.968   7.320
  487   1HG   ARG  22          1HG       ARG  22  13.732  -1.276   8.686
  488   2HG   ARG  22          2HG       ARG  22  12.937  -0.466  10.036
  489   1HD   ARG  22          1HD       ARG  22  11.865  -2.961   8.690
  490   2HD   ARG  22          2HD       ARG  22  12.827  -2.972  10.168
  491    HE   ARG  22           HE       ARG  22  10.750  -1.222  10.733
  492   1HH1  ARG  22          1HH1      ARG  22  11.063  -4.441   9.544
  493   2HH1  ARG  22          2HH1      ARG  22   9.582  -4.991  10.255
  494   1HH2  ARG  22          1HH2      ARG  22   8.812  -1.920  11.667
  495   2HH2  ARG  22          2HH2      ARG  22   8.309  -3.564  11.458
  496    H    VAL  23           H        VAL  23  12.705   0.298   5.265
  497    HA   VAL  23           HA       VAL  23  15.449  -0.670   5.316
  498    HB   VAL  23           HB       VAL  23  13.545  -0.089   3.027
  499   1HG1  VAL  23          1HG1      VAL  23  16.321  -1.294   3.086
  500   2HG1  VAL  23          2HG1      VAL  23  15.749   0.062   2.114
  501   3HG1  VAL  23          3HG1      VAL  23  15.195  -1.574   1.757
  502   1HG2  VAL  23          1HG2      VAL  23  14.456  -2.669   4.344
  503   2HG2  VAL  23          2HG2      VAL  23  13.385  -2.562   2.948
  504   3HG2  VAL  23          3HG2      VAL  23  12.861  -1.935   4.511
  505    H    LYS  24           H        LYS  24  13.849   2.344   4.450
  506    HA   LYS  24           HA       LYS  24  15.911   3.577   2.963
  507   1HB   LYS  24          1HB       LYS  24  13.602   4.510   3.376
  508   2HB   LYS  24          2HB       LYS  24  14.139   4.959   4.995
  509   1HG   LYS  24          1HG       LYS  24  15.966   6.310   3.992
  510   2HG   LYS  24          2HG       LYS  24  15.357   5.909   2.386
  511   1HD   LYS  24          1HD       LYS  24  13.192   6.958   2.942
  512   2HD   LYS  24          2HD       LYS  24  13.804   7.369   4.544
  513   1HE   LYS  24          1HE       LYS  24  14.041   9.321   3.132
  514   2HE   LYS  24          2HE       LYS  24  15.650   8.663   3.429
  515   1HZ   LYS  24          1HZ       LYS  24  15.378   7.423   1.292
  516   2HZ   LYS  24          2HZ       LYS  24  15.499   9.110   1.131
  517   3HZ   LYS  24          3HZ       LYS  24  13.987   8.347   0.997
  518    H    PHE  25           H        PHE  25  15.431   3.473   6.500
  519    HA   PHE  25           HA       PHE  25  17.887   4.963   7.009
  520   1HB   PHE  25          1HB       PHE  25  16.049   3.364   8.812
  521   2HB   PHE  25          2HB       PHE  25  17.462   4.245   9.395
  522    HD1  PHE  25           HD1      PHE  25  14.019   4.499   8.272
  523    HD2  PHE  25           HD2      PHE  25  17.598   6.739   9.055
  524    HE1  PHE  25           HE1      PHE  25  12.695   6.594   8.319
  525    HE2  PHE  25           HE2      PHE  25  16.274   8.836   9.103
  526    HZ   PHE  25           HZ       PHE  25  13.822   8.764   8.734
  527    H    SER  26           H        SER  26  16.996   1.594   6.662
  528    HA   SER  26           HA       SER  26  18.294  -0.360   6.745
  529   1HB   SER  26          1HB       SER  26  20.410  -0.220   5.711
  530   2HB   SER  26          2HB       SER  26  19.527   1.141   5.027
  531    HG   SER  26           HG       SER  26  21.322   1.207   7.230
  532    H    ARG  27           H        ARG  27  18.140  -0.953   8.914
  533    HA   ARG  27           HA       ARG  27  19.436   0.344  11.089
  534   1HB   ARG  27          1HB       ARG  27  18.791  -2.611  10.862
  535   2HB   ARG  27          2HB       ARG  27  18.981  -1.686  12.351
  536   1HG   ARG  27          1HG       ARG  27  16.866  -1.109  10.252
  537   2HG   ARG  27          2HG       ARG  27  16.579  -2.069  11.701
  538   1HD   ARG  27          1HD       ARG  27  17.500  -0.009  12.993
  539   2HD   ARG  27          2HD       ARG  27  17.208   0.872  11.492
  540    HE   ARG  27           HE       ARG  27  14.816  -0.434  11.948
  541   1HH1  ARG  27          1HH1      ARG  27  16.922   1.617  13.748
  542   2HH1  ARG  27          2HH1      ARG  27  15.650   2.325  14.687
  543   1HH2  ARG  27          1HH2      ARG  27  13.141   0.476  13.164
  544   2HH2  ARG  27          2HH2      ARG  27  13.508   1.678  14.356
  545    H    SER  28           H        SER  28  20.575  -2.126   8.834
  546    HA   SER  28           HA       SER  28  22.929  -2.911  10.221
  547   1HB   SER  28          1HB       SER  28  22.477  -2.680   7.232
  548   2HB   SER  28          2HB       SER  28  23.780  -3.584   7.999
  549    HG   SER  28           HG       SER  28  21.825  -4.794   7.410
  550    H    ALA  29           H        ALA  29  22.357  -0.202   7.980
  551    HA   ALA  29           HA       ALA  29  23.746   1.615   7.417
  552   1HB   ALA  29          1HB       ALA  29  24.734   2.738   9.362
  553   2HB   ALA  29          2HB       ALA  29  24.542   1.273  10.325
  554   3HB   ALA  29          3HB       ALA  29  23.120   2.151   9.762
  555    H    ASP  30           H        ASP  30  26.280   2.375   8.136
  556    HA   ASP  30           HA       ASP  30  27.900   0.340   6.808
  557   1HB   ASP  30          1HB       ASP  30  28.248   2.773   6.417
  558   2HB   ASP  30          2HB       ASP  30  28.752   2.951   8.098
  Start of MODEL    3
    1   1H    ASP  -3          1H        ASP  -3 -24.642   2.778  -4.278
    2    HA   ASP  -3           HA       ASP  -3 -26.950   4.052  -5.637
    3   1HB   ASP  -3          1HB       ASP  -3 -25.390   4.634  -3.106
    4   2HB   ASP  -3          2HB       ASP  -3 -26.531   5.770  -3.827
    5    H    SER  -2           H        SER  -2 -23.480   3.902  -5.265
    6    HA   SER  -2           HA       SER  -2 -23.140   5.763  -7.494
    7   1HB   SER  -2          1HB       SER  -2 -21.804   7.406  -6.280
    8   2HB   SER  -2          2HB       SER  -2 -23.396   7.293  -5.536
    9    HG   SER  -2           HG       SER  -2 -21.528   5.519  -4.564
   10    H    LYS  -1           H        LYS  -1 -20.954   5.705  -8.319
   11    HA   LYS  -1           HA       LYS  -1 -19.492   3.252  -7.516
   12   1HB   LYS  -1          1HB       LYS  -1 -18.194   3.649  -9.584
   13   2HB   LYS  -1          2HB       LYS  -1 -19.926   3.628  -9.911
   14   1HG   LYS  -1          1HG       LYS  -1 -19.918   6.140  -9.744
   15   2HG   LYS  -1          2HG       LYS  -1 -18.160   6.074  -9.622
   16   1HD   LYS  -1          1HD       LYS  -1 -18.154   4.789 -11.804
   17   2HD   LYS  -1          2HD       LYS  -1 -19.873   5.159 -11.946
   18   1HE   LYS  -1          1HE       LYS  -1 -19.302   7.597 -11.742
   19   2HE   LYS  -1          2HE       LYS  -1 -17.596   7.154 -11.791
   20   1HZ   LYS  -1          1HZ       LYS  -1 -19.077   5.930 -13.898
   21   2HZ   LYS  -1          2HZ       LYS  -1 -17.680   6.893 -13.978
   22   3HZ   LYS  -1          3HZ       LYS  -1 -19.216   7.620 -13.945
   23    H    LEU   1           H        LEU   1 -19.529   6.002  -6.074
   24    HA   LEU   1           HA       LEU   1 -16.875   7.084  -6.299
   25   1HB   LEU   1          1HB       LEU   1 -18.762   8.348  -5.329
   26   2HB   LEU   1          2HB       LEU   1 -18.842   7.204  -3.992
   27    HG   LEU   1           HG       LEU   1 -16.544   7.831  -3.317
   28   1HD1  LEU   1          1HD1      LEU   1 -15.746  10.071  -4.464
   29   2HD1  LEU   1          2HD1      LEU   1 -16.747   9.517  -5.806
   30   3HD1  LEU   1          3HD1      LEU   1 -15.402   8.527  -5.237
   31   1HD2  LEU   1          1HD2      LEU   1 -18.259  10.299  -3.692
   32   2HD2  LEU   1          2HD2      LEU   1 -17.120   9.972  -2.386
   33   3HD2  LEU   1          3HD2      LEU   1 -18.618   9.048  -2.503
   34    H    CYS   2           H        CYS   2 -18.323   4.631  -4.165
   35    HA   CYS   2           HA       CYS   2 -16.149   4.293  -2.384
   36   1HB   CYS   2          1HB       CYS   2 -18.400   3.197  -2.169
   37   2HB   CYS   2          2HB       CYS   2 -17.933   2.091  -3.463
   38    H    TYR   3           H        TYR   3 -16.749   2.739  -5.539
   39    HA   TYR   3           HA       TYR   3 -14.445   1.067  -5.527
   40   1HB   TYR   3          1HB       TYR   3 -16.369   0.965  -7.169
   41   2HB   TYR   3          2HB       TYR   3 -15.671   2.374  -7.968
   42    HD1  TYR   3           HD1      TYR   3 -14.996  -1.149  -6.973
   43    HD2  TYR   3           HD2      TYR   3 -13.787   2.171  -9.418
   44    HE1  TYR   3           HE1      TYR   3 -13.418  -2.622  -8.192
   45    HE2  TYR   3           HE2      TYR   3 -12.208   0.698 -10.637
   46    HH   TYR   3           HH       TYR   3 -11.205  -2.229  -9.540
   47    H    LEU   4           H        LEU   4 -14.798   4.493  -6.071
   48    HA   LEU   4           HA       LEU   4 -12.398   4.949  -7.544
   49   1HB   LEU   4          1HB       LEU   4 -14.251   6.631  -7.113
   50   2HB   LEU   4          2HB       LEU   4 -13.600   6.816  -5.485
   51    HG   LEU   4           HG       LEU   4 -11.381   7.411  -6.501
   52   1HD1  LEU   4          1HD1      LEU   4 -11.292   6.620  -8.684
   53   2HD1  LEU   4          2HD1      LEU   4 -11.757   8.288  -8.994
   54   3HD1  LEU   4          3HD1      LEU   4 -12.977   7.018  -9.019
   55   1HD2  LEU   4          1HD2      LEU   4 -13.790   9.111  -7.212
   56   2HD2  LEU   4          2HD2      LEU   4 -12.127   9.697  -7.225
   57   3HD2  LEU   4          3HD2      LEU   4 -12.864   9.167  -5.712
   58    H    LEU   5           H        LEU   5 -13.014   4.754  -4.043
   59    HA   LEU   5           HA       LEU   5 -10.353   5.461  -3.238
   60   1HB   LEU   5          1HB       LEU   5 -12.604   3.936  -1.920
   61   2HB   LEU   5          2HB       LEU   5 -11.030   4.057  -1.135
   62    HG   LEU   5           HG       LEU   5 -11.174   6.551  -1.344
   63   1HD1  LEU   5          1HD1      LEU   5 -12.675   6.846  -3.174
   64   2HD1  LEU   5          2HD1      LEU   5 -13.552   7.414  -1.753
   65   3HD1  LEU   5          3HD1      LEU   5 -13.902   5.823  -2.428
   66   1HD2  LEU   5          1HD2      LEU   5 -11.832   5.426   0.742
   67   2HD2  LEU   5          2HD2      LEU   5 -13.460   5.179   0.110
   68   3HD2  LEU   5          3HD2      LEU   5 -12.882   6.811   0.443
   69    H    ASP   6           H        ASP   6 -11.902   2.311  -3.861
   70    HA   ASP   6           HA       ASP   6  -9.672   0.683  -3.204
   71   1HB   ASP   6          1HB       ASP   6 -11.919   0.296  -5.194
   72   2HB   ASP   6          2HB       ASP   6 -10.732  -0.957  -4.831
   73    H    GLY   7           H        GLY   7 -10.539   2.331  -6.229
   74   1HA   GLY   7          1HA       GLY   7  -8.466   1.202  -7.840
   75   2HA   GLY   7          2HA       GLY   7  -9.264   2.741  -8.157
   76    H    ILE   8           H        ILE   8  -8.555   4.288  -6.019
   77    HA   ILE   8           HA       ILE   8  -5.815   4.951  -6.630
   78    HB   ILE   8           HB       ILE   8  -7.484   5.890  -4.277
   79   1HG1  ILE   8          1HG1      ILE   8  -7.183   7.104  -7.045
   80   2HG1  ILE   8          2HG1      ILE   8  -8.600   6.204  -6.501
   81   1HG2  ILE   8          1HG2      ILE   8  -5.129   7.134  -5.733
   82   2HG2  ILE   8          2HG2      ILE   8  -5.063   6.396  -4.132
   83   3HG2  ILE   8          3HG2      ILE   8  -6.008   7.862  -4.389
   84   1HD1  ILE   8          1HD1      ILE   8  -7.558   8.844  -5.461
   85   2HD1  ILE   8          2HD1      ILE   8  -8.713   7.871  -4.551
   86   3HD1  ILE   8          3HD1      ILE   8  -9.146   8.494  -6.143
   87    H    LEU   9           H        LEU   9  -7.352   3.471  -3.756
   88    HA   LEU   9           HA       LEU   9  -4.941   3.191  -2.250
   89   1HB   LEU   9          1HB       LEU   9  -7.464   1.508  -2.225
   90   2HB   LEU   9          2HB       LEU   9  -6.196   1.415  -1.008
   91    HG   LEU   9           HG       LEU   9  -7.610   4.006  -1.688
   92   1HD1  LEU   9          1HD1      LEU   9  -8.295   2.034   0.512
   93   2HD1  LEU   9          2HD1      LEU   9  -9.266   2.329  -0.930
   94   3HD1  LEU   9          3HD1      LEU   9  -9.048   3.610   0.262
   95   1HD2  LEU   9          1HD2      LEU   9  -5.781   3.063   0.530
   96   2HD2  LEU   9          2HD2      LEU   9  -6.868   4.426   0.781
   97   3HD2  LEU   9          3HD2      LEU   9  -5.642   4.503  -0.478
   98    H    PHE  10           H        PHE  10  -6.532   0.978  -4.557
   99    HA   PHE  10           HA       PHE  10  -4.702  -1.188  -4.230
  100   1HB   PHE  10          1HB       PHE  10  -6.848  -1.396  -5.448
  101   2HB   PHE  10          2HB       PHE  10  -6.214  -0.363  -6.729
  102    HD1  PHE  10           HD1      PHE  10  -5.427  -3.504  -4.843
  103    HD2  PHE  10           HD2      PHE  10  -5.044  -1.329  -8.528
  104    HE1  PHE  10           HE1      PHE  10  -4.364  -5.479  -5.900
  105    HE2  PHE  10           HE2      PHE  10  -3.981  -3.304  -9.584
  106    HZ   PHE  10           HZ       PHE  10  -3.641  -5.380  -8.271
  107    H    ILE  11           H        ILE  11  -4.733   1.402  -6.709
  108    HA   ILE  11           HA       ILE  11  -2.291   0.694  -7.960
  109    HB   ILE  11           HB       ILE  11  -3.554   3.425  -7.571
  110   1HG1  ILE  11          1HG1      ILE  11  -3.532   1.613 -10.001
  111   2HG1  ILE  11          2HG1      ILE  11  -4.842   1.624  -8.819
  112   1HG2  ILE  11          1HG2      ILE  11  -1.264   3.820  -8.117
  113   2HG2  ILE  11          2HG2      ILE  11  -2.145   3.958  -9.639
  114   3HG2  ILE  11          3HG2      ILE  11  -1.236   2.491  -9.275
  115   1HD1  ILE  11          1HD1      ILE  11  -5.460   3.841  -9.347
  116   2HD1  ILE  11          2HD1      ILE  11  -5.102   3.124 -10.917
  117   3HD1  ILE  11          3HD1      ILE  11  -3.922   4.178 -10.141
  118    H    TYR  12           H        TYR  12  -2.929   2.649  -5.079
  119    HA   TYR  12           HA       TYR  12  -0.310   3.673  -4.675
  120   1HB   TYR  12          1HB       TYR  12  -2.271   4.407  -3.365
  121   2HB   TYR  12          2HB       TYR  12  -2.353   2.823  -2.598
  122    HD1  TYR  12           HD1      TYR  12  -0.842   2.199  -0.839
  123    HD2  TYR  12           HD2      TYR  12  -0.312   5.899  -2.958
  124    HE1  TYR  12           HE1      TYR  12   0.817   2.931   0.855
  125    HE2  TYR  12           HE2      TYR  12   1.345   6.630  -1.264
  126    HH   TYR  12           HH       TYR  12   2.370   6.135   0.637
  127    H    GLY  13           H        GLY  13  -1.761   0.577  -3.675
  128   1HA   GLY  13          1HA       GLY  13   0.539  -0.342  -2.217
  129   2HA   GLY  13          2HA       GLY  13  -0.749  -1.372  -2.839
  130    H    VAL  14           H        VAL  14  -0.477  -0.753  -5.609
  131    HA   VAL  14           HA       VAL  14   1.623  -2.563  -6.331
  132    HB   VAL  14           HB       VAL  14   0.077  -0.566  -8.009
  133   1HG1  VAL  14          1HG1      VAL  14   1.979  -2.800  -8.752
  134   2HG1  VAL  14          2HG1      VAL  14   2.068  -1.104  -9.226
  135   3HG1  VAL  14          3HG1      VAL  14   0.800  -2.139  -9.884
  136   1HG2  VAL  14          1HG2      VAL  14  -1.153  -2.453  -6.794
  137   2HG2  VAL  14          2HG2      VAL  14  -0.246  -3.569  -7.813
  138   3HG2  VAL  14          3HG2      VAL  14  -1.352  -2.407  -8.545
  139    H    ILE  15           H        ILE  15   1.414   1.003  -6.518
  140    HA   ILE  15           HA       ILE  15   4.017   1.322  -7.694
  141    HB   ILE  15           HB       ILE  15   2.398   3.255  -6.010
  142   1HG1  ILE  15          1HG1      ILE  15   2.705   3.051  -9.023
  143   2HG1  ILE  15          2HG1      ILE  15   1.337   2.382  -8.132
  144   1HG2  ILE  15          1HG2      ILE  15   4.838   3.609  -7.774
  145   2HG2  ILE  15          2HG2      ILE  15   4.695   3.989  -6.058
  146   3HG2  ILE  15          3HG2      ILE  15   3.824   4.953  -7.249
  147   1HD1  ILE  15          1HD1      ILE  15   0.799   4.620  -9.020
  148   2HD1  ILE  15          2HD1      ILE  15   2.171   5.298  -8.143
  149   3HD1  ILE  15          3HD1      ILE  15   0.802   4.625  -7.257
  150    H    LEU  16           H        LEU  16   2.902   1.370  -4.303
  151    HA   LEU  16           HA       LEU  16   5.478   2.007  -3.208
  152   1HB   LEU  16          1HB       LEU  16   2.912   1.705  -2.194
  153   2HB   LEU  16          2HB       LEU  16   3.719   0.299  -1.526
  154    HG   LEU  16           HG       LEU  16   4.029   1.968   0.108
  155   1HD1  LEU  16          1HD1      LEU  16   6.299   1.992   0.351
  156   2HD1  LEU  16          2HD1      LEU  16   6.598   2.588  -1.276
  157   3HD1  LEU  16          3HD1      LEU  16   6.237   0.885  -1.014
  158   1HD2  LEU  16          1HD2      LEU  16   3.248   3.847  -1.362
  159   2HD2  LEU  16          2HD2      LEU  16   4.865   3.923  -2.060
  160   3HD2  LEU  16          3HD2      LEU  16   4.625   4.277  -0.351
  161    H    THR  17           H        THR  17   3.814  -1.084  -3.803
  162    HA   THR  17           HA       THR  17   5.831  -2.786  -2.736
  163    HB   THR  17           HB       THR  17   4.035  -3.380  -5.105
  164    HG1  THR  17           HG1      THR  17   3.060  -4.359  -2.885
  165   1HG2  THR  17          1HG2      THR  17   4.195  -5.705  -4.145
  166   2HG2  THR  17          2HG2      THR  17   5.434  -5.101  -3.045
  167   3HG2  THR  17          3HG2      THR  17   5.716  -5.081  -4.786
  168    H    ALA  18           H        ALA  18   5.442  -1.369  -5.973
  169    HA   ALA  18           HA       ALA  18   7.591  -2.762  -7.230
  170   1HB   ALA  18          1HB       ALA  18   6.459   0.003  -7.750
  171   2HB   ALA  18          2HB       ALA  18   6.005  -1.494  -8.562
  172   3HB   ALA  18          3HB       ALA  18   7.610  -0.808  -8.811
  173    H    LEU  19           H        LEU  19   7.536   0.404  -5.573
  174    HA   LEU  19           HA       LEU  19  10.354   0.901  -5.886
  175   1HB   LEU  19          1HB       LEU  19   8.469   1.926  -3.738
  176   2HB   LEU  19          2HB       LEU  19  10.032   2.621  -4.157
  177    HG   LEU  19           HG       LEU  19   7.756   2.337  -6.139
  178   1HD1  LEU  19          1HD1      LEU  19   7.331   4.732  -5.763
  179   2HD1  LEU  19          2HD1      LEU  19   8.572   4.763  -4.510
  180   3HD1  LEU  19          3HD1      LEU  19   7.101   3.821  -4.271
  181   1HD2  LEU  19          1HD2      LEU  19  10.447   3.719  -6.144
  182   2HD2  LEU  19          2HD2      LEU  19   9.154   4.249  -7.218
  183   3HD2  LEU  19          3HD2      LEU  19   9.780   2.608  -7.339
  184    H    PHE  20           H        PHE  20   8.480  -0.897  -3.512
  185    HA   PHE  20           HA       PHE  20  10.574  -1.104  -1.547
  186   1HB   PHE  20          1HB       PHE  20   8.219  -1.584  -1.007
  187   2HB   PHE  20          2HB       PHE  20   8.241  -2.964  -2.105
  188    HD1  PHE  20           HD1      PHE  20   9.211  -5.054  -1.464
  189    HD2  PHE  20           HD2      PHE  20   9.685  -1.590   1.032
  190    HE1  PHE  20           HE1      PHE  20  10.122  -6.483   0.345
  191    HE2  PHE  20           HE2      PHE  20  10.596  -3.020   2.843
  192    HZ   PHE  20           HZ       PHE  20  10.814  -5.467   2.498
  193    H    LEU  21           H        LEU  21   9.485  -3.393  -4.080
  194    HA   LEU  21           HA       LEU  21  11.584  -5.287  -3.582
  195   1HB   LEU  21          1HB       LEU  21   9.971  -4.781  -6.100
  196   2HB   LEU  21          2HB       LEU  21  10.968  -6.205  -5.813
  197    HG   LEU  21           HG       LEU  21   8.691  -5.363  -3.993
  198   1HD1  LEU  21          1HD1      LEU  21   7.760  -5.874  -6.176
  199   2HD1  LEU  21          2HD1      LEU  21   7.435  -7.231  -5.097
  200   3HD1  LEU  21          3HD1      LEU  21   8.729  -7.342  -6.290
  201   1HD2  LEU  21          1HD2      LEU  21  10.511  -7.771  -4.181
  202   2HD2  LEU  21          2HD2      LEU  21   8.906  -7.926  -3.470
  203   3HD2  LEU  21          3HD2      LEU  21  10.076  -6.820  -2.761
  204    H    ARG  22           H        ARG  22  11.360  -2.477  -5.738
  205    HA   ARG  22           HA       ARG  22  13.689  -2.963  -7.278
  206   1HB   ARG  22          1HB       ARG  22  11.994  -1.103  -7.628
  207   2HB   ARG  22          2HB       ARG  22  12.797  -0.233  -6.318
  208   1HG   ARG  22          1HG       ARG  22  14.955  -0.440  -7.581
  209   2HG   ARG  22          2HG       ARG  22  14.053  -1.143  -8.923
  210   1HD   ARG  22          1HD       ARG  22  12.690   0.900  -9.092
  211   2HD   ARG  22          2HD       ARG  22  13.564   1.604  -7.733
  212    HE   ARG  22           HE       ARG  22  15.561   0.962  -9.548
  213   1HH1  ARG  22          1HH1      ARG  22  12.604   2.732  -9.590
  214   2HH1  ARG  22          2HH1      ARG  22  13.135   3.851 -10.800
  215   1HH2  ARG  22          1HH2      ARG  22  16.274   2.417 -11.129
  216   2HH2  ARG  22          2HH2      ARG  22  15.211   3.673 -11.672
  217    H    VAL  23           H        VAL  23  13.344  -1.380  -4.105
  218    HA   VAL  23           HA       VAL  23  16.155  -0.741  -3.858
  219    HB   VAL  23           HB       VAL  23  13.991  -1.067  -1.758
  220   1HG1  VAL  23          1HG1      VAL  23  16.837  -0.050  -1.618
  221   2HG1  VAL  23          2HG1      VAL  23  16.089  -1.313  -0.640
  222   3HG1  VAL  23          3HG1      VAL  23  15.621   0.372  -0.411
  223   1HG2  VAL  23          1HG2      VAL  23  13.901   1.374  -1.832
  224   2HG2  VAL  23          2HG2      VAL  23  13.642   0.736  -3.455
  225   3HG2  VAL  23          3HG2      VAL  23  15.209   1.413  -3.015
  226    H    LYS  24           H        LYS  24  14.178  -3.539  -3.025
  227    HA   LYS  24           HA       LYS  24  15.921  -4.904  -1.291
  228   1HB   LYS  24          1HB       LYS  24  13.609  -5.647  -1.972
  229   2HB   LYS  24          2HB       LYS  24  14.295  -6.194  -3.502
  230   1HG   LYS  24          1HG       LYS  24  15.857  -7.668  -2.246
  231   2HG   LYS  24          2HG       LYS  24  15.089  -7.163  -0.740
  232   1HD   LYS  24          1HD       LYS  24  12.911  -8.013  -1.606
  233   2HD   LYS  24          2HD       LYS  24  13.741  -8.599  -3.047
  234   1HE   LYS  24          1HE       LYS  24  14.612  -9.416  -0.271
  235   2HE   LYS  24          2HE       LYS  24  13.370 -10.302  -1.155
  236   1HZ   LYS  24          1HZ       LYS  24  14.949 -11.328  -2.287
  237   2HZ   LYS  24          2HZ       LYS  24  16.147 -10.478  -1.431
  238   3HZ   LYS  24          3HZ       LYS  24  15.525  -9.847  -2.879
  239    H    PHE  25           H        PHE  25  16.071  -4.549  -4.804
  240    HA   PHE  25           HA       PHE  25  18.375  -6.395  -4.986
  241   1HB   PHE  25          1HB       PHE  25  16.959  -4.699  -7.063
  242   2HB   PHE  25          2HB       PHE  25  18.285  -5.808  -7.413
  243    HD1  PHE  25           HD1      PHE  25  18.007  -8.273  -6.736
  244    HD2  PHE  25           HD2      PHE  25  14.733  -5.496  -6.927
  245    HE1  PHE  25           HE1      PHE  25  16.409 -10.166  -6.848
  246    HE2  PHE  25           HE2      PHE  25  13.135  -7.391  -7.037
  247    HZ   PHE  25           HZ       PHE  25  13.974  -9.725  -6.998
  248    H    SER  26           H        SER  26  18.113  -3.386  -3.830
  249    HA   SER  26           HA       SER  26  19.959  -1.799  -5.286
  250   1HB   SER  26          1HB       SER  26  18.511  -1.009  -3.384
  251   2HB   SER  26          2HB       SER  26  19.611  -1.822  -2.275
  252    HG   SER  26           HG       SER  26  21.225  -0.492  -3.675
  253    H    ARG  27           H        ARG  27  20.494  -4.374  -2.936
  254    HA   ARG  27           HA       ARG  27  23.227  -3.907  -2.354
  255   1HB   ARG  27          1HB       ARG  27  21.784  -6.558  -2.657
  256   2HB   ARG  27          2HB       ARG  27  23.343  -6.332  -1.861
  257   1HG   ARG  27          1HG       ARG  27  22.286  -4.789  -0.242
  258   2HG   ARG  27          2HG       ARG  27  20.727  -5.048  -1.024
  259   1HD   ARG  27          1HD       ARG  27  20.938  -7.490  -0.541
  260   2HD   ARG  27          2HD       ARG  27  22.421  -7.152   0.349
  261    HE   ARG  27           HE       ARG  27  20.557  -5.481   1.528
  262   1HH1  ARG  27          1HH1      ARG  27  20.769  -8.837   0.763
  263   2HH1  ARG  27          2HH1      ARG  27  19.810  -9.344   2.114
  264   1HH2  ARG  27          1HH2      ARG  27  19.303  -6.122   3.298
  265   2HH2  ARG  27          2HH2      ARG  27  18.982  -7.806   3.550
  266    H    SER  28           H        SER  28  21.737  -5.653  -5.075
  267    HA   SER  28           HA       SER  28  24.063  -5.119  -6.744
  268   1HB   SER  28          1HB       SER  28  24.815  -7.376  -7.061
  269   2HB   SER  28          2HB       SER  28  24.753  -7.112  -5.321
  270    HG   SER  28           HG       SER  28  23.510  -8.961  -6.731
  271    H    ALA  29           H        ALA  29  23.720  -6.608  -8.877
  272    HA   ALA  29           HA       ALA  29  21.201  -5.804  -9.973
  273   1HB   ALA  29          1HB       ALA  29  21.842  -7.319 -11.880
  274   2HB   ALA  29          2HB       ALA  29  23.237  -7.833 -10.931
  275   3HB   ALA  29          3HB       ALA  29  23.090  -6.153 -11.443
  276    H    ASP  30           H        ASP  30  22.290  -8.813  -8.477
  277    HA   ASP  30           HA       ASP  30  19.862 -10.262  -9.233
  278   1HB   ASP  30          1HB       ASP  30  20.763 -12.076  -7.895
  279   2HB   ASP  30          2HB       ASP  30  22.077 -11.384  -8.848
  280   1H    ASP  -3          1H        ASP  -3 -23.084  -5.034   5.891
  281    HA   ASP  -3           HA       ASP  -3 -22.421  -7.020   4.538
  282   1HB   ASP  -3          1HB       ASP  -3 -25.435  -7.121   4.329
  283   2HB   ASP  -3          2HB       ASP  -3 -24.401  -7.810   3.077
  284    H    SER  -2           H        SER  -2 -24.624  -4.296   4.273
  285    HA   SER  -2           HA       SER  -2 -24.153  -3.786   1.466
  286   1HB   SER  -2          1HB       SER  -2 -24.986  -1.823   3.622
  287   2HB   SER  -2          2HB       SER  -2 -25.187  -1.617   1.885
  288    HG   SER  -2           HG       SER  -2 -26.444  -3.456   3.627
  289    H    LYS  -1           H        LYS  -1 -22.454  -2.988   4.419
  290    HA   LYS  -1           HA       LYS  -1 -20.770  -0.956   3.150
  291   1HB   LYS  -1          1HB       LYS  -1 -20.523  -2.391   5.812
  292   2HB   LYS  -1          2HB       LYS  -1 -19.520  -1.034   5.300
  293   1HG   LYS  -1          1HG       LYS  -1 -21.529   0.380   5.084
  294   2HG   LYS  -1          2HG       LYS  -1 -22.537  -0.974   5.596
  295   1HD   LYS  -1          1HD       LYS  -1 -21.286  -1.056   7.747
  296   2HD   LYS  -1          2HD       LYS  -1 -20.361   0.358   7.237
  297   1HE   LYS  -1          1HE       LYS  -1 -23.381   0.292   7.479
  298   2HE   LYS  -1          2HE       LYS  -1 -22.299   0.940   8.711
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.649   2.669   7.353
  300   2HZ   LYS  -1          2HZ       LYS  -1 -23.298   2.526   6.972
  301   3HZ   LYS  -1          3HZ       LYS  -1 -22.121   1.885   5.926
  302    H    LEU   1           H        LEU   1 -20.927  -3.970   2.322
  303    HA   LEU   1           HA       LEU   1 -18.483  -5.265   2.822
  304   1HB   LEU   1          1HB       LEU   1 -20.475  -6.169   1.521
  305   2HB   LEU   1          2HB       LEU   1 -19.899  -5.234   0.144
  306    HG   LEU   1           HG       LEU   1 -17.610  -6.468   0.603
  307   1HD1  LEU   1          1HD1      LEU   1 -19.636  -8.295   1.941
  308   2HD1  LEU   1          2HD1      LEU   1 -18.221  -7.560   2.695
  309   3HD1  LEU   1          3HD1      LEU   1 -18.017  -8.794   1.456
  310   1HD2  LEU   1          1HD2      LEU   1 -18.475  -8.437  -0.784
  311   2HD2  LEU   1          2HD2      LEU   1 -18.773  -6.834  -1.453
  312   3HD2  LEU   1          3HD2      LEU   1 -20.074  -7.706  -0.645
  313    H    CYS   2           H        CYS   2 -19.240  -2.724   0.469
  314    HA   CYS   2           HA       CYS   2 -16.778  -2.751  -0.955
  315   1HB   CYS   2          1HB       CYS   2 -18.873  -1.448  -1.551
  316   2HB   CYS   2          2HB       CYS   2 -18.417  -0.285  -0.306
  317    H    TYR   3           H        TYR   3 -17.724  -0.983   1.993
  318    HA   TYR   3           HA       TYR   3 -15.332   0.508   2.314
  319   1HB   TYR   3          1HB       TYR   3 -17.510   0.707   3.646
  320   2HB   TYR   3          2HB       TYR   3 -16.930  -0.657   4.602
  321    HD1  TYR   3           HD1      TYR   3 -16.177   2.829   3.566
  322    HD2  TYR   3           HD2      TYR   3 -15.196  -0.391   6.233
  323    HE1  TYR   3           HE1      TYR   3 -14.778   4.371   4.912
  324    HE2  TYR   3           HE2      TYR   3 -13.796   1.150   7.580
  325    HH   TYR   3           HH       TYR   3 -13.732   4.613   6.930
  326    H    LEU   4           H        LEU   4 -16.023  -2.870   2.922
  327    HA   LEU   4           HA       LEU   4 -13.864  -3.446   4.694
  328   1HB   LEU   4          1HB       LEU   4 -15.776  -4.999   4.125
  329   2HB   LEU   4          2HB       LEU   4 -15.004  -5.281   2.568
  330    HG   LEU   4           HG       LEU   4 -12.914  -5.974   3.868
  331   1HD1  LEU   4          1HD1      LEU   4 -13.607  -6.906   6.212
  332   2HD1  LEU   4          2HD1      LEU   4 -14.906  -5.720   6.121
  333   3HD1  LEU   4          3HD1      LEU   4 -13.225  -5.194   6.065
  334   1HD2  LEU   4          1HD2      LEU   4 -15.421  -7.638   4.252
  335   2HD2  LEU   4          2HD2      LEU   4 -13.764  -8.241   4.226
  336   3HD2  LEU   4          3HD2      LEU   4 -14.478  -7.562   2.764
  337    H    LEU   5           H        LEU   5 -14.027  -3.237   1.158
  338    HA   LEU   5           HA       LEU   5 -11.413  -4.285   0.640
  339   1HB   LEU   5          1HB       LEU   5 -13.275  -2.448  -0.868
  340   2HB   LEU   5          2HB       LEU   5 -11.651  -2.765  -1.481
  341    HG   LEU   5           HG       LEU   5 -12.140  -5.217  -1.374
  342   1HD1  LEU   5          1HD1      LEU   5 -14.857  -4.165  -0.559
  343   2HD1  LEU   5          2HD1      LEU   5 -13.853  -5.343   0.286
  344   3HD1  LEU   5          3HD1      LEU   5 -14.632  -5.778  -1.235
  345   1HD2  LEU   5          1HD2      LEU   5 -13.914  -3.406  -3.029
  346   2HD2  LEU   5          2HD2      LEU   5 -13.857  -5.152  -3.274
  347   3HD2  LEU   5          3HD2      LEU   5 -12.404  -4.180  -3.512
  348    H    ASP   6           H        ASP   6 -12.560  -0.953   1.217
  349    HA   ASP   6           HA       ASP   6 -10.033   0.321   0.848
  350   1HB   ASP   6          1HB       ASP   6 -12.462   1.058   2.495
  351   2HB   ASP   6          2HB       ASP   6 -11.044   2.102   2.383
  352    H    GLY   7           H        GLY   7 -11.549  -1.120   3.724
  353   1HA   GLY   7          1HA       GLY   7  -9.593  -0.304   5.623
  354   2HA   GLY   7          2HA       GLY   7 -10.625  -1.725   5.789
  355    H    ILE   8           H        ILE   8  -9.809  -3.326   3.716
  356    HA   ILE   8           HA       ILE   8  -7.333  -4.396   4.722
  357    HB   ILE   8           HB       ILE   8  -8.764  -4.993   2.116
  358   1HG1  ILE   8          1HG1      ILE   8  -8.903  -6.419   4.792
  359   2HG1  ILE   8          2HG1      ILE   8 -10.126  -5.288   4.212
  360   1HG2  ILE   8          1HG2      ILE   8  -7.552  -7.182   2.344
  361   2HG2  ILE   8          2HG2      ILE   8  -6.652  -6.492   3.694
  362   3HG2  ILE   8          3HG2      ILE   8  -6.475  -5.813   2.077
  363   1HD1  ILE   8          1HD1      ILE   8  -9.344  -7.950   3.004
  364   2HD1  ILE   8          2HD1      ILE   8 -10.313  -6.759   2.135
  365   3HD1  ILE   8          3HD1      ILE   8 -10.921  -7.467   3.631
  366    H    LEU   9           H        LEU   9  -8.114  -2.665   1.685
  367    HA   LEU   9           HA       LEU   9  -5.415  -2.686   0.711
  368   1HB   LEU   9          1HB       LEU   9  -7.630  -0.696   0.134
  369   2HB   LEU   9          2HB       LEU   9  -6.174  -0.923  -0.832
  370    HG   LEU   9           HG       LEU   9  -8.060  -3.221  -0.279
  371   1HD1  LEU   9          1HD1      LEU   9  -9.122  -2.737  -2.462
  372   2HD1  LEU   9          2HD1      LEU   9  -8.180  -1.250  -2.582
  373   3HD1  LEU   9          3HD1      LEU   9  -9.389  -1.427  -1.310
  374   1HD2  LEU   9          1HD2      LEU   9  -5.951  -2.619  -2.379
  375   2HD2  LEU   9          2HD2      LEU   9  -7.081  -3.964  -2.508
  376   3HD2  LEU   9          3HD2      LEU   9  -5.931  -3.909  -1.177
  377    H    PHE  10           H        PHE  10  -7.236  -0.334   2.668
  378    HA   PHE  10           HA       PHE  10  -5.250   1.707   2.698
  379   1HB   PHE  10          1HB       PHE  10  -7.551   2.059   3.514
  380   2HB   PHE  10          2HB       PHE  10  -7.238   0.969   4.866
  381    HD1  PHE  10           HD1      PHE  10  -6.086   1.715   6.814
  382    HD2  PHE  10           HD2      PHE  10  -6.190   4.182   3.299
  383    HE1  PHE  10           HE1      PHE  10  -5.120   3.598   8.107
  384    HE2  PHE  10           HE2      PHE  10  -5.224   6.064   4.592
  385    HZ   PHE  10           HZ       PHE  10  -4.688   5.773   6.996
  386    H    ILE  11           H        ILE  11  -5.868  -0.862   5.121
  387    HA   ILE  11           HA       ILE  11  -3.652  -0.289   6.782
  388    HB   ILE  11           HB       ILE  11  -4.960  -2.952   6.152
  389   1HG1  ILE  11          1HG1      ILE  11  -5.272  -1.125   8.552
  390   2HG1  ILE  11          2HG1      ILE  11  -6.360  -1.093   7.164
  391   1HG2  ILE  11          1HG2      ILE  11  -2.945  -2.133   8.256
  392   2HG2  ILE  11          2HG2      ILE  11  -2.813  -3.445   7.087
  393   3HG2  ILE  11          3HG2      ILE  11  -3.959  -3.565   8.420
  394   1HD1  ILE  11          1HD1      ILE  11  -5.866  -3.400   9.062
  395   2HD1  ILE  11          2HD1      ILE  11  -6.741  -3.574   7.541
  396   3HD1  ILE  11          3HD1      ILE  11  -7.375  -2.524   8.806
  397    H    TYR  12           H        TYR  12  -3.852  -2.231   3.824
  398    HA   TYR  12           HA       TYR  12  -1.221  -3.324   3.905
  399   1HB   TYR  12          1HB       TYR  12  -2.912  -4.097   2.298
  400   2HB   TYR  12          2HB       TYR  12  -2.895  -2.521   1.506
  401    HD1  TYR  12           HD1      TYR  12  -0.971  -5.610   2.141
  402    HD2  TYR  12           HD2      TYR  12  -1.046  -1.835   0.090
  403    HE1  TYR  12           HE1      TYR  12   0.951  -6.329   0.748
  404    HE2  TYR  12           HE2      TYR  12   0.878  -2.553  -1.304
  405    HH   TYR  12           HH       TYR  12   2.524  -5.637  -0.709
  406    H    GLY  13           H        GLY  13  -2.436  -0.228   2.639
  407   1HA   GLY  13          1HA       GLY  13   0.012   0.638   1.459
  408   2HA   GLY  13          2HA       GLY  13  -1.273   1.711   2.017
  409    H    VAL  14           H        VAL  14  -1.260   1.029   4.763
  410    HA   VAL  14           HA       VAL  14   0.928   2.666   5.678
  411    HB   VAL  14           HB       VAL  14  -0.922   0.863   7.267
  412   1HG1  VAL  14          1HG1      VAL  14  -0.347   2.586   9.073
  413   2HG1  VAL  14          2HG1      VAL  14   0.977   3.091   8.024
  414   3HG1  VAL  14          3HG1      VAL  14   0.931   1.444   8.654
  415   1HG2  VAL  14          1HG2      VAL  14  -2.338   2.780   7.515
  416   2HG2  VAL  14          2HG2      VAL  14  -1.975   2.665   5.793
  417   3HG2  VAL  14          3HG2      VAL  14  -1.133   3.848   6.795
  418    H    ILE  15           H        ILE  15   0.298  -0.848   5.890
  419    HA   ILE  15           HA       ILE  15   2.719  -1.419   7.338
  420    HB   ILE  15           HB       ILE  15   1.073  -3.224   5.539
  421   1HG1  ILE  15          1HG1      ILE  15   1.051  -2.913   8.559
  422   2HG1  ILE  15          2HG1      ILE  15  -0.131  -2.165   7.484
  423   1HG2  ILE  15          1HG2      ILE  15   2.145  -5.022   6.965
  424   2HG2  ILE  15          2HG2      ILE  15   3.227  -3.782   7.599
  425   3HG2  ILE  15          3HG2      ILE  15   3.262  -4.190   5.884
  426   1HD1  ILE  15          1HD1      ILE  15  -1.022  -4.276   8.354
  427   2HD1  ILE  15          2HD1      ILE  15   0.397  -5.138   7.761
  428   3HD1  ILE  15          3HD1      ILE  15  -0.736  -4.416   6.620
  429    H    LEU  16           H        LEU  16   1.947  -1.329   3.863
  430    HA   LEU  16           HA       LEU  16   4.528  -2.349   3.053
  431   1HB   LEU  16          1HB       LEU  16   2.213  -2.076   1.734
  432   2HB   LEU  16          2HB       LEU  16   2.929  -0.544   1.259
  433    HG   LEU  16           HG       LEU  16   3.505  -2.143  -0.435
  434   1HD1  LEU  16          1HD1      LEU  16   5.849  -1.925  -0.486
  435   2HD1  LEU  16          2HD1      LEU  16   5.991  -2.040   1.267
  436   3HD1  LEU  16          3HD1      LEU  16   5.320  -0.587   0.530
  437   1HD2  LEU  16          1HD2      LEU  16   4.213  -4.324  -0.088
  438   2HD2  LEU  16          2HD2      LEU  16   3.191  -4.119   1.330
  439   3HD2  LEU  16          3HD2      LEU  16   4.942  -3.970   1.475
  440    H    THR  17           H        THR  17   3.193   0.903   3.532
  441    HA   THR  17           HA       THR  17   5.514   2.298   2.542
  442    HB   THR  17           HB       THR  17   3.483   3.266   4.574
  443    HG1  THR  17           HG1      THR  17   3.479   3.413   1.742
  444   1HG2  THR  17          1HG2      THR  17   5.284   4.724   2.621
  445   2HG2  THR  17          2HG2      THR  17   5.487   4.673   4.372
  446   3HG2  THR  17          3HG2      THR  17   4.088   5.486   3.670
  447    H    ALA  18           H        ALA  18   4.529   1.192   5.772
  448    HA   ALA  18           HA       ALA  18   6.605   2.449   7.255
  449   1HB   ALA  18          1HB       ALA  18   6.247   0.469   8.852
  450   2HB   ALA  18          2HB       ALA  18   5.045  -0.102   7.694
  451   3HB   ALA  18          3HB       ALA  18   4.829   1.456   8.492
  452    H    LEU  19           H        LEU  19   6.512  -0.836   5.825
  453    HA   LEU  19           HA       LEU  19   9.185  -1.538   6.567
  454   1HB   LEU  19          1HB       LEU  19   7.594  -2.463   4.155
  455   2HB   LEU  19          2HB       LEU  19   9.005  -3.273   4.830
  456    HG   LEU  19           HG       LEU  19   6.463  -2.748   6.398
  457   1HD1  LEU  19          1HD1      LEU  19   5.982  -4.252   4.518
  458   2HD1  LEU  19          2HD1      LEU  19   5.972  -5.152   6.035
  459   3HD1  LEU  19          3HD1      LEU  19   7.362  -5.261   4.954
  460   1HD2  LEU  19          1HD2      LEU  19   7.530  -4.726   7.738
  461   2HD2  LEU  19          2HD2      LEU  19   8.200  -3.113   7.953
  462   3HD2  LEU  19          3HD2      LEU  19   9.021  -4.274   6.913
  463    H    PHE  20           H        PHE  20   7.900   0.304   3.850
  464    HA   PHE  20           HA       PHE  20  10.315   0.300   2.291
  465   1HB   PHE  20          1HB       PHE  20   8.174   0.974   1.312
  466   2HB   PHE  20          2HB       PHE  20   8.067   2.337   2.428
  467    HD1  PHE  20           HD1      PHE  20   9.237   4.372   2.015
  468    HD2  PHE  20           HD2      PHE  20  10.048   0.898  -0.375
  469    HE1  PHE  20           HE1      PHE  20  10.578   5.758   0.458
  470    HE2  PHE  20           HE2      PHE  20  11.390   2.284  -1.934
  471    HZ   PHE  20           HZ       PHE  20  11.653   4.715  -1.517
  472    H    LEU  21           H        LEU  21   8.998   2.694   4.609
  473    HA   LEU  21           HA       LEU  21  11.255   4.448   4.510
  474   1HB   LEU  21          1HB       LEU  21   9.376   3.926   6.834
  475   2HB   LEU  21          2HB       LEU  21  10.412   5.337   6.646
  476    HG   LEU  21           HG       LEU  21   8.280   4.555   4.638
  477   1HD1  LEU  21          1HD1      LEU  21   8.119   6.654   6.820
  478   2HD1  LEU  21          2HD1      LEU  21   7.333   5.076   6.901
  479   3HD1  LEU  21          3HD1      LEU  21   6.856   6.239   5.663
  480   1HD2  LEU  21          1HD2      LEU  21   8.561   7.090   4.137
  481   2HD2  LEU  21          2HD2      LEU  21   9.834   6.008   3.585
  482   3HD2  LEU  21          3HD2      LEU  21  10.066   6.965   5.047
  483    H    ARG  22           H        ARG  22  10.525   1.639   6.558
  484    HA   ARG  22           HA       ARG  22  12.655   1.807   8.379
  485   1HB   ARG  22          1HB       ARG  22  10.840   0.069   8.391
  486   2HB   ARG  22          2HB       ARG  22  11.660  -0.734   7.052
  487   1HG   ARG  22          1HG       ARG  22  13.707  -0.922   8.481
  488   2HG   ARG  22          2HG       ARG  22  12.785  -0.248   9.826
  489   1HD   ARG  22          1HD       ARG  22  12.064  -2.772   8.307
  490   2HD   ARG  22          2HD       ARG  22  12.822  -2.726   9.900
  491    HE   ARG  22           HE       ARG  22  10.542  -1.210  10.239
  492   1HH1  ARG  22          1HH1      ARG  22  11.276  -4.329   8.970
  493   2HH1  ARG  22          2HH1      ARG  22   9.766  -5.027   9.453
  494   1HH2  ARG  22          1HH2      ARG  22   8.567  -2.104  10.881
  495   2HH2  ARG  22          2HH2      ARG  22   8.234  -3.769  10.536
  496    H    VAL  23           H        VAL  23  12.662   0.597   5.041
  497    HA   VAL  23           HA       VAL  23  15.438  -0.248   5.133
  498    HB   VAL  23           HB       VAL  23  13.634   0.384   2.777
  499   1HG1  VAL  23          1HG1      VAL  23  16.376  -0.874   2.993
  500   2HG1  VAL  23          2HG1      VAL  23  15.882   0.491   1.990
  501   3HG1  VAL  23          3HG1      VAL  23  15.328  -1.137   1.599
  502   1HG2  VAL  23          1HG2      VAL  23  14.452  -2.311   3.890
  503   2HG2  VAL  23          2HG2      VAL  23  13.205  -1.974   2.689
  504   3HG2  VAL  23          3HG2      VAL  23  12.964  -1.495   4.371
  505    H    LYS  24           H        LYS  24  13.754   2.740   4.385
  506    HA   LYS  24           HA       LYS  24  15.792   4.107   2.976
  507   1HB   LYS  24          1HB       LYS  24  13.422   4.914   3.411
  508   2HB   LYS  24          2HB       LYS  24  13.947   5.345   5.036
  509   1HG   LYS  24          1HG       LYS  24  14.263   7.368   3.911
  510   2HG   LYS  24          2HG       LYS  24  15.865   6.650   3.773
  511   1HD   LYS  24          1HD       LYS  24  15.346   5.848   1.518
  512   2HD   LYS  24          2HD       LYS  24  13.694   6.445   1.661
  513   1HE   LYS  24          1HE       LYS  24  15.204   7.992   0.386
  514   2HE   LYS  24          2HE       LYS  24  14.476   8.737   1.810
  515   1HZ   LYS  24          1HZ       LYS  24  16.456   8.992   2.760
  516   2HZ   LYS  24          2HZ       LYS  24  17.133   8.648   1.240
  517   3HZ   LYS  24          3HZ       LYS  24  16.948   7.411   2.390
  518    H    PHE  25           H        PHE  25  15.314   3.665   6.467
  519    HA   PHE  25           HA       PHE  25  17.789   5.198   7.044
  520   1HB   PHE  25          1HB       PHE  25  15.802   3.823   8.881
  521   2HB   PHE  25          2HB       PHE  25  17.167   4.804   9.414
  522    HD1  PHE  25           HD1      PHE  25  17.213   7.236   9.012
  523    HD2  PHE  25           HD2      PHE  25  13.838   4.833   7.880
  524    HE1  PHE  25           HE1      PHE  25  15.844   9.286   8.738
  525    HE2  PHE  25           HE2      PHE  25  12.470   6.883   7.605
  526    HZ   PHE  25           HZ       PHE  25  13.473   9.110   8.036
  527    H    SER  26           H        SER  26  19.721   4.174   7.249
  528    HA   SER  26           HA       SER  26  19.900   1.282   7.028
  529   1HB   SER  26          1HB       SER  26  22.285   1.609   7.091
  530   2HB   SER  26          2HB       SER  26  21.610   2.933   6.146
  531    HG   SER  26           HG       SER  26  22.824   2.934   8.634
  532    H    ARG  27           H        ARG  27  19.733   3.551   9.650
  533    HA   ARG  27           HA       ARG  27  19.863   3.262  11.976
  534   1HB   ARG  27          1HB       ARG  27  18.912   0.545  11.043
  535   2HB   ARG  27          2HB       ARG  27  19.043   0.974  12.748
  536   1HG   ARG  27          1HG       ARG  27  17.529   2.892  12.382
  537   2HG   ARG  27          2HG       ARG  27  17.388   2.452  10.680
  538   1HD   ARG  27          1HD       ARG  27  16.505   0.216  11.385
  539   2HD   ARG  27          2HD       ARG  27  16.522   0.780  13.056
  540    HE   ARG  27           HE       ARG  27  15.044   2.709  11.730
  541   1HH1  ARG  27          1HH1      ARG  27  14.994  -0.726  12.010
  542   2HH1  ARG  27          2HH1      ARG  27  13.276  -0.850  11.823
  543   1HH2  ARG  27          1HH2      ARG  27  12.799   2.568  11.487
  544   2HH2  ARG  27          2HH2      ARG  27  12.034   1.015  11.527
  545    H    SER  28           H        SER  28  20.630  -0.102  11.770
  546    HA   SER  28           HA       SER  28  23.072   0.210  13.227
  547   1HB   SER  28          1HB       SER  28  23.299  -2.132  13.054
  548   2HB   SER  28          2HB       SER  28  21.556  -1.880  12.983
  549    HG   SER  28           HG       SER  28  23.199  -1.981  10.676
  550    H    ALA  29           H        ALA  29  25.235  -0.568  12.389
  551    HA   ALA  29           HA       ALA  29  25.688  -0.230   9.493
  552   1HB   ALA  29          1HB       ALA  29  25.735   2.090  10.525
  553   2HB   ALA  29          2HB       ALA  29  27.221   1.613   9.704
  554   3HB   ALA  29          3HB       ALA  29  27.130   1.562  11.465
  555    H    ASP  30           H        ASP  30  27.819  -0.984   8.875
  556    HA   ASP  30           HA       ASP  30  29.543  -2.576   9.043
  557   1HB   ASP  30          1HB       ASP  30  30.468  -0.596  10.314
  558   2HB   ASP  30          2HB       ASP  30  29.894  -1.359  11.797
  Start of MODEL    4
    1   1H    ASP  -3          1H        ASP  -3 -22.643   7.367  -6.198
    2    HA   ASP  -3           HA       ASP  -3 -24.229   5.099  -7.176
    3   1HB   ASP  -3          1HB       ASP  -3 -24.480   7.967  -8.141
    4   2HB   ASP  -3          2HB       ASP  -3 -25.179   6.556  -8.938
    5    H    SER  -2           H        SER  -2 -23.702   5.245  -9.749
    6    HA   SER  -2           HA       SER  -2 -21.970   4.839 -11.287
    7   1HB   SER  -2          1HB       SER  -2 -20.739   7.298 -10.021
    8   2HB   SER  -2          2HB       SER  -2 -20.507   6.714 -11.666
    9    HG   SER  -2           HG       SER  -2 -22.883   7.724 -10.483
   10    H    LYS  -1           H        LYS  -1 -21.728   3.649  -8.562
   11    HA   LYS  -1           HA       LYS  -1 -20.126   2.519  -7.271
   12   1HB   LYS  -1          1HB       LYS  -1 -18.651   2.672  -9.919
   13   2HB   LYS  -1          2HB       LYS  -1 -18.180   1.645  -8.566
   14   1HG   LYS  -1          1HG       LYS  -1 -20.437   0.570  -8.658
   15   2HG   LYS  -1          2HG       LYS  -1 -20.790   1.519 -10.101
   16   1HD   LYS  -1          1HD       LYS  -1 -18.808   0.514 -11.218
   17   2HD   LYS  -1          2HD       LYS  -1 -18.535  -0.485  -9.790
   18   1HE   LYS  -1          1HE       LYS  -1 -20.872  -0.569 -11.702
   19   2HE   LYS  -1          2HE       LYS  -1 -19.764  -1.873 -11.275
   20   1HZ   LYS  -1          1HZ       LYS  -1 -20.643  -1.854  -9.034
   21   2HZ   LYS  -1          2HZ       LYS  -1 -21.896  -2.100 -10.154
   22   3HZ   LYS  -1          3HZ       LYS  -1 -21.693  -0.579  -9.425
   23    H    LEU   1           H        LEU   1 -20.093   5.164  -6.664
   24    HA   LEU   1           HA       LEU   1 -17.652   6.558  -7.084
   25   1HB   LEU   1          1HB       LEU   1 -19.612   7.688  -6.180
   26   2HB   LEU   1          2HB       LEU   1 -19.597   6.649  -4.758
   27    HG   LEU   1           HG       LEU   1 -17.487   7.602  -4.014
   28   1HD1  LEU   1          1HD1      LEU   1 -16.637   9.646  -5.404
   29   2HD1  LEU   1          2HD1      LEU   1 -17.542   8.916  -6.730
   30   3HD1  LEU   1          3HD1      LEU   1 -16.231   8.023  -5.959
   31   1HD2  LEU   1          1HD2      LEU   1 -18.217   9.867  -3.546
   32   2HD2  LEU   1          2HD2      LEU   1 -19.638   8.820  -3.541
   33   3HD2  LEU   1          3HD2      LEU   1 -19.305   9.848  -4.935
   34    H    CYS   2           H        CYS   2 -18.601   4.231  -4.569
   35    HA   CYS   2           HA       CYS   2 -16.329   4.459  -2.900
   36   1HB   CYS   2          1HB       CYS   2 -18.412   3.083  -2.458
   37   2HB   CYS   2          2HB       CYS   2 -17.752   1.866  -3.552
   38    H    TYR   3           H        TYR   3 -16.784   2.588  -5.888
   39    HA   TYR   3           HA       TYR   3 -14.417   1.064  -5.839
   40   1HB   TYR   3          1HB       TYR   3 -16.182   0.867  -7.584
   41   2HB   TYR   3          2HB       TYR   3 -15.648   2.403  -8.268
   42    HD1  TYR   3           HD1      TYR   3 -14.436  -1.019  -7.364
   43    HD2  TYR   3           HD2      TYR   3 -13.854   2.467  -9.808
   44    HE1  TYR   3           HE1      TYR   3 -12.672  -2.206  -8.640
   45    HE2  TYR   3           HE2      TYR   3 -12.090   1.278 -11.083
   46    HH   TYR   3           HH       TYR   3 -10.434  -0.873 -10.359
   47    H    LEU   4           H        LEU   4 -14.827   4.490  -6.249
   48    HA   LEU   4           HA       LEU   4 -12.351   5.055  -7.579
   49   1HB   LEU   4          1HB       LEU   4 -14.295   6.661  -7.254
   50   2HB   LEU   4          2HB       LEU   4 -13.771   6.833  -5.582
   51    HG   LEU   4           HG       LEU   4 -11.426   7.389  -6.625
   52   1HD1  LEU   4          1HD1      LEU   4 -11.840   6.859  -8.935
   53   2HD1  LEU   4          2HD1      LEU   4 -11.725   8.613  -8.828
   54   3HD1  LEU   4          3HD1      LEU   4 -13.303   7.844  -8.964
   55   1HD2  LEU   4          1HD2      LEU   4 -12.757   9.017  -5.386
   56   2HD2  LEU   4          2HD2      LEU   4 -13.781   9.294  -6.796
   57   3HD2  LEU   4          3HD2      LEU   4 -12.087   9.785  -6.826
   58    H    LEU   5           H        LEU   5 -13.213   4.717  -4.145
   59    HA   LEU   5           HA       LEU   5 -10.672   5.552  -3.110
   60   1HB   LEU   5          1HB       LEU   5 -12.916   3.848  -2.023
   61   2HB   LEU   5          2HB       LEU   5 -11.422   4.047  -1.110
   62    HG   LEU   5           HG       LEU   5 -11.723   6.537  -1.277
   63   1HD1  LEU   5          1HD1      LEU   5 -14.318   5.648  -2.555
   64   2HD1  LEU   5          2HD1      LEU   5 -13.120   6.770  -3.201
   65   3HD1  LEU   5          3HD1      LEU   5 -14.119   7.243  -1.829
   66   1HD2  LEU   5          1HD2      LEU   5 -12.443   5.284   0.725
   67   2HD2  LEU   5          2HD2      LEU   5 -14.013   4.990  -0.021
   68   3HD2  LEU   5          3HD2      LEU   5 -13.533   6.633   0.404
   69    H    ASP   6           H        ASP   6 -11.951   2.344  -3.993
   70    HA   ASP   6           HA       ASP   6  -9.642   0.859  -3.194
   71   1HB   ASP   6          1HB       ASP   6 -11.787   0.333  -5.263
   72   2HB   ASP   6          2HB       ASP   6 -10.512  -0.831  -4.898
   73    H    GLY   7           H        GLY   7 -10.496   2.479  -6.235
   74   1HA   GLY   7          1HA       GLY   7  -8.365   1.503  -7.829
   75   2HA   GLY   7          2HA       GLY   7  -9.154   3.061  -8.068
   76    H    ILE   8           H        ILE   8  -8.488   4.523  -5.897
   77    HA   ILE   8           HA       ILE   8  -5.754   5.225  -6.386
   78    HB   ILE   8           HB       ILE   8  -7.530   5.942  -4.033
   79   1HG1  ILE   8          1HG1      ILE   8  -6.927   7.519  -6.552
   80   2HG1  ILE   8          2HG1      ILE   8  -8.374   6.530  -6.351
   81   1HG2  ILE   8          1HG2      ILE   8  -4.925   7.084  -5.077
   82   2HG2  ILE   8          2HG2      ILE   8  -5.232   6.407  -3.478
   83   3HG2  ILE   8          3HG2      ILE   8  -5.970   7.940  -3.943
   84   1HD1  ILE   8          1HD1      ILE   8  -8.664   8.990  -5.782
   85   2HD1  ILE   8          2HD1      ILE   8  -7.594   8.715  -4.405
   86   3HD1  ILE   8          3HD1      ILE   8  -9.136   7.865  -4.509
   87    H    LEU   9           H        LEU   9  -7.248   3.685  -3.508
   88    HA   LEU   9           HA       LEU   9  -4.819   3.243  -2.113
   89   1HB   LEU   9          1HB       LEU   9  -7.323   1.537  -2.089
   90   2HB   LEU   9          2HB       LEU   9  -6.060   1.519  -0.863
   91    HG   LEU   9           HG       LEU   9  -7.577   4.034  -1.600
   92   1HD1  LEU   9          1HD1      LEU   9  -9.144   2.275  -0.801
   93   2HD1  LEU   9          2HD1      LEU   9  -9.012   3.618   0.335
   94   3HD1  LEU   9          3HD1      LEU   9  -8.170   2.102   0.660
   95   1HD2  LEU   9          1HD2      LEU   9  -5.601   4.598  -0.409
   96   2HD2  LEU   9          2HD2      LEU   9  -5.743   3.206   0.664
   97   3HD2  LEU   9          3HD2      LEU   9  -6.852   4.565   0.830
   98    H    PHE  10           H        PHE  10  -6.517   1.169  -4.471
   99    HA   PHE  10           HA       PHE  10  -4.722  -1.045  -4.277
  100   1HB   PHE  10          1HB       PHE  10  -6.943  -1.117  -5.419
  101   2HB   PHE  10          2HB       PHE  10  -6.271  -0.131  -6.718
  102    HD1  PHE  10           HD1      PHE  10  -5.963  -3.388  -4.952
  103    HD2  PHE  10           HD2      PHE  10  -4.872  -1.081  -8.407
  104    HE1  PHE  10           HE1      PHE  10  -5.038  -5.426  -6.020
  105    HE2  PHE  10           HE2      PHE  10  -3.947  -3.120  -9.475
  106    HZ   PHE  10           HZ       PHE  10  -4.030  -5.292  -8.282
  107    H    ILE  11           H        ILE  11  -4.823   1.552  -6.749
  108    HA   ILE  11           HA       ILE  11  -2.446   0.866  -8.092
  109    HB   ILE  11           HB       ILE  11  -3.632   3.603  -7.545
  110   1HG1  ILE  11          1HG1      ILE  11  -3.716   1.916 -10.058
  111   2HG1  ILE  11          2HG1      ILE  11  -4.973   1.846  -8.823
  112   1HG2  ILE  11          1HG2      ILE  11  -1.343   3.966  -8.154
  113   2HG2  ILE  11          2HG2      ILE  11  -2.285   4.213  -9.625
  114   3HG2  ILE  11          3HG2      ILE  11  -1.403   2.705  -9.386
  115   1HD1  ILE  11          1HD1      ILE  11  -5.473   4.198  -9.111
  116   2HD1  ILE  11          2HD1      ILE  11  -5.490   3.438 -10.702
  117   3HD1  ILE  11          3HD1      ILE  11  -4.100   4.401 -10.199
  118    H    TYR  12           H        TYR  12  -2.895   2.748  -5.124
  119    HA   TYR  12           HA       TYR  12  -0.196   3.619  -4.819
  120   1HB   TYR  12          1HB       TYR  12  -1.990   4.537  -3.439
  121   2HB   TYR  12          2HB       TYR  12  -2.277   2.954  -2.714
  122    HD1  TYR  12           HD1      TYR  12  -0.844   2.081  -0.993
  123    HD2  TYR  12           HD2      TYR  12   0.139   5.753  -2.992
  124    HE1  TYR  12           HE1      TYR  12   0.905   2.537   0.706
  125    HE2  TYR  12           HE2      TYR  12   1.887   6.211  -1.293
  126    HH   TYR  12           HH       TYR  12   2.051   4.719   1.618
  127    H    GLY  13           H        GLY  13  -1.824   0.620  -3.814
  128   1HA   GLY  13          1HA       GLY  13   0.348  -0.473  -2.326
  129   2HA   GLY  13          2HA       GLY  13  -0.922  -1.422  -3.098
  130    H    VAL  14           H        VAL  14  -0.449  -0.677  -5.790
  131    HA   VAL  14           HA       VAL  14   1.705  -2.474  -6.444
  132    HB   VAL  14           HB       VAL  14   0.245  -0.476  -8.197
  133   1HG1  VAL  14          1HG1      VAL  14   0.979  -2.075 -10.014
  134   2HG1  VAL  14          2HG1      VAL  14   2.030  -2.842  -8.825
  135   3HG1  VAL  14          3HG1      VAL  14   2.291  -1.157  -9.277
  136   1HG2  VAL  14          1HG2      VAL  14  -1.293  -2.069  -7.177
  137   2HG2  VAL  14          2HG2      VAL  14  -0.232  -3.413  -7.602
  138   3HG2  VAL  14          3HG2      VAL  14  -1.058  -2.507  -8.869
  139    H    ILE  15           H        ILE  15   1.398   1.083  -6.701
  140    HA   ILE  15           HA       ILE  15   4.034   1.494  -7.737
  141    HB   ILE  15           HB       ILE  15   2.207   3.330  -6.164
  142   1HG1  ILE  15          1HG1      ILE  15   2.886   3.283  -9.118
  143   2HG1  ILE  15          2HG1      ILE  15   1.475   2.474  -8.437
  144   1HG2  ILE  15          1HG2      ILE  15   3.702   5.122  -7.234
  145   2HG2  ILE  15          2HG2      ILE  15   4.854   3.823  -7.544
  146   3HG2  ILE  15          3HG2      ILE  15   4.402   4.224  -5.888
  147   1HD1  ILE  15          1HD1      ILE  15   0.781   4.687  -7.447
  148   2HD1  ILE  15          2HD1      ILE  15   0.767   4.653  -9.210
  149   3HD1  ILE  15          3HD1      ILE  15   2.094   5.439  -8.353
  150    H    LEU  16           H        LEU  16   2.795   1.374  -4.404
  151    HA   LEU  16           HA       LEU  16   5.311   2.154  -3.216
  152   1HB   LEU  16          1HB       LEU  16   2.825   2.054  -2.240
  153   2HB   LEU  16          2HB       LEU  16   3.329   0.451  -1.728
  154    HG   LEU  16           HG       LEU  16   3.800   1.943   0.092
  155   1HD1  LEU  16          1HD1      LEU  16   6.479   1.656  -1.262
  156   2HD1  LEU  16          2HD1      LEU  16   5.589   0.255  -0.669
  157   3HD1  LEU  16          3HD1      LEU  16   6.091   1.518   0.451
  158   1HD2  LEU  16          1HD2      LEU  16   3.905   3.989  -1.612
  159   2HD2  LEU  16          2HD2      LEU  16   5.640   3.682  -1.535
  160   3HD2  LEU  16          3HD2      LEU  16   4.745   4.057  -0.067
  161    H    THR  17           H        THR  17   3.766  -0.988  -3.861
  162    HA   THR  17           HA       THR  17   5.805  -2.581  -2.630
  163    HB   THR  17           HB       THR  17   4.073  -3.363  -4.991
  164    HG1  THR  17           HG1      THR  17   3.552  -3.261  -2.212
  165   1HG2  THR  17          1HG2      THR  17   4.335  -5.613  -4.114
  166   2HG2  THR  17          2HG2      THR  17   5.226  -5.003  -2.720
  167   3HG2  THR  17          3HG2      THR  17   5.934  -4.902  -4.332
  168    H    ALA  18           H        ALA  18   5.426  -1.321  -5.930
  169    HA   ALA  18           HA       ALA  18   7.563  -2.721  -7.156
  170   1HB   ALA  18          1HB       ALA  18   7.675  -0.632  -8.656
  171   2HB   ALA  18          2HB       ALA  18   6.368   0.007  -7.660
  172   3HB   ALA  18          3HB       ALA  18   6.128  -1.476  -8.582
  173    H    LEU  19           H        LEU  19   7.610   0.456  -5.510
  174    HA   LEU  19           HA       LEU  19  10.428   0.881  -5.831
  175   1HB   LEU  19          1HB       LEU  19   8.585   1.891  -3.643
  176   2HB   LEU  19          2HB       LEU  19  10.174   2.548  -4.031
  177    HG   LEU  19           HG       LEU  19   7.870   2.420  -6.001
  178   1HD1  LEU  19          1HD1      LEU  19   7.642   4.851  -5.575
  179   2HD1  LEU  19          2HD1      LEU  19   8.857   4.732  -4.303
  180   3HD1  LEU  19          3HD1      LEU  19   7.311   3.903  -4.125
  181   1HD2  LEU  19          1HD2      LEU  19   9.857   2.603  -7.261
  182   2HD2  LEU  19          2HD2      LEU  19  10.657   3.593  -6.041
  183   3HD2  LEU  19          3HD2      LEU  19   9.386   4.285  -7.048
  184    H    PHE  20           H        PHE  20   8.549  -0.888  -3.429
  185    HA   PHE  20           HA       PHE  20  10.689  -1.220  -1.537
  186   1HB   PHE  20          1HB       PHE  20   8.346  -1.657  -0.938
  187   2HB   PHE  20          2HB       PHE  20   8.286  -2.990  -2.091
  188    HD1  PHE  20           HD1      PHE  20   9.643  -1.840   1.140
  189    HD2  PHE  20           HD2      PHE  20   9.429  -5.092  -1.655
  190    HE1  PHE  20           HE1      PHE  20  10.556  -3.377   2.859
  191    HE2  PHE  20           HE2      PHE  20  10.342  -6.631   0.062
  192    HZ   PHE  20           HZ       PHE  20  10.906  -5.773   2.319
  193    H    LEU  21           H        LEU  21   9.469  -3.399  -4.111
  194    HA   LEU  21           HA       LEU  21  11.492  -5.389  -3.746
  195   1HB   LEU  21          1HB       LEU  21  10.003  -4.654  -6.285
  196   2HB   LEU  21          2HB       LEU  21  10.860  -6.166  -5.997
  197    HG   LEU  21           HG       LEU  21   8.595  -5.202  -4.230
  198   1HD1  LEU  21          1HD1      LEU  21   8.534  -6.939  -6.708
  199   2HD1  LEU  21          2HD1      LEU  21   7.627  -5.456  -6.410
  200   3HD1  LEU  21          3HD1      LEU  21   7.236  -6.924  -5.515
  201   1HD2  LEU  21          1HD2      LEU  21  10.095  -7.811  -4.579
  202   2HD2  LEU  21          2HD2      LEU  21   8.502  -7.760  -3.830
  203   3HD2  LEU  21          3HD2      LEU  21   9.844  -6.883  -3.101
  204    H    ARG  22           H        ARG  22  11.369  -2.477  -5.777
  205    HA   ARG  22           HA       ARG  22  13.738  -2.927  -7.266
  206   1HB   ARG  22          1HB       ARG  22  12.082  -1.054  -7.628
  207   2HB   ARG  22          2HB       ARG  22  12.787  -0.242  -6.229
  208   1HG   ARG  22          1HG       ARG  22  15.028  -0.371  -7.373
  209   2HG   ARG  22          2HG       ARG  22  14.202  -0.989  -8.804
  210   1HD   ARG  22          1HD       ARG  22  14.511   1.426  -9.020
  211   2HD   ARG  22          2HD       ARG  22  12.793   1.066  -8.838
  212    HE   ARG  22           HE       ARG  22  13.640   1.529  -6.246
  213   1HH1  ARG  22          1HH1      ARG  22  13.839   3.172  -9.268
  214   2HH1  ARG  22          2HH1      ARG  22  13.824   4.753  -8.561
  215   1HH2  ARG  22          1HH2      ARG  22  13.618   3.584  -5.304
  216   2HH2  ARG  22          2HH2      ARG  22  13.700   4.987  -6.318
  217    H    VAL  23           H        VAL  23  13.308  -1.448  -4.050
  218    HA   VAL  23           HA       VAL  23  16.111  -0.841  -3.713
  219    HB   VAL  23           HB       VAL  23  13.915  -1.228  -1.656
  220   1HG1  VAL  23          1HG1      VAL  23  15.497   0.188  -0.250
  221   2HG1  VAL  23          2HG1      VAL  23  16.733  -0.140  -1.465
  222   3HG1  VAL  23          3HG1      VAL  23  16.028  -1.468  -0.544
  223   1HG2  VAL  23          1HG2      VAL  23  13.702   0.620  -3.435
  224   2HG2  VAL  23          2HG2      VAL  23  15.111   1.358  -2.675
  225   3HG2  VAL  23          3HG2      VAL  23  13.625   1.136  -1.751
  226    H    LYS  24           H        LYS  24  14.079  -3.627  -2.907
  227    HA   LYS  24           HA       LYS  24  15.913  -5.031  -1.263
  228   1HB   LYS  24          1HB       LYS  24  13.503  -5.661  -1.746
  229   2HB   LYS  24          2HB       LYS  24  14.060  -6.311  -3.289
  230   1HG   LYS  24          1HG       LYS  24  15.726  -7.707  -1.959
  231   2HG   LYS  24          2HG       LYS  24  14.845  -7.219  -0.511
  232   1HD   LYS  24          1HD       LYS  24  13.599  -8.604  -2.904
  233   2HD   LYS  24          2HD       LYS  24  14.059  -9.410  -1.404
  234   1HE   LYS  24          1HE       LYS  24  12.556  -7.649  -0.234
  235   2HE   LYS  24          2HE       LYS  24  11.893  -7.358  -1.842
  236   1HZ   LYS  24          1HZ       LYS  24  12.075 -10.138  -1.308
  237   2HZ   LYS  24          2HZ       LYS  24  10.713  -9.211  -1.722
  238   3HZ   LYS  24          3HZ       LYS  24  11.180  -9.362  -0.095
  239    H    PHE  25           H        PHE  25  15.593  -4.963  -4.810
  240    HA   PHE  25           HA       PHE  25  17.901  -6.762  -5.136
  241   1HB   PHE  25          1HB       PHE  25  16.290  -5.184  -7.168
  242   2HB   PHE  25          2HB       PHE  25  17.530  -6.376  -7.559
  243    HD1  PHE  25           HD1      PHE  25  14.063  -5.914  -7.051
  244    HD2  PHE  25           HD2      PHE  25  17.236  -8.723  -6.345
  245    HE1  PHE  25           HE1      PHE  25  12.400  -7.741  -6.841
  246    HE2  PHE  25           HE2      PHE  25  15.572 -10.549  -6.135
  247    HZ   PHE  25           HZ       PHE  25  13.154 -10.058  -6.383
  248    H    SER  26           H        SER  26  17.463  -3.819  -7.026
  249    HA   SER  26           HA       SER  26  19.785  -2.513  -5.751
  250   1HB   SER  26          1HB       SER  26  19.849  -3.173  -8.708
  251   2HB   SER  26          2HB       SER  26  21.125  -2.426  -7.751
  252    HG   SER  26           HG       SER  26  21.113  -4.847  -8.225
  253    H    ARG  27           H        ARG  27  19.899  -0.270  -6.303
  254    HA   ARG  27           HA       ARG  27  17.411   0.990  -6.886
  255   1HB   ARG  27          1HB       ARG  27  20.230   2.092  -7.102
  256   2HB   ARG  27          2HB       ARG  27  18.760   3.067  -7.108
  257   1HG   ARG  27          1HG       ARG  27  18.173   2.151  -4.870
  258   2HG   ARG  27          2HG       ARG  27  19.696   1.260  -4.861
  259   1HD   ARG  27          1HD       ARG  27  19.895   3.391  -3.618
  260   2HD   ARG  27          2HD       ARG  27  20.948   3.370  -5.034
  261    HE   ARG  27           HE       ARG  27  18.616   4.542  -5.962
  262   1HH1  ARG  27          1HH1      ARG  27  20.794   5.042  -3.337
  263   2HH1  ARG  27          2HH1      ARG  27  20.535   6.754  -3.275
  264   1HH2  ARG  27          1HH2      ARG  27  18.267   6.772  -5.898
  265   2HH2  ARG  27          2HH2      ARG  27  19.105   7.734  -4.726
  266    H    SER  28           H        SER  28  20.160   0.145  -8.952
  267    HA   SER  28           HA       SER  28  18.836   1.358 -11.314
  268   1HB   SER  28          1HB       SER  28  21.236   1.683 -11.148
  269   2HB   SER  28          2HB       SER  28  21.499  -0.048 -10.951
  270    HG   SER  28           HG       SER  28  21.617  -0.068 -13.045
  271    H    ALA  29           H        ALA  29  18.123   0.103 -13.094
  272    HA   ALA  29           HA       ALA  29  18.355  -2.815 -13.035
  273   1HB   ALA  29          1HB       ALA  29  16.475  -2.358 -11.445
  274   2HB   ALA  29          2HB       ALA  29  15.969  -3.274 -12.865
  275   3HB   ALA  29          3HB       ALA  29  15.612  -1.551 -12.755
  276    H    ASP  30           H        ASP  30  17.657  -3.756 -15.048
  277    HA   ASP  30           HA       ASP  30  17.985  -2.072 -17.334
  278   1HB   ASP  30          1HB       ASP  30  17.111  -4.095 -18.595
  279   2HB   ASP  30          2HB       ASP  30  18.492  -4.413 -17.544
  280   1H    ASP  -3          1H        ASP  -3 -25.576  -6.720   5.041
  281    HA   ASP  -3           HA       ASP  -3 -22.784  -6.965   6.010
  282   1HB   ASP  -3          1HB       ASP  -3 -23.964  -7.705   3.313
  283   2HB   ASP  -3          2HB       ASP  -3 -22.251  -7.740   3.732
  284    H    SER  -2           H        SER  -2 -24.171  -4.598   6.259
  285    HA   SER  -2           HA       SER  -2 -24.035  -2.981   3.856
  286   1HB   SER  -2          1HB       SER  -2 -24.299  -2.276   6.788
  287   2HB   SER  -2          2HB       SER  -2 -24.312  -1.072   5.502
  288    HG   SER  -2           HG       SER  -2 -26.056  -3.307   5.708
  289    H    LYS  -1           H        LYS  -1 -22.612  -0.974   3.803
  290    HA   LYS  -1           HA       LYS  -1 -20.436  -0.116   3.623
  291   1HB   LYS  -1          1HB       LYS  -1 -20.131  -1.387   6.363
  292   2HB   LYS  -1          2HB       LYS  -1 -19.141  -0.090   5.695
  293   1HG   LYS  -1          1HG       LYS  -1 -21.241   1.297   5.488
  294   2HG   LYS  -1          2HG       LYS  -1 -22.089   0.034   6.381
  295   1HD   LYS  -1          1HD       LYS  -1 -20.476   0.308   8.254
  296   2HD   LYS  -1          2HD       LYS  -1 -19.701   1.622   7.371
  297   1HE   LYS  -1          1HE       LYS  -1 -21.249   2.627   8.919
  298   2HE   LYS  -1          2HE       LYS  -1 -21.949   2.781   7.307
  299   1HZ   LYS  -1          1HZ       LYS  -1 -23.340   1.855   9.306
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.590   0.392   8.875
  301   3HZ   LYS  -1          3HZ       LYS  -1 -23.538   1.231   7.741
  302    H    LEU   1           H        LEU   1 -20.952  -2.837   2.618
  303    HA   LEU   1           HA       LEU   1 -18.780  -4.584   3.285
  304   1HB   LEU   1          1HB       LEU   1 -20.873  -5.261   2.054
  305   2HB   LEU   1          2HB       LEU   1 -20.259  -4.404   0.644
  306    HG   LEU   1           HG       LEU   1 -18.189  -5.856   0.763
  307   1HD1  LEU   1          1HD1      LEU   1 -18.089  -6.755   2.924
  308   2HD1  LEU   1          2HD1      LEU   1 -18.741  -8.110   2.011
  309   3HD1  LEU   1          3HD1      LEU   1 -19.817  -7.102   2.975
  310   1HD2  LEU   1          1HD2      LEU   1 -20.807  -7.351   0.434
  311   2HD2  LEU   1          2HD2      LEU   1 -19.268  -7.741  -0.334
  312   3HD2  LEU   1          3HD2      LEU   1 -20.125  -6.266  -0.777
  313    H    CYS   2           H        CYS   2 -19.175  -2.070   0.810
  314    HA   CYS   2           HA       CYS   2 -16.727  -2.512  -0.574
  315   1HB   CYS   2          1HB       CYS   2 -18.575  -0.984  -1.330
  316   2HB   CYS   2          2HB       CYS   2 -18.077   0.160  -0.084
  317    H    TYR   3           H        TYR   3 -17.455  -0.771   2.410
  318    HA   TYR   3           HA       TYR   3 -14.964   0.582   2.706
  319   1HB   TYR   3          1HB       TYR   3 -17.034   0.933   4.119
  320   2HB   TYR   3          2HB       TYR   3 -16.640  -0.571   4.953
  321    HD1  TYR   3           HD1      TYR   3 -14.922  -0.658   6.611
  322    HD2  TYR   3           HD2      TYR   3 -15.381   2.838   4.158
  323    HE1  TYR   3           HE1      TYR   3 -13.317   0.564   8.051
  324    HE2  TYR   3           HE2      TYR   3 -13.776   4.060   5.600
  325    HH   TYR   3           HH       TYR   3 -11.854   2.461   7.974
  326    H    LEU   4           H        LEU   4 -15.848  -2.768   3.118
  327    HA   LEU   4           HA       LEU   4 -13.660  -3.544   4.807
  328   1HB   LEU   4          1HB       LEU   4 -15.721  -4.934   4.276
  329   2HB   LEU   4          2HB       LEU   4 -15.012  -5.243   2.693
  330    HG   LEU   4           HG       LEU   4 -12.910  -6.026   4.047
  331   1HD1  LEU   4          1HD1      LEU   4 -13.539  -5.323   6.267
  332   2HD1  LEU   4          2HD1      LEU   4 -13.616  -7.081   6.241
  333   3HD1  LEU   4          3HD1      LEU   4 -15.099  -6.137   6.145
  334   1HD2  LEU   4          1HD2      LEU   4 -14.189  -7.589   2.735
  335   2HD2  LEU   4          2HD2      LEU   4 -15.511  -7.575   3.903
  336   3HD2  LEU   4          3HD2      LEU   4 -13.967  -8.313   4.328
  337    H    LEU   5           H        LEU   5 -14.026  -3.293   1.281
  338    HA   LEU   5           HA       LEU   5 -11.484  -4.431   0.609
  339   1HB   LEU   5          1HB       LEU   5 -13.360  -2.524  -0.793
  340   2HB   LEU   5          2HB       LEU   5 -11.791  -2.913  -1.497
  341    HG   LEU   5           HG       LEU   5 -12.386  -5.347  -1.338
  342   1HD1  LEU   5          1HD1      LEU   5 -14.890  -5.782  -1.085
  343   2HD1  LEU   5          2HD1      LEU   5 -15.010  -4.155  -0.419
  344   3HD1  LEU   5          3HD1      LEU   5 -14.029  -5.372   0.397
  345   1HD2  LEU   5          1HD2      LEU   5 -13.989  -5.289  -3.229
  346   2HD2  LEU   5          2HD2      LEU   5 -12.705  -4.098  -3.435
  347   3HD2  LEU   5          3HD2      LEU   5 -14.304  -3.585  -2.896
  348    H    ASP   6           H        ASP   6 -12.503  -1.082   1.255
  349    HA   ASP   6           HA       ASP   6  -9.966   0.130   0.752
  350   1HB   ASP   6          1HB       ASP   6 -12.212   0.961   2.613
  351   2HB   ASP   6          2HB       ASP   6 -10.845   1.989   2.176
  352    H    GLY   7           H        GLY   7 -11.363  -1.353   3.654
  353   1HA   GLY   7          1HA       GLY   7  -9.354  -0.550   5.505
  354   2HA   GLY   7          2HA       GLY   7 -10.352  -1.994   5.673
  355    H    ILE   8           H        ILE   8  -9.600  -3.557   3.569
  356    HA   ILE   8           HA       ILE   8  -7.073  -4.604   4.428
  357    HB   ILE   8           HB       ILE   8  -8.603  -5.105   1.857
  358   1HG1  ILE   8          1HG1      ILE   8  -8.501  -6.710   4.433
  359   2HG1  ILE   8          2HG1      ILE   8  -9.804  -5.594   4.022
  360   1HG2  ILE   8          1HG2      ILE   8  -6.316  -5.829   1.582
  361   2HG2  ILE   8          2HG2      ILE   8  -7.282  -7.267   1.908
  362   3HG2  ILE   8          3HG2      ILE   8  -6.299  -6.557   3.188
  363   1HD1  ILE   8          1HD1      ILE   8  -8.973  -7.943   2.296
  364   2HD1  ILE   8          2HD1      ILE   8 -10.367  -6.893   2.048
  365   3HD1  ILE   8          3HD1      ILE   8 -10.317  -7.979   3.436
  366    H    LEU   9           H        LEU   9  -7.970  -2.775   1.479
  367    HA   LEU   9           HA       LEU   9  -5.314  -2.672   0.422
  368   1HB   LEU   9          1HB       LEU   9  -7.557  -0.660   0.072
  369   2HB   LEU   9          2HB       LEU   9  -6.145  -0.822  -0.967
  370    HG   LEU   9           HG       LEU   9  -8.008  -3.154  -0.486
  371   1HD1  LEU   9          1HD1      LEU   9  -9.057  -2.495  -2.697
  372   2HD1  LEU   9          2HD1      LEU   9  -8.260  -0.931  -2.525
  373   3HD1  LEU   9          3HD1      LEU   9  -9.461  -1.444  -1.340
  374   1HD2  LEU   9          1HD2      LEU   9  -5.921  -3.774  -1.521
  375   2HD2  LEU   9          2HD2      LEU   9  -5.997  -2.410  -2.635
  376   3HD2  LEU   9          3HD2      LEU   9  -7.132  -3.747  -2.799
  377    H    PHE  10           H        PHE  10  -7.087  -0.478   2.596
  378    HA   PHE  10           HA       PHE  10  -5.077   1.548   2.727
  379   1HB   PHE  10          1HB       PHE  10  -7.389   1.846   3.582
  380   2HB   PHE  10          2HB       PHE  10  -7.039   0.707   4.884
  381    HD1  PHE  10           HD1      PHE  10  -5.889   3.929   3.373
  382    HD2  PHE  10           HD2      PHE  10  -6.003   1.446   6.878
  383    HE1  PHE  10           HE1      PHE  10  -4.902   5.769   4.709
  384    HE2  PHE  10           HE2      PHE  10  -5.016   3.287   8.214
  385    HZ   PHE  10           HZ       PHE  10  -4.464   5.448   7.130
  386    H    ILE  11           H        ILE  11  -5.747  -1.113   5.040
  387    HA   ILE  11           HA       ILE  11  -3.491  -0.728   6.685
  388    HB   ILE  11           HB       ILE  11  -4.866  -3.310   5.876
  389   1HG1  ILE  11          1HG1      ILE  11  -5.104  -1.683   8.423
  390   2HG1  ILE  11          2HG1      ILE  11  -6.204  -1.501   7.057
  391   1HG2  ILE  11          1HG2      ILE  11  -2.800  -2.708   8.003
  392   2HG2  ILE  11          2HG2      ILE  11  -2.718  -3.924   6.729
  393   3HG2  ILE  11          3HG2      ILE  11  -3.847  -4.125   8.068
  394   1HD1  ILE  11          1HD1      ILE  11  -6.915  -3.804   7.234
  395   2HD1  ILE  11          2HD1      ILE  11  -7.033  -3.081   8.839
  396   3HD1  ILE  11          3HD1      ILE  11  -5.679  -4.141   8.447
  397    H    TYR  12           H        TYR  12  -3.791  -2.526   3.633
  398    HA   TYR  12           HA       TYR  12  -1.185  -3.647   3.567
  399   1HB   TYR  12          1HB       TYR  12  -2.952  -4.245   1.948
  400   2HB   TYR  12          2HB       TYR  12  -2.858  -2.630   1.248
  401    HD1  TYR  12           HD1      TYR  12  -1.149  -5.873   1.620
  402    HD2  TYR  12           HD2      TYR  12  -0.930  -1.937  -0.090
  403    HE1  TYR  12           HE1      TYR  12   0.719  -6.607   0.162
  404    HE2  TYR  12           HE2      TYR  12   0.935  -2.671  -1.544
  405    HH   TYR  12           HH       TYR  12   2.507  -5.739  -1.114
  406    H    GLY  13           H        GLY  13  -2.352  -0.454   2.503
  407   1HA   GLY  13          1HA       GLY  13   0.153   0.421   1.413
  408   2HA   GLY  13          2HA       GLY  13  -1.158   1.482   1.927
  409    H    VAL  14           H        VAL  14  -1.256   0.678   4.667
  410    HA   VAL  14           HA       VAL  14   0.806   2.357   5.752
  411    HB   VAL  14           HB       VAL  14  -1.047   0.376   7.106
  412   1HG1  VAL  14          1HG1      VAL  14   0.755   0.767   8.621
  413   2HG1  VAL  14          2HG1      VAL  14  -0.528   1.867   9.123
  414   3HG1  VAL  14          3HG1      VAL  14   0.841   2.476   8.192
  415   1HG2  VAL  14          1HG2      VAL  14  -2.128   2.269   5.874
  416   2HG2  VAL  14          2HG2      VAL  14  -1.192   3.398   6.854
  417   3HG2  VAL  14          3HG2      VAL  14  -2.388   2.350   7.616
  418    H    ILE  15           H        ILE  15   0.340  -1.191   5.925
  419    HA   ILE  15           HA       ILE  15   2.728  -1.731   7.375
  420    HB   ILE  15           HB       ILE  15   1.317  -3.490   5.344
  421   1HG1  ILE  15          1HG1      ILE  15   1.028  -3.376   8.364
  422   2HG1  ILE  15          2HG1      ILE  15  -0.098  -2.616   7.241
  423   1HG2  ILE  15          1HG2      ILE  15   3.545  -4.337   5.845
  424   2HG2  ILE  15          2HG2      ILE  15   2.363  -5.328   6.699
  425   3HG2  ILE  15          3HG2      ILE  15   3.283  -4.104   7.573
  426   1HD1  ILE  15          1HD1      ILE  15  -0.918  -4.837   7.932
  427   2HD1  ILE  15          2HD1      ILE  15   0.569  -5.573   7.336
  428   3HD1  ILE  15          3HD1      ILE  15  -0.553  -4.813   6.207
  429    H    LEU  16           H        LEU  16   2.156  -1.543   3.857
  430    HA   LEU  16           HA       LEU  16   4.823  -2.316   3.135
  431   1HB   LEU  16          1HB       LEU  16   2.472  -1.791   1.759
  432   2HB   LEU  16          2HB       LEU  16   3.461  -0.421   1.293
  433    HG   LEU  16           HG       LEU  16   3.911  -2.041  -0.356
  434   1HD1  LEU  16          1HD1      LEU  16   5.982  -1.154   1.128
  435   2HD1  LEU  16          2HD1      LEU  16   6.187  -2.222  -0.252
  436   3HD1  LEU  16          3HD1      LEU  16   6.192  -2.886   1.377
  437   1HD2  LEU  16          1HD2      LEU  16   2.799  -3.918   0.890
  438   2HD2  LEU  16          2HD2      LEU  16   4.289  -4.135   1.807
  439   3HD2  LEU  16          3HD2      LEU  16   4.280  -4.399   0.066
  440    H    THR  17           H        THR  17   3.300   0.868   3.621
  441    HA   THR  17           HA       THR  17   5.567   2.448   2.944
  442    HB   THR  17           HB       THR  17   3.490   3.117   5.044
  443    HG1  THR  17           HG1      THR  17   2.404   4.037   3.194
  444   1HG2  THR  17          1HG2      THR  17   5.452   4.636   4.844
  445   2HG2  THR  17          2HG2      THR  17   3.944   5.418   4.372
  446   3HG2  THR  17          3HG2      THR  17   5.073   4.860   3.137
  447    H    ALA  18           H        ALA  18   4.603   0.979   6.039
  448    HA   ALA  18           HA       ALA  18   6.610   2.195   7.654
  449   1HB   ALA  18          1HB       ALA  18   6.312   0.077   9.075
  450   2HB   ALA  18          2HB       ALA  18   5.143  -0.439   7.859
  451   3HB   ALA  18          3HB       ALA  18   4.864   1.038   8.780
  452    H    LEU  19           H        LEU  19   6.657  -0.967   5.974
  453    HA   LEU  19           HA       LEU  19   9.366  -1.597   6.673
  454   1HB   LEU  19          1HB       LEU  19   7.822  -2.462   4.210
  455   2HB   LEU  19          2HB       LEU  19   9.244  -3.259   4.879
  456    HG   LEU  19           HG       LEU  19   6.665  -2.877   6.427
  457   1HD1  LEU  19          1HD1      LEU  19   6.138  -5.195   5.890
  458   2HD1  LEU  19          2HD1      LEU  19   7.628  -5.351   4.960
  459   3HD1  LEU  19          3HD1      LEU  19   6.340  -4.288   4.390
  460   1HD2  LEU  19          1HD2      LEU  19   7.731  -4.876   7.694
  461   2HD2  LEU  19          2HD2      LEU  19   8.437  -3.285   7.956
  462   3HD2  LEU  19          3HD2      LEU  19   9.226  -4.430   6.873
  463    H    PHE  20           H        PHE  20   7.970   0.305   4.049
  464    HA   PHE  20           HA       PHE  20  10.371   0.483   2.480
  465   1HB   PHE  20          1HB       PHE  20   8.151   1.079   1.580
  466   2HB   PHE  20          2HB       PHE  20   8.064   2.443   2.696
  467    HD1  PHE  20           HD1      PHE  20   9.933   1.035  -0.196
  468    HD2  PHE  20           HD2      PHE  20   9.227   4.485   2.265
  469    HE1  PHE  20           HE1      PHE  20  11.199   2.440  -1.800
  470    HE2  PHE  20           HE2      PHE  20  10.493   5.890   0.660
  471    HZ   PHE  20           HZ       PHE  20  11.479   4.867  -1.372
  472    H    LEU  21           H        LEU  21   8.958   2.752   4.872
  473    HA   LEU  21           HA       LEU  21  11.156   4.589   4.796
  474   1HB   LEU  21          1HB       LEU  21   9.220   3.996   7.055
  475   2HB   LEU  21          2HB       LEU  21  10.267   5.409   6.964
  476    HG   LEU  21           HG       LEU  21   8.195   4.704   4.862
  477   1HD1  LEU  21          1HD1      LEU  21   7.100   5.194   7.003
  478   2HD1  LEU  21          2HD1      LEU  21   6.856   6.532   5.880
  479   3HD1  LEU  21          3HD1      LEU  21   8.051   6.670   7.170
  480   1HD2  LEU  21          1HD2      LEU  21   9.755   6.143   3.834
  481   2HD2  LEU  21          2HD2      LEU  21  10.068   7.032   5.322
  482   3HD2  LEU  21          3HD2      LEU  21   8.556   7.273   4.451
  483    H    ARG  22           H        ARG  22  10.515   1.733   6.812
  484    HA   ARG  22           HA       ARG  22  12.668   2.035   8.624
  485   1HB   ARG  22          1HB       ARG  22  10.924   0.319   8.907
  486   2HB   ARG  22          2HB       ARG  22  11.504  -0.520   7.470
  487   1HG   ARG  22          1HG       ARG  22  12.343  -1.567   9.563
  488   2HG   ARG  22          2HG       ARG  22  13.659  -0.964   8.561
  489   1HD   ARG  22          1HD       ARG  22  12.505   0.837  10.674
  490   2HD   ARG  22          2HD       ARG  22  13.622  -0.440  11.149
  491    HE   ARG  22           HE       ARG  22  14.908   0.820   9.039
  492   1HH1  ARG  22          1HH1      ARG  22  13.480   1.763  12.034
  493   2HH1  ARG  22          2HH1      ARG  22  14.560   3.095  12.280
  494   1HH2  ARG  22          1HH2      ARG  22  16.322   2.554   9.344
  495   2HH2  ARG  22          2HH2      ARG  22  16.169   3.542  10.758
  496    H    VAL  23           H        VAL  23  12.620   0.808   5.303
  497    HA   VAL  23           HA       VAL  23  15.449  -0.008   5.467
  498    HB   VAL  23           HB       VAL  23  13.552   0.121   3.103
  499   1HG1  VAL  23          1HG1      VAL  23  15.278  -1.447   2.111
  500   2HG1  VAL  23          2HG1      VAL  23  16.333  -1.025   3.461
  501   3HG1  VAL  23          3HG1      VAL  23  15.825   0.216   2.316
  502   1HG2  VAL  23          1HG2      VAL  23  13.280  -2.255   3.425
  503   2HG2  VAL  23          2HG2      VAL  23  12.979  -1.486   4.984
  504   3HG2  VAL  23          3HG2      VAL  23  14.522  -2.282   4.678
  505    H    LYS  24           H        LYS  24  13.538   2.703   4.300
  506    HA   LYS  24           HA       LYS  24  15.373   3.955   2.578
  507   1HB   LYS  24          1HB       LYS  24  13.028   4.732   3.097
  508   2HB   LYS  24          2HB       LYS  24  13.644   5.388   4.615
  509   1HG   LYS  24          1HG       LYS  24  15.280   6.756   3.314
  510   2HG   LYS  24          2HG       LYS  24  14.540   6.167   1.824
  511   1HD   LYS  24          1HD       LYS  24  12.350   7.087   2.599
  512   2HD   LYS  24          2HD       LYS  24  13.172   7.773   4.002
  513   1HE   LYS  24          1HE       LYS  24  14.008   8.370   1.155
  514   2HE   LYS  24          2HE       LYS  24  12.859   9.368   2.046
  515   1HZ   LYS  24          1HZ       LYS  24  15.537   9.668   2.098
  516   2HZ   LYS  24          2HZ       LYS  24  15.264   8.760   3.508
  517   3HZ   LYS  24          3HZ       LYS  24  14.474  10.248   3.285
  518    H    PHE  25           H        PHE  25  15.275   3.951   6.126
  519    HA   PHE  25           HA       PHE  25  17.758   5.601   6.205
  520   1HB   PHE  25          1HB       PHE  25  15.848   4.685   8.374
  521   2HB   PHE  25          2HB       PHE  25  17.324   5.601   8.681
  522    HD1  PHE  25           HD1      PHE  25  13.905   5.723   7.384
  523    HD2  PHE  25           HD2      PHE  25  17.567   7.920   7.842
  524    HE1  PHE  25           HE1      PHE  25  12.705   7.830   6.866
  525    HE2  PHE  25           HE2      PHE  25  16.367  10.028   7.323
  526    HZ   PHE  25           HZ       PHE  25  13.936   9.982   6.835
  527    H    SER  26           H        SER  26  19.702   4.652   6.618
  528    HA   SER  26           HA       SER  26  19.804   2.025   7.986
  529   1HB   SER  26          1HB       SER  26  21.112   0.979   6.230
  530   2HB   SER  26          2HB       SER  26  19.610   1.566   5.521
  531    HG   SER  26           HG       SER  26  21.931   2.086   4.630
  532    H    ARG  27           H        ARG  27  22.051   1.497   8.641
  533    HA   ARG  27           HA       ARG  27  24.081   3.601   8.360
  534   1HB   ARG  27          1HB       ARG  27  24.278   4.034  10.768
  535   2HB   ARG  27          2HB       ARG  27  22.660   4.458  10.206
  536   1HG   ARG  27          1HG       ARG  27  21.903   2.157  10.934
  537   2HG   ARG  27          2HG       ARG  27  23.486   1.947  11.685
  538   1HD   ARG  27          1HD       ARG  27  23.085   4.010  13.027
  539   2HD   ARG  27          2HD       ARG  27  21.467   4.114  12.334
  540    HE   ARG  27           HE       ARG  27  21.559   1.560  13.395
  541   1HH1  ARG  27          1HH1      ARG  27  22.202   4.755  14.527
  542   2HH1  ARG  27          2HH1      ARG  27  21.731   4.413  16.158
  543   1HH2  ARG  27          1HH2      ARG  27  20.940   1.098  15.520
  544   2HH2  ARG  27          2HH2      ARG  27  21.015   2.345  16.719
  545    H    SER  28           H        SER  28  26.116   2.930   9.570
  546    HA   SER  28           HA       SER  28  26.910   0.327   8.884
  547   1HB   SER  28          1HB       SER  28  27.999   1.950  11.201
  548   2HB   SER  28          2HB       SER  28  28.840   0.671  10.330
  549    HG   SER  28           HG       SER  28  27.825   2.610   8.694
  550    H    ALA  29           H        ALA  29  25.319   1.476  11.811
  551    HA   ALA  29           HA       ALA  29  24.492   0.300  13.669
  552   1HB   ALA  29          1HB       ALA  29  24.257  -1.807  11.500
  553   2HB   ALA  29          2HB       ALA  29  23.009  -0.668  12.007
  554   3HB   ALA  29          3HB       ALA  29  23.529  -1.951  13.100
  555    H    ASP  30           H        ASP  30  25.544  -2.771  12.466
  556    HA   ASP  30           HA       ASP  30  27.115  -3.329  14.783
  557   1HB   ASP  30          1HB       ASP  30  27.869  -5.322  13.554
  558   2HB   ASP  30          2HB       ASP  30  26.135  -5.090  13.340
  Start of MODEL    5
    1   1H    ASP  -3          1H        ASP  -3 -24.407   4.810  -6.734
    2    HA   ASP  -3           HA       ASP  -3 -24.177   7.681  -6.123
    3   1HB   ASP  -3          1HB       ASP  -3 -23.022   5.354  -4.566
    4   2HB   ASP  -3          2HB       ASP  -3 -22.368   6.990  -4.483
    5    H    SER  -2           H        SER  -2 -23.871   6.203  -8.584
    6    HA   SER  -2           HA       SER  -2 -22.274   5.758 -10.255
    7   1HB   SER  -2          1HB       SER  -2 -20.629   7.834  -8.797
    8   2HB   SER  -2          2HB       SER  -2 -20.632   7.474 -10.521
    9    HG   SER  -2           HG       SER  -2 -22.281   9.075  -9.055
   10    H    LYS  -1           H        LYS  -1 -21.993   4.439  -7.466
   11    HA   LYS  -1           HA       LYS  -1 -20.474   3.004  -6.396
   12   1HB   LYS  -1          1HB       LYS  -1 -19.391   2.878  -9.229
   13   2HB   LYS  -1          2HB       LYS  -1 -18.987   1.745  -7.938
   14   1HG   LYS  -1          1HG       LYS  -1 -21.418   1.193  -7.724
   15   2HG   LYS  -1          2HG       LYS  -1 -21.740   2.233  -9.113
   16   1HD   LYS  -1          1HD       LYS  -1 -20.107   0.831 -10.434
   17   2HD   LYS  -1          2HD       LYS  -1 -20.043  -0.277  -9.063
   18   1HE   LYS  -1          1HE       LYS  -1 -22.556   0.488 -10.581
   19   2HE   LYS  -1          2HE       LYS  -1 -21.683  -1.034 -10.754
   20   1HZ   LYS  -1          1HZ       LYS  -1 -22.990  -1.761  -9.125
   21   2HZ   LYS  -1          2HZ       LYS  -1 -23.506  -0.197  -8.706
   22   3HZ   LYS  -1          3HZ       LYS  -1 -22.053  -0.813  -8.076
   23    H    LEU   1           H        LEU   1 -19.830   5.691  -6.030
   24    HA   LEU   1           HA       LEU   1 -17.195   6.443  -6.790
   25   1HB   LEU   1          1HB       LEU   1 -18.880   7.972  -5.748
   26   2HB   LEU   1          2HB       LEU   1 -18.637   7.141  -4.214
   27    HG   LEU   1           HG       LEU   1 -16.201   7.747  -4.333
   28   1HD1  LEU   1          1HD1      LEU   1 -15.839   9.809  -5.948
   29   2HD1  LEU   1          2HD1      LEU   1 -17.158   9.077  -6.861
   30   3HD1  LEU   1          3HD1      LEU   1 -15.675   8.170  -6.570
   31   1HD2  LEU   1          1HD2      LEU   1 -16.542  10.026  -3.599
   32   2HD2  LEU   1          2HD2      LEU   1 -17.947   9.086  -3.096
   33   3HD2  LEU   1          3HD2      LEU   1 -18.050  10.142  -4.504
   34    H    CYS   2           H        CYS   2 -18.370   4.566  -4.007
   35    HA   CYS   2           HA       CYS   2 -16.051   4.360  -2.476
   36   1HB   CYS   2          1HB       CYS   2 -18.261   3.286  -1.953
   37   2HB   CYS   2          2HB       CYS   2 -17.885   2.038  -3.142
   38    H    TYR   3           H        TYR   3 -16.844   2.632  -5.474
   39    HA   TYR   3           HA       TYR   3 -14.627   0.847  -5.485
   40   1HB   TYR   3          1HB       TYR   3 -16.613   0.783  -7.048
   41   2HB   TYR   3          2HB       TYR   3 -15.890   2.135  -7.920
   42    HD1  TYR   3           HD1      TYR   3 -15.192  -1.343  -6.738
   43    HD2  TYR   3           HD2      TYR   3 -14.223   1.753  -9.554
   44    HE1  TYR   3           HE1      TYR   3 -13.745  -2.926  -7.984
   45    HE2  TYR   3           HE2      TYR   3 -12.777   0.169 -10.797
   46    HH   TYR   3           HH       TYR   3 -12.711  -3.246 -10.034
   47    H    LEU   4           H        LEU   4 -14.869   4.260  -6.246
   48    HA   LEU   4           HA       LEU   4 -12.412   4.497  -7.709
   49   1HB   LEU   4          1HB       LEU   4 -14.184   6.255  -7.642
   50   2HB   LEU   4          2HB       LEU   4 -13.779   6.562  -5.958
   51    HG   LEU   4           HG       LEU   4 -11.432   7.106  -6.673
   52   1HD1  LEU   4          1HD1      LEU   4 -12.649   6.542  -9.374
   53   2HD1  LEU   4          2HD1      LEU   4 -11.071   6.071  -8.742
   54   3HD1  LEU   4          3HD1      LEU   4 -11.359   7.736  -9.231
   55   1HD2  LEU   4          1HD2      LEU   4 -13.563   8.757  -8.061
   56   2HD2  LEU   4          2HD2      LEU   4 -11.995   9.323  -7.488
   57   3HD2  LEU   4          3HD2      LEU   4 -13.230   8.827  -6.331
   58    H    LEU   5           H        LEU   5 -13.192   4.679  -4.247
   59    HA   LEU   5           HA       LEU   5 -10.637   5.522  -3.324
   60   1HB   LEU   5          1HB       LEU   5 -12.872   3.911  -2.097
   61   2HB   LEU   5          2HB       LEU   5 -11.354   4.113  -1.223
   62    HG   LEU   5           HG       LEU   5 -11.580   6.581  -1.454
   63   1HD1  LEU   5          1HD1      LEU   5 -13.886   7.409  -2.115
   64   2HD1  LEU   5          2HD1      LEU   5 -14.207   5.793  -2.741
   65   3HD1  LEU   5          3HD1      LEU   5 -12.917   6.771  -3.443
   66   1HD2  LEU   5          1HD2      LEU   5 -12.458   5.315   0.531
   67   2HD2  LEU   5          2HD2      LEU   5 -14.040   5.282  -0.246
   68   3HD2  LEU   5          3HD2      LEU   5 -13.322   6.822   0.223
   69    H    ASP   6           H        ASP   6 -11.909   2.282  -4.032
   70    HA   ASP   6           HA       ASP   6  -9.609   0.828  -3.160
   71   1HB   ASP   6          1HB       ASP   6 -11.698   0.198  -5.261
   72   2HB   ASP   6          2HB       ASP   6 -10.477  -0.955  -4.720
   73    H    GLY   7           H        GLY   7 -10.436   2.316  -6.280
   74   1HA   GLY   7          1HA       GLY   7  -8.261   1.258  -7.782
   75   2HA   GLY   7          2HA       GLY   7  -9.082   2.777  -8.143
   76    H    ILE   8           H        ILE   8  -8.501   4.381  -6.038
   77    HA   ILE   8           HA       ILE   8  -5.801   5.176  -6.529
   78    HB   ILE   8           HB       ILE   8  -7.508   5.864  -4.118
   79   1HG1  ILE   8          1HG1      ILE   8  -7.317   7.230  -6.824
   80   2HG1  ILE   8          2HG1      ILE   8  -8.685   6.261  -6.275
   81   1HG2  ILE   8          1HG2      ILE   8  -5.257   7.362  -5.498
   82   2HG2  ILE   8          2HG2      ILE   8  -5.107   6.493  -3.970
   83   3HG2  ILE   8          3HG2      ILE   8  -6.150   7.910  -4.079
   84   1HD1  ILE   8          1HD1      ILE   8  -9.300   8.513  -5.814
   85   2HD1  ILE   8          2HD1      ILE   8  -7.706   8.895  -5.166
   86   3HD1  ILE   8          3HD1      ILE   8  -8.796   7.848  -4.260
   87    H    LEU   9           H        LEU   9  -7.237   3.554  -3.678
   88    HA   LEU   9           HA       LEU   9  -4.781   3.248  -2.264
   89   1HB   LEU   9          1HB       LEU   9  -7.235   1.469  -2.206
   90   2HB   LEU   9          2HB       LEU   9  -5.965   1.498  -0.986
   91    HG   LEU   9           HG       LEU   9  -7.493   4.001  -1.727
   92   1HD1  LEU   9          1HD1      LEU   9  -9.208   2.456  -1.051
   93   2HD1  LEU   9          2HD1      LEU   9  -8.881   3.503   0.332
   94   3HD1  LEU   9          3HD1      LEU   9  -8.226   1.866   0.292
   95   1HD2  LEU   9          1HD2      LEU   9  -5.843   3.107   0.658
   96   2HD2  LEU   9          2HD2      LEU   9  -6.868   4.539   0.687
   97   3HD2  LEU   9          3HD2      LEU   9  -5.516   4.452  -0.436
   98    H    PHE  10           H        PHE  10  -6.404   1.123  -4.616
   99    HA   PHE  10           HA       PHE  10  -4.561  -1.050  -4.389
  100   1HB   PHE  10          1HB       PHE  10  -6.790  -1.146  -5.549
  101   2HB   PHE  10          2HB       PHE  10  -6.085  -0.217  -6.872
  102    HD1  PHE  10           HD1      PHE  10  -5.765  -3.379  -4.929
  103    HD2  PHE  10           HD2      PHE  10  -4.718  -1.262  -8.518
  104    HE1  PHE  10           HE1      PHE  10  -4.825  -5.464  -5.885
  105    HE2  PHE  10           HE2      PHE  10  -3.778  -3.349  -9.474
  106    HZ   PHE  10           HZ       PHE  10  -3.831  -5.450  -8.158
  107    H    ILE  11           H        ILE  11  -4.696   1.555  -6.857
  108    HA   ILE  11           HA       ILE  11  -2.305   0.899  -8.193
  109    HB   ILE  11           HB       ILE  11  -3.508   3.630  -7.648
  110   1HG1  ILE  11          1HG1      ILE  11  -3.599   1.910 -10.143
  111   2HG1  ILE  11          2HG1      ILE  11  -4.870   1.906  -8.921
  112   1HG2  ILE  11          1HG2      ILE  11  -1.239   4.031  -8.257
  113   2HG2  ILE  11          2HG2      ILE  11  -2.156   4.219  -9.751
  114   3HG2  ILE  11          3HG2      ILE  11  -1.252   2.734  -9.452
  115   1HD1  ILE  11          1HD1      ILE  11  -5.496   3.455 -10.686
  116   2HD1  ILE  11          2HD1      ILE  11  -3.945   4.284 -10.558
  117   3HD1  ILE  11          3HD1      ILE  11  -5.107   4.380  -9.236
  118    H    TYR  12           H        TYR  12  -2.792   2.767  -5.224
  119    HA   TYR  12           HA       TYR  12  -0.111   3.674  -4.892
  120   1HB   TYR  12          1HB       TYR  12  -1.981   4.492  -3.508
  121   2HB   TYR  12          2HB       TYR  12  -2.137   2.898  -2.770
  122    HD1  TYR  12           HD1      TYR  12  -0.608   2.140  -1.078
  123    HD2  TYR  12           HD2      TYR  12   0.073   5.857  -3.121
  124    HE1  TYR  12           HE1      TYR  12   1.144   2.727   0.575
  125    HE2  TYR  12           HE2      TYR  12   1.826   6.444  -1.466
  126    HH   TYR  12           HH       TYR  12   2.199   4.853   1.459
  127    H    GLY  13           H        GLY  13  -1.698   0.649  -3.885
  128   1HA   GLY  13          1HA       GLY  13   0.533  -0.441  -2.474
  129   2HA   GLY  13          2HA       GLY  13  -0.767  -1.391  -3.192
  130    H    VAL  14           H        VAL  14  -0.396  -0.608  -5.902
  131    HA   VAL  14           HA       VAL  14   1.690  -2.429  -6.675
  132    HB   VAL  14           HB       VAL  14   0.152  -0.355  -8.264
  133   1HG1  VAL  14          1HG1      VAL  14   2.106  -2.503  -9.114
  134   2HG1  VAL  14          2HG1      VAL  14   2.149  -0.784  -9.503
  135   3HG1  VAL  14          3HG1      VAL  14   0.914  -1.819 -10.219
  136   1HG2  VAL  14          1HG2      VAL  14  -1.303  -2.075  -7.413
  137   2HG2  VAL  14          2HG2      VAL  14  -0.148  -3.339  -7.831
  138   3HG2  VAL  14          3HG2      VAL  14  -0.992  -2.460  -9.106
  139    H    ILE  15           H        ILE  15   1.492   1.135  -6.678
  140    HA   ILE  15           HA       ILE  15   4.148   1.473  -7.777
  141    HB   ILE  15           HB       ILE  15   2.452   3.421  -6.187
  142   1HG1  ILE  15          1HG1      ILE  15   2.776   3.122  -9.189
  143   2HG1  ILE  15          2HG1      ILE  15   1.407   2.478  -8.282
  144   1HG2  ILE  15          1HG2      ILE  15   4.865   3.786  -7.990
  145   2HG2  ILE  15          2HG2      ILE  15   4.776   4.135  -6.265
  146   3HG2  ILE  15          3HG2      ILE  15   3.857   5.111  -7.410
  147   1HD1  ILE  15          1HD1      ILE  15   2.231   5.395  -8.394
  148   2HD1  ILE  15          2HD1      ILE  15   0.866   4.751  -7.482
  149   3HD1  ILE  15          3HD1      ILE  15   0.861   4.682  -9.245
  150    H    LEU  16           H        LEU  16   2.842   1.471  -4.459
  151    HA   LEU  16           HA       LEU  16   5.340   2.214  -3.232
  152   1HB   LEU  16          1HB       LEU  16   2.831   2.122  -2.300
  153   2HB   LEU  16          2HB       LEU  16   3.333   0.527  -1.760
  154    HG   LEU  16           HG       LEU  16   3.764   2.054   0.044
  155   1HD1  LEU  16          1HD1      LEU  16   6.469   1.745  -1.248
  156   2HD1  LEU  16          2HD1      LEU  16   5.564   0.350  -0.660
  157   3HD1  LEU  16          3HD1      LEU  16   6.042   1.625   0.458
  158   1HD2  LEU  16          1HD2      LEU  16   4.696   4.168  -0.135
  159   2HD2  LEU  16          2HD2      LEU  16   3.914   4.067  -1.708
  160   3HD2  LEU  16          3HD2      LEU  16   5.645   3.765  -1.562
  161    H    THR  17           H        THR  17   3.830  -0.905  -4.009
  162    HA   THR  17           HA       THR  17   5.853  -2.502  -2.710
  163    HB   THR  17           HB       THR  17   4.076  -3.273  -5.044
  164    HG1  THR  17           HG1      THR  17   2.565  -2.985  -3.629
  165   1HG2  THR  17          1HG2      THR  17   5.919  -4.840  -4.582
  166   2HG2  THR  17          2HG2      THR  17   4.368  -5.548  -4.135
  167   3HG2  THR  17          3HG2      THR  17   5.438  -4.911  -2.886
  168    H    ALA  18           H        ALA  18   5.451  -1.301  -6.037
  169    HA   ALA  18           HA       ALA  18   7.603  -2.714  -7.226
  170   1HB   ALA  18          1HB       ALA  18   5.921  -1.339  -8.468
  171   2HB   ALA  18          2HB       ALA  18   7.582  -0.991  -8.943
  172   3HB   ALA  18          3HB       ALA  18   6.722   0.115  -7.872
  173    H    LEU  19           H        LEU  19   7.599   0.466  -5.598
  174    HA   LEU  19           HA       LEU  19  10.421   0.921  -5.951
  175   1HB   LEU  19          1HB       LEU  19   8.577   1.982  -3.787
  176   2HB   LEU  19          2HB       LEU  19  10.151   2.645  -4.215
  177    HG   LEU  19           HG       LEU  19   7.840   2.418  -6.166
  178   1HD1  LEU  19          1HD1      LEU  19   8.744   4.741  -4.441
  179   2HD1  LEU  19          2HD1      LEU  19   7.175   3.938  -4.403
  180   3HD1  LEU  19          3HD1      LEU  19   7.638   4.901  -5.806
  181   1HD2  LEU  19          1HD2      LEU  19   9.837   2.617  -7.418
  182   2HD2  LEU  19          2HD2      LEU  19  10.586   3.686  -6.234
  183   3HD2  LEU  19          3HD2      LEU  19   9.293   4.285  -7.271
  184    H    PHE  20           H        PHE  20   8.532  -0.748  -3.473
  185    HA   PHE  20           HA       PHE  20  10.659  -1.026  -1.573
  186   1HB   PHE  20          1HB       PHE  20   8.306  -1.461  -0.998
  187   2HB   PHE  20          2HB       PHE  20   8.287  -2.847  -2.086
  188    HD1  PHE  20           HD1      PHE  20   9.059  -4.963  -1.363
  189    HD2  PHE  20           HD2      PHE  20   9.972  -1.459   0.948
  190    HE1  PHE  20           HE1      PHE  20   9.967  -6.394   0.446
  191    HE2  PHE  20           HE2      PHE  20  10.880  -2.891   2.759
  192    HZ   PHE  20           HZ       PHE  20  10.877  -5.359   2.506
  193    H    LEU  21           H        LEU  21   9.462  -3.329  -4.052
  194    HA   LEU  21           HA       LEU  21  11.482  -5.287  -3.611
  195   1HB   LEU  21          1HB       LEU  21  10.047  -4.602  -6.195
  196   2HB   LEU  21          2HB       LEU  21  10.932  -6.094  -5.883
  197    HG   LEU  21           HG       LEU  21   8.556  -5.144  -4.249
  198   1HD1  LEU  21          1HD1      LEU  21   8.753  -7.137  -6.525
  199   2HD1  LEU  21          2HD1      LEU  21   7.790  -5.660  -6.483
  200   3HD1  LEU  21          3HD1      LEU  21   7.366  -7.020  -5.443
  201   1HD2  LEU  21          1HD2      LEU  21   9.751  -6.625  -2.865
  202   2HD2  LEU  21          2HD2      LEU  21  10.316  -7.600  -4.220
  203   3HD2  LEU  21          3HD2      LEU  21   8.641  -7.717  -3.686
  204    H    ARG  22           H        ARG  22  11.422  -2.448  -5.758
  205    HA   ARG  22           HA       ARG  22  13.838  -2.908  -7.144
  206   1HB   ARG  22          1HB       ARG  22  12.224  -1.014  -7.563
  207   2HB   ARG  22          2HB       ARG  22  12.876  -0.215  -6.132
  208   1HG   ARG  22          1HG       ARG  22  15.151  -0.315  -7.165
  209   2HG   ARG  22          2HG       ARG  22  14.422  -0.983  -8.626
  210   1HD   ARG  22          1HD       ARG  22  13.773   1.711  -7.391
  211   2HD   ARG  22          2HD       ARG  22  14.724   1.449  -8.852
  212    HE   ARG  22           HE       ARG  22  12.326   0.181  -9.401
  213   1HH1  ARG  22          1HH1      ARG  22  13.298   3.297  -8.292
  214   2HH1  ARG  22          2HH1      ARG  22  11.971   4.124  -9.038
  215   1HH2  ARG  22          1HH2      ARG  22  10.586   1.245 -10.382
  216   2HH2  ARG  22          2HH2      ARG  22  10.438   2.964 -10.219
  217    H    VAL  23           H        VAL  23  13.299  -1.500  -3.928
  218    HA   VAL  23           HA       VAL  23  16.074  -0.851  -3.469
  219    HB   VAL  23           HB       VAL  23  13.792  -1.340  -1.530
  220   1HG1  VAL  23          1HG1      VAL  23  16.610  -0.309  -1.149
  221   2HG1  VAL  23          2HG1      VAL  23  15.815  -1.634  -0.298
  222   3HG1  VAL  23          3HG1      VAL  23  15.317   0.031   0.002
  223   1HG2  VAL  23          1HG2      VAL  23  13.662   0.585  -3.224
  224   2HG2  VAL  23          2HG2      VAL  23  15.045   1.282  -2.380
  225   3HG2  VAL  23          3HG2      VAL  23  13.523   1.034  -1.524
  226    H    LYS  24           H        LYS  24  14.066  -3.696  -2.781
  227    HA   LYS  24           HA       LYS  24  15.870  -5.112  -1.132
  228   1HB   LYS  24          1HB       LYS  24  13.506  -5.798  -1.700
  229   2HB   LYS  24          2HB       LYS  24  14.095  -6.319  -3.274
  230   1HG   LYS  24          1HG       LYS  24  14.155  -8.313  -2.038
  231   2HG   LYS  24          2HG       LYS  24  15.814  -7.741  -1.903
  232   1HD   LYS  24          1HD       LYS  24  15.411  -6.863   0.311
  233   2HD   LYS  24          2HD       LYS  24  13.678  -7.149   0.167
  234   1HE   LYS  24          1HE       LYS  24  14.786  -8.905   1.519
  235   2HE   LYS  24          2HE       LYS  24  14.065  -9.568   0.051
  236   1HZ   LYS  24          1HZ       LYS  24  16.044 -10.234  -0.646
  237   2HZ   LYS  24          2HZ       LYS  24  16.689  -9.789   0.861
  238   3HZ   LYS  24          3HZ       LYS  24  16.717  -8.691  -0.436
  239    H    PHE  25           H        PHE  25  15.734  -4.859  -4.676
  240    HA   PHE  25           HA       PHE  25  18.576  -5.452  -4.855
  241   1HB   PHE  25          1HB       PHE  25  18.350  -7.486  -6.239
  242   2HB   PHE  25          2HB       PHE  25  17.695  -7.741  -4.622
  243    HD1  PHE  25           HD1      PHE  25  16.835  -7.157  -8.174
  244    HD2  PHE  25           HD2      PHE  25  15.329  -8.058  -4.252
  245    HE1  PHE  25           HE1      PHE  25  14.636  -7.749  -9.154
  246    HE2  PHE  25           HE2      PHE  25  13.129  -8.650  -5.234
  247    HZ   PHE  25           HZ       PHE  25  12.782  -8.495  -7.684
  248    H    SER  26           H        SER  26  19.274  -5.451  -7.207
  249    HA   SER  26           HA       SER  26  17.368  -4.340  -9.145
  250   1HB   SER  26          1HB       SER  26  19.631  -2.678  -8.001
  251   2HB   SER  26          2HB       SER  26  18.808  -2.289  -9.510
  252    HG   SER  26           HG       SER  26  18.005  -1.936  -6.932
  253    H    ARG  27           H        ARG  27  20.457  -5.618  -8.250
  254    HA   ARG  27           HA       ARG  27  21.914  -5.409 -10.655
  255   1HB   ARG  27          1HB       ARG  27  22.781  -6.375  -8.513
  256   2HB   ARG  27          2HB       ARG  27  21.815  -7.819  -8.813
  257   1HG   ARG  27          1HG       ARG  27  23.017  -8.173 -10.946
  258   2HG   ARG  27          2HG       ARG  27  23.999  -6.744 -10.622
  259   1HD   ARG  27          1HD       ARG  27  23.860  -9.187  -8.830
  260   2HD   ARG  27          2HD       ARG  27  25.160  -8.849  -9.972
  261    HE   ARG  27           HE       ARG  27  25.028  -6.567  -8.392
  262   1HH1  ARG  27          1HH1      ARG  27  25.354  -9.966  -7.884
  263   2HH1  ARG  27          2HH1      ARG  27  26.285  -9.790  -6.435
  264   1HH2  ARG  27          1HH2      ARG  27  26.242  -6.326  -6.500
  265   2HH2  ARG  27          2HH2      ARG  27  26.786  -7.736  -5.653
  266    H    SER  28           H        SER  28  19.428  -7.773  -9.706
  267    HA   SER  28           HA       SER  28  19.609  -9.377 -12.076
  268   1HB   SER  28          1HB       SER  28  17.089  -8.918 -10.469
  269   2HB   SER  28          2HB       SER  28  17.540 -10.351 -11.388
  270    HG   SER  28           HG       SER  28  17.873 -10.251  -8.958
  271    H    ALA  29           H        ALA  29  17.821  -6.431 -11.291
  272    HA   ALA  29           HA       ALA  29  16.004  -6.321 -13.414
  273   1HB   ALA  29          1HB       ALA  29  17.602  -3.889 -12.610
  274   2HB   ALA  29          2HB       ALA  29  16.434  -4.614 -11.506
  275   3HB   ALA  29          3HB       ALA  29  15.901  -3.989 -13.067
  276    H    ASP  30           H        ASP  30  16.142  -5.748 -15.592
  277    HA   ASP  30           HA       ASP  30  18.643  -4.795 -16.760
  278   1HB   ASP  30          1HB       ASP  30  19.265  -7.122 -16.575
  279   2HB   ASP  30          2HB       ASP  30  17.708  -7.644 -17.214
  280   1H    ASP  -3          1H        ASP  -3 -25.540   2.088   4.860
  281    HA   ASP  -3           HA       ASP  -3 -26.245   0.199   6.531
  282   1HB   ASP  -3          1HB       ASP  -3 -27.137  -1.029   4.549
  283   2HB   ASP  -3          2HB       ASP  -3 -27.400   0.712   4.441
  284    H    SER  -2           H        SER  -2 -25.428  -1.852   4.038
  285    HA   SER  -2           HA       SER  -2 -23.981  -3.664   5.660
  286   1HB   SER  -2          1HB       SER  -2 -23.707  -3.428   2.653
  287   2HB   SER  -2          2HB       SER  -2 -23.493  -4.874   3.637
  288    HG   SER  -2           HG       SER  -2 -25.737  -3.849   2.579
  289    H    LYS  -1           H        LYS  -1 -22.854  -1.015   3.614
  290    HA   LYS  -1           HA       LYS  -1 -20.705  -0.108   3.327
  291   1HB   LYS  -1          1HB       LYS  -1 -20.543  -1.138   6.173
  292   2HB   LYS  -1          2HB       LYS  -1 -19.324  -0.099   5.435
  293   1HG   LYS  -1          1HG       LYS  -1 -21.065   1.609   4.992
  294   2HG   LYS  -1          2HG       LYS  -1 -22.261   0.578   5.778
  295   1HD   LYS  -1          1HD       LYS  -1 -20.807   0.620   7.847
  296   2HD   LYS  -1          2HD       LYS  -1 -19.819   1.844   7.048
  297   1HE   LYS  -1          1HE       LYS  -1 -21.389   3.059   8.370
  298   2HE   LYS  -1          2HE       LYS  -1 -21.984   3.167   6.714
  299   1HZ   LYS  -1          1HZ       LYS  -1 -23.296   2.128   8.943
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.994   0.829   7.890
  301   3HZ   LYS  -1          3HZ       LYS  -1 -23.850   2.190   7.342
  302    H    LEU   1           H        LEU   1 -21.162  -3.045   2.693
  303    HA   LEU   1           HA       LEU   1 -18.914  -4.607   3.399
  304   1HB   LEU   1          1HB       LEU   1 -20.960  -5.392   2.119
  305   2HB   LEU   1          2HB       LEU   1 -20.279  -4.614   0.692
  306    HG   LEU   1           HG       LEU   1 -18.133  -6.043   1.267
  307   1HD1  LEU   1          1HD1      LEU   1 -18.873  -6.919   3.416
  308   2HD1  LEU   1          2HD1      LEU   1 -18.774  -8.250   2.266
  309   3HD1  LEU   1          3HD1      LEU   1 -20.342  -7.565   2.686
  310   1HD2  LEU   1          1HD2      LEU   1 -19.168  -7.995  -0.006
  311   2HD2  LEU   1          2HD2      LEU   1 -19.320  -6.417  -0.778
  312   3HD2  LEU   1          3HD2      LEU   1 -20.697  -7.120   0.069
  313    H    CYS   2           H        CYS   2 -19.329  -2.243   0.779
  314    HA   CYS   2           HA       CYS   2 -16.843  -2.641  -0.524
  315   1HB   CYS   2          1HB       CYS   2 -18.672  -1.188  -1.392
  316   2HB   CYS   2          2HB       CYS   2 -18.312  -0.017  -0.124
  317    H    TYR   3           H        TYR   3 -17.668  -0.848   2.400
  318    HA   TYR   3           HA       TYR   3 -15.246   0.599   2.721
  319   1HB   TYR   3          1HB       TYR   3 -17.363   0.811   4.121
  320   2HB   TYR   3          2HB       TYR   3 -16.839  -0.638   4.980
  321    HD1  TYR   3           HD1      TYR   3 -16.005   2.888   4.214
  322    HD2  TYR   3           HD2      TYR   3 -14.986  -0.586   6.526
  323    HE1  TYR   3           HE1      TYR   3 -14.500   4.266   5.621
  324    HE2  TYR   3           HE2      TYR   3 -13.480   0.793   7.934
  325    HH   TYR   3           HH       TYR   3 -12.707   4.096   7.109
  326    H    LEU   4           H        LEU   4 -15.948  -2.789   3.097
  327    HA   LEU   4           HA       LEU   4 -13.755  -3.472   4.818
  328   1HB   LEU   4          1HB       LEU   4 -15.632  -5.015   4.389
  329   2HB   LEU   4          2HB       LEU   4 -15.156  -5.135   2.698
  330    HG   LEU   4           HG       LEU   4 -12.991  -6.118   3.367
  331   1HD1  LEU   4          1HD1      LEU   4 -12.455  -5.270   5.483
  332   2HD1  LEU   4          2HD1      LEU   4 -12.968  -6.906   5.881
  333   3HD1  LEU   4          3HD1      LEU   4 -14.074  -5.553   6.123
  334   1HD2  LEU   4          1HD2      LEU   4 -15.413  -7.465   4.606
  335   2HD2  LEU   4          2HD2      LEU   4 -13.892  -8.270   4.217
  336   3HD2  LEU   4          3HD2      LEU   4 -14.894  -7.607   2.926
  337    H    LEU   5           H        LEU   5 -14.064  -3.223   1.284
  338    HA   LEU   5           HA       LEU   5 -11.478  -4.243   0.642
  339   1HB   LEU   5          1HB       LEU   5 -13.382  -2.356  -0.748
  340   2HB   LEU   5          2HB       LEU   5 -11.785  -2.661  -1.428
  341    HG   LEU   5           HG       LEU   5 -12.286  -5.120  -1.363
  342   1HD1  LEU   5          1HD1      LEU   5 -14.972  -4.063  -0.457
  343   2HD1  LEU   5          2HD1      LEU   5 -13.958  -5.269   0.338
  344   3HD1  LEU   5          3HD1      LEU   5 -14.777  -5.661  -1.175
  345   1HD2  LEU   5          1HD2      LEU   5 -14.220  -3.361  -2.906
  346   2HD2  LEU   5          2HD2      LEU   5 -13.889  -5.053  -3.271
  347   3HD2  LEU   5          3HD2      LEU   5 -12.610  -3.850  -3.433
  348    H    ASP   6           H        ASP   6 -12.577  -0.903   1.276
  349    HA   ASP   6           HA       ASP   6 -10.064   0.363   0.880
  350   1HB   ASP   6          1HB       ASP   6 -12.390   1.066   2.689
  351   2HB   ASP   6          2HB       ASP   6 -10.996   2.121   2.451
  352    H    GLY   7           H        GLY   7 -11.445  -1.234   3.727
  353   1HA   GLY   7          1HA       GLY   7  -9.440  -0.459   5.597
  354   2HA   GLY   7          2HA       GLY   7 -10.431  -1.913   5.730
  355    H    ILE   8           H        ILE   8  -9.672  -3.441   3.617
  356    HA   ILE   8           HA       ILE   8  -7.134  -4.485   4.447
  357    HB   ILE   8           HB       ILE   8  -8.542  -4.963   1.804
  358   1HG1  ILE   8          1HG1      ILE   8  -8.861  -6.394   4.463
  359   2HG1  ILE   8          2HG1      ILE   8 -10.050  -5.301   3.753
  360   1HG2  ILE   8          1HG2      ILE   8  -6.194  -5.800   2.008
  361   2HG2  ILE   8          2HG2      ILE   8  -7.369  -7.106   1.862
  362   3HG2  ILE   8          3HG2      ILE   8  -6.676  -6.714   3.436
  363   1HD1  ILE   8          1HD1      ILE   8  -9.082  -7.929   2.594
  364   2HD1  ILE   8          2HD1      ILE   8 -10.129  -6.797   1.738
  365   3HD1  ILE   8          3HD1      ILE   8 -10.694  -7.577   3.215
  366    H    LEU   9           H        LEU   9  -8.006  -2.859   1.367
  367    HA   LEU   9           HA       LEU   9  -5.383  -2.657   0.348
  368   1HB   LEU   9          1HB       LEU   9  -7.605  -0.618   0.027
  369   2HB   LEU   9          2HB       LEU   9  -6.227  -0.834  -1.049
  370    HG   LEU   9           HG       LEU   9  -8.217  -3.046  -0.473
  371   1HD1  LEU   9          1HD1      LEU   9  -9.445  -1.197  -1.475
  372   2HD1  LEU   9          2HD1      LEU   9  -9.209  -2.454  -2.690
  373   3HD1  LEU   9          3HD1      LEU   9  -8.205  -1.004  -2.714
  374   1HD2  LEU   9          1HD2      LEU   9  -7.307  -3.793  -2.763
  375   2HD2  LEU   9          2HD2      LEU   9  -6.209  -3.943  -1.395
  376   3HD2  LEU   9          3HD2      LEU   9  -6.031  -2.601  -2.524
  377    H    PHE  10           H        PHE  10  -7.138  -0.424   2.502
  378    HA   PHE  10           HA       PHE  10  -5.124   1.586   2.618
  379   1HB   PHE  10          1HB       PHE  10  -7.374   1.973   3.491
  380   2HB   PHE  10          2HB       PHE  10  -7.134   0.734   4.723
  381    HD1  PHE  10           HD1      PHE  10  -6.188   1.304   6.806
  382    HD2  PHE  10           HD2      PHE  10  -5.690   3.946   3.456
  383    HE1  PHE  10           HE1      PHE  10  -5.134   2.988   8.290
  384    HE2  PHE  10           HE2      PHE  10  -4.637   5.630   4.941
  385    HZ   PHE  10           HZ       PHE  10  -4.360   5.151   7.358
  386    H    ILE  11           H        ILE  11  -5.744  -1.089   4.927
  387    HA   ILE  11           HA       ILE  11  -3.473  -0.651   6.555
  388    HB   ILE  11           HB       ILE  11  -4.878  -3.242   5.833
  389   1HG1  ILE  11          1HG1      ILE  11  -5.038  -1.571   8.354
  390   2HG1  ILE  11          2HG1      ILE  11  -6.157  -1.379   7.006
  391   1HG2  ILE  11          1HG2      ILE  11  -2.723  -3.865   6.661
  392   2HG2  ILE  11          2HG2      ILE  11  -3.823  -4.009   8.031
  393   3HG2  ILE  11          3HG2      ILE  11  -2.759  -2.610   7.898
  394   1HD1  ILE  11          1HD1      ILE  11  -6.994  -3.597   7.250
  395   2HD1  ILE  11          2HD1      ILE  11  -6.913  -2.946   8.888
  396   3HD1  ILE  11          3HD1      ILE  11  -5.668  -4.058   8.318
  397    H    TYR  12           H        TYR  12  -3.795  -2.437   3.512
  398    HA   TYR  12           HA       TYR  12  -1.220  -3.636   3.459
  399   1HB   TYR  12          1HB       TYR  12  -2.976  -4.181   1.818
  400   2HB   TYR  12          2HB       TYR  12  -2.853  -2.558   1.139
  401    HD1  TYR  12           HD1      TYR  12  -1.120  -5.797   1.570
  402    HD2  TYR  12           HD2      TYR  12  -0.984  -1.914  -0.264
  403    HE1  TYR  12           HE1      TYR  12   0.745  -6.545   0.119
  404    HE2  TYR  12           HE2      TYR  12   0.884  -2.663  -1.716
  405    HH   TYR  12           HH       TYR  12   2.502  -4.303  -1.923
  406    H    GLY  13           H        GLY  13  -2.279  -0.404   2.392
  407   1HA   GLY  13          1HA       GLY  13   0.284   0.382   1.354
  408   2HA   GLY  13          2HA       GLY  13  -1.013   1.485   1.810
  409    H    VAL  14           H        VAL  14  -1.219   0.710   4.561
  410    HA   VAL  14           HA       VAL  14   0.845   2.355   5.687
  411    HB   VAL  14           HB       VAL  14  -1.103   0.432   6.991
  412   1HG1  VAL  14          1HG1      VAL  14  -0.569   1.862   9.044
  413   2HG1  VAL  14          2HG1      VAL  14   0.842   2.435   8.155
  414   3HG1  VAL  14          3HG1      VAL  14   0.682   0.724   8.550
  415   1HG2  VAL  14          1HG2      VAL  14  -2.271   2.564   7.577
  416   2HG2  VAL  14          2HG2      VAL  14  -2.178   2.302   5.835
  417   3HG2  VAL  14          3HG2      VAL  14  -1.084   3.444   6.615
  418    H    ILE  15           H        ILE  15   0.366  -1.187   5.696
  419    HA   ILE  15           HA       ILE  15   2.717  -1.741   7.255
  420    HB   ILE  15           HB       ILE  15   1.261  -3.501   5.259
  421   1HG1  ILE  15          1HG1      ILE  15   1.052  -3.390   8.283
  422   2HG1  ILE  15          2HG1      ILE  15  -0.083  -2.588   7.197
  423   1HG2  ILE  15          1HG2      ILE  15   2.313  -5.340   6.638
  424   2HG2  ILE  15          2HG2      ILE  15   3.300  -4.106   7.419
  425   3HG2  ILE  15          3HG2      ILE  15   3.466  -4.402   5.689
  426   1HD1  ILE  15          1HD1      ILE  15   0.507  -5.564   7.254
  427   2HD1  ILE  15          2HD1      ILE  15  -0.614  -4.765   6.151
  428   3HD1  ILE  15          3HD1      ILE  15  -0.949  -4.790   7.883
  429    H    LEU  16           H        LEU  16   2.189  -1.303   3.787
  430    HA   LEU  16           HA       LEU  16   4.832  -2.255   3.056
  431   1HB   LEU  16          1HB       LEU  16   2.495  -1.685   1.669
  432   2HB   LEU  16          2HB       LEU  16   3.522  -0.345   1.193
  433    HG   LEU  16           HG       LEU  16   3.934  -1.990  -0.439
  434   1HD1  LEU  16          1HD1      LEU  16   6.185  -2.891   1.305
  435   2HD1  LEU  16          2HD1      LEU  16   6.025  -1.155   1.053
  436   3HD1  LEU  16          3HD1      LEU  16   6.203  -2.231  -0.328
  437   1HD2  LEU  16          1HD2      LEU  16   4.212  -4.068   1.759
  438   2HD2  LEU  16          2HD2      LEU  16   4.254  -4.361   0.022
  439   3HD2  LEU  16          3HD2      LEU  16   2.760  -3.826   0.788
  440    H    THR  17           H        THR  17   3.380   0.975   3.472
  441    HA   THR  17           HA       THR  17   5.695   2.484   2.798
  442    HB   THR  17           HB       THR  17   3.607   3.244   4.855
  443    HG1  THR  17           HG1      THR  17   2.282   3.632   3.244
  444   1HG2  THR  17          1HG2      THR  17   5.598   4.719   4.664
  445   2HG2  THR  17          2HG2      THR  17   4.121   5.522   4.129
  446   3HG2  THR  17          3HG2      THR  17   5.270   4.905   2.941
  447    H    ALA  18           H        ALA  18   4.663   1.080   5.900
  448    HA   ALA  18           HA       ALA  18   6.650   2.296   7.533
  449   1HB   ALA  18          1HB       ALA  18   4.872   1.139   8.627
  450   2HB   ALA  18          2HB       ALA  18   6.329   0.208   8.976
  451   3HB   ALA  18          3HB       ALA  18   5.200  -0.351   7.741
  452    H    LEU  19           H        LEU  19   6.730  -0.810   5.768
  453    HA   LEU  19           HA       LEU  19   9.425  -1.463   6.566
  454   1HB   LEU  19          1HB       LEU  19   7.911  -2.353   4.094
  455   2HB   LEU  19          2HB       LEU  19   9.330  -3.138   4.779
  456    HG   LEU  19           HG       LEU  19   6.741  -2.753   6.309
  457   1HD1  LEU  19          1HD1      LEU  19   6.298  -4.171   4.374
  458   2HD1  LEU  19          2HD1      LEU  19   6.349  -5.170   5.826
  459   3HD1  LEU  19          3HD1      LEU  19   7.726  -5.145   4.725
  460   1HD2  LEU  19          1HD2      LEU  19   8.497  -3.147   7.855
  461   2HD2  LEU  19          2HD2      LEU  19   9.308  -4.287   6.783
  462   3HD2  LEU  19          3HD2      LEU  19   7.811  -4.747   7.589
  463    H    PHE  20           H        PHE  20   8.086   0.403   3.877
  464    HA   PHE  20           HA       PHE  20  10.489   0.533   2.330
  465   1HB   PHE  20          1HB       PHE  20   8.286   1.217   1.443
  466   2HB   PHE  20          2HB       PHE  20   8.262   2.580   2.562
  467    HD1  PHE  20           HD1      PHE  20  10.000   1.119  -0.374
  468    HD2  PHE  20           HD2      PHE  20   9.558   4.558   2.159
  469    HE1  PHE  20           HE1      PHE  20  11.311   2.474  -1.986
  470    HE2  PHE  20           HE2      PHE  20  10.869   5.914   0.548
  471    HZ   PHE  20           HZ       PHE  20  11.745   4.871  -1.524
  472    H    LEU  21           H        LEU  21   9.170   2.857   4.726
  473    HA   LEU  21           HA       LEU  21  11.468   4.577   4.643
  474   1HB   LEU  21          1HB       LEU  21   9.512   4.158   6.923
  475   2HB   LEU  21          2HB       LEU  21  10.580   5.543   6.718
  476    HG   LEU  21           HG       LEU  21   8.516   4.750   4.647
  477   1HD1  LEU  21          1HD1      LEU  21   8.282   6.614   7.022
  478   2HD1  LEU  21          2HD1      LEU  21   7.261   5.227   6.638
  479   3HD1  LEU  21          3HD1      LEU  21   7.191   6.677   5.637
  480   1HD2  LEU  21          1HD2      LEU  21   8.790   7.258   4.127
  481   2HD2  LEU  21          2HD2      LEU  21  10.145   6.220   3.700
  482   3HD2  LEU  21          3HD2      LEU  21  10.218   7.207   5.158
  483    H    ARG  22           H        ARG  22  10.639   1.778   6.664
  484    HA   ARG  22           HA       ARG  22  12.739   1.991   8.549
  485   1HB   ARG  22          1HB       ARG  22  10.826   0.315   8.560
  486   2HB   ARG  22          2HB       ARG  22  11.740  -0.613   7.371
  487   1HG   ARG  22          1HG       ARG  22  13.669  -0.662   8.973
  488   2HG   ARG  22          2HG       ARG  22  12.636   0.118  10.173
  489   1HD   ARG  22          1HD       ARG  22  12.097  -2.553   8.839
  490   2HD   ARG  22          2HD       ARG  22  12.637  -2.318  10.502
  491    HE   ARG  22           HE       ARG  22  10.316  -0.826  10.366
  492   1HH1  ARG  22          1HH1      ARG  22  11.248  -4.050   9.582
  493   2HH1  ARG  22          2HH1      ARG  22   9.696  -4.728   9.941
  494   1HH2  ARG  22          1HH2      ARG  22   8.283  -1.691  10.842
  495   2HH2  ARG  22          2HH2      ARG  22   8.016  -3.392  10.655
  496    H    VAL  23           H        VAL  23  12.727   0.429   5.341
  497    HA   VAL  23           HA       VAL  23  15.493  -0.409   5.508
  498    HB   VAL  23           HB       VAL  23  13.673   0.007   3.117
  499   1HG1  VAL  23          1HG1      VAL  23  15.911   0.086   2.293
  500   2HG1  VAL  23          2HG1      VAL  23  15.378  -1.576   2.044
  501   3HG1  VAL  23          3HG1      VAL  23  16.438  -1.184   3.397
  502   1HG2  VAL  23          1HG2      VAL  23  13.024  -1.735   4.836
  503   2HG2  VAL  23          2HG2      VAL  23  14.551  -2.549   4.491
  504   3HG2  VAL  23          3HG2      VAL  23  13.333  -2.382   3.226
  505    H    LYS  24           H        LYS  24  13.847   2.501   4.405
  506    HA   LYS  24           HA       LYS  24  15.950   3.693   2.929
  507   1HB   LYS  24          1HB       LYS  24  13.618   4.588   3.097
  508   2HB   LYS  24          2HB       LYS  24  13.979   5.120   4.740
  509   1HG   LYS  24          1HG       LYS  24  15.826   6.520   3.874
  510   2HG   LYS  24          2HG       LYS  24  15.441   6.002   2.233
  511   1HD   LYS  24          1HD       LYS  24  13.139   6.934   2.529
  512   2HD   LYS  24          2HD       LYS  24  13.634   7.558   4.103
  513   1HE   LYS  24          1HE       LYS  24  15.119   8.226   1.555
  514   2HE   LYS  24          2HE       LYS  24  13.785   9.208   2.161
  515   1HZ   LYS  24          1HZ       LYS  24  15.144   9.120   4.353
  516   2HZ   LYS  24          2HZ       LYS  24  15.582  10.216   3.132
  517   3HZ   LYS  24          3HZ       LYS  24  16.446   8.766   3.326
  518    H    PHE  25           H        PHE  25  15.272   3.830   6.440
  519    HA   PHE  25           HA       PHE  25  18.136   4.233   6.953
  520   1HB   PHE  25          1HB       PHE  25  17.888   6.340   8.141
  521   2HB   PHE  25          2HB       PHE  25  17.273   6.540   6.501
  522    HD1  PHE  25           HD1      PHE  25  16.351   6.197  10.059
  523    HD2  PHE  25           HD2      PHE  25  14.899   6.821   6.064
  524    HE1  PHE  25           HE1      PHE  25  14.145   6.876  10.965
  525    HE2  PHE  25           HE2      PHE  25  12.693   7.499   6.972
  526    HZ   PHE  25           HZ       PHE  25  12.315   7.528   9.422
  527    H    SER  26           H        SER  26  18.603   4.131   9.302
  528    HA   SER  26           HA       SER  26  16.423   3.333  11.098
  529   1HB   SER  26          1HB       SER  26  17.259   1.102  11.546
  530   2HB   SER  26          2HB       SER  26  16.984   1.243   9.813
  531    HG   SER  26           HG       SER  26  19.424   1.367  11.246
  532    H    ARG  27           H        ARG  27  17.273   2.998  13.337
  533    HA   ARG  27           HA       ARG  27  19.186   4.996  14.042
  534   1HB   ARG  27          1HB       ARG  27  18.188   2.614  15.631
  535   2HB   ARG  27          2HB       ARG  27  19.098   3.965  16.308
  536   1HG   ARG  27          1HG       ARG  27  17.310   5.510  15.442
  537   2HG   ARG  27          2HG       ARG  27  16.373   4.086  14.991
  538   1HD   ARG  27          1HD       ARG  27  15.586   4.750  17.156
  539   2HD   ARG  27          2HD       ARG  27  16.591   3.323  17.408
  540    HE   ARG  27           HE       ARG  27  18.359   5.430  17.717
  541   1HH1  ARG  27          1HH1      ARG  27  15.297   4.520  19.014
  542   2HH1  ARG  27          2HH1      ARG  27  15.571   5.278  20.547
  543   1HH2  ARG  27          1HH2      ARG  27  18.735   6.425  19.715
  544   2HH2  ARG  27          2HH2      ARG  27  17.517   6.357  20.944
  545    H    SER  28           H        SER  28  19.517   1.555  13.370
  546    HA   SER  28           HA       SER  28  22.045   1.044  14.492
  547   1HB   SER  28          1HB       SER  28  20.968   0.058  11.835
  548   2HB   SER  28          2HB       SER  28  22.306  -0.662  12.724
  549    HG   SER  28           HG       SER  28  20.694  -0.788  14.509
  550    H    ALA  29           H        ALA  29  24.167   1.433  13.803
  551    HA   ALA  29           HA       ALA  29  24.681   2.729  11.219
  552   1HB   ALA  29          1HB       ALA  29  23.944   4.589  12.775
  553   2HB   ALA  29          2HB       ALA  29  25.563   4.790  12.103
  554   3HB   ALA  29          3HB       ALA  29  25.361   4.228  13.762
  555    H    ASP  30           H        ASP  30  26.987   2.844  10.773
  556    HA   ASP  30           HA       ASP  30  28.973   1.992  12.671
  557   1HB   ASP  30          1HB       ASP  30  29.457  -0.234  11.600
  558   2HB   ASP  30          2HB       ASP  30  27.929  -0.188  12.482
  Start of MODEL    6
    1   1H    ASP  -3          1H        ASP  -3 -23.147   4.186  -0.249
    2    HA   ASP  -3           HA       ASP  -3 -24.546   4.485  -2.200
    3   1HB   ASP  -3          1HB       ASP  -3 -22.989   6.893  -1.219
    4   2HB   ASP  -3          2HB       ASP  -3 -24.440   7.016  -2.215
    5    H    SER  -2           H        SER  -2 -24.634   4.706  -4.405
    6    HA   SER  -2           HA       SER  -2 -23.830   4.776  -6.609
    7   1HB   SER  -2          1HB       SER  -2 -21.943   6.884  -5.533
    8   2HB   SER  -2          2HB       SER  -2 -22.543   6.722  -7.182
    9    HG   SER  -2           HG       SER  -2 -24.160   7.180  -4.890
   10    H    LYS  -1           H        LYS  -1 -21.580   4.777  -7.881
   11    HA   LYS  -1           HA       LYS  -1 -20.027   2.574  -6.694
   12   1HB   LYS  -1          1HB       LYS  -1 -19.813   3.977  -9.377
   13   2HB   LYS  -1          2HB       LYS  -1 -18.885   2.553  -8.905
   14   1HG   LYS  -1          1HG       LYS  -1 -21.033   1.333  -8.522
   15   2HG   LYS  -1          2HG       LYS  -1 -21.904   2.743  -9.127
   16   1HD   LYS  -1          1HD       LYS  -1 -20.548   2.547 -11.256
   17   2HD   LYS  -1          2HD       LYS  -1 -19.947   1.004 -10.649
   18   1HE   LYS  -1          1HE       LYS  -1 -21.871   0.613 -12.107
   19   2HE   LYS  -1          2HE       LYS  -1 -22.294   0.202 -10.446
   20   1HZ   LYS  -1          1HZ       LYS  -1 -24.009   1.533 -11.540
   21   2HZ   LYS  -1          2HZ       LYS  -1 -22.891   2.793 -11.767
   22   3HZ   LYS  -1          3HZ       LYS  -1 -23.353   2.335 -10.197
   23    H    LEU   1           H        LEU   1 -19.926   5.627  -5.930
   24    HA   LEU   1           HA       LEU   1 -17.355   6.635  -6.547
   25   1HB   LEU   1          1HB       LEU   1 -19.075   8.003  -5.455
   26   2HB   LEU   1          2HB       LEU   1 -19.001   6.985  -4.019
   27    HG   LEU   1           HG       LEU   1 -16.671   7.659  -3.629
   28   1HD1  LEU   1          1HD1      LEU   1 -15.708   8.051  -5.734
   29   2HD1  LEU   1          2HD1      LEU   1 -15.900   9.687  -5.110
   30   3HD1  LEU   1          3HD1      LEU   1 -17.057   9.048  -6.278
   31   1HD2  LEU   1          1HD2      LEU   1 -18.507  10.020  -4.149
   32   2HD2  LEU   1          2HD2      LEU   1 -17.090  10.035  -3.098
   33   3HD2  LEU   1          3HD2      LEU   1 -18.485   9.040  -2.682
   34    H    CYS   2           H        CYS   2 -18.392   4.331  -4.070
   35    HA   CYS   2           HA       CYS   2 -16.034   4.231  -2.515
   36   1HB   CYS   2          1HB       CYS   2 -18.167   3.042  -1.975
   37   2HB   CYS   2          2HB       CYS   2 -17.808   1.886  -3.260
   38    H    TYR   3           H        TYR   3 -16.787   2.721  -5.624
   39    HA   TYR   3           HA       TYR   3 -14.556   0.959  -5.765
   40   1HB   TYR   3          1HB       TYR   3 -16.550   1.054  -7.345
   41   2HB   TYR   3          2HB       TYR   3 -15.765   2.431  -8.117
   42    HD1  TYR   3           HD1      TYR   3 -15.167  -1.119  -7.105
   43    HD2  TYR   3           HD2      TYR   3 -14.110   2.082  -9.767
   44    HE1  TYR   3           HE1      TYR   3 -13.741  -2.673  -8.409
   45    HE2  TYR   3           HE2      TYR   3 -12.685   0.528 -11.070
   46    HH   TYR   3           HH       TYR   3 -12.236  -2.849 -10.046
   47    H    LEU   4           H        LEU   4 -14.834   4.421  -6.349
   48    HA   LEU   4           HA       LEU   4 -12.340   4.768  -7.710
   49   1HB   LEU   4          1HB       LEU   4 -14.177   6.487  -7.544
   50   2HB   LEU   4          2HB       LEU   4 -13.719   6.740  -5.865
   51    HG   LEU   4           HG       LEU   4 -11.364   7.249  -6.700
   52   1HD1  LEU   4          1HD1      LEU   4 -11.476   8.150  -9.159
   53   2HD1  LEU   4          2HD1      LEU   4 -12.839   7.046  -9.325
   54   3HD1  LEU   4          3HD1      LEU   4 -11.247   6.424  -8.897
   55   1HD2  LEU   4          1HD2      LEU   4 -11.993   9.562  -7.387
   56   2HD2  LEU   4          2HD2      LEU   4 -12.890   9.013  -5.971
   57   3HD2  LEU   4          3HD2      LEU   4 -13.666   9.030  -7.555
   58    H    LEU   5           H        LEU   5 -13.190   4.656  -4.267
   59    HA   LEU   5           HA       LEU   5 -10.657   5.514  -3.253
   60   1HB   LEU   5          1HB       LEU   5 -12.912   3.855  -2.130
   61   2HB   LEU   5          2HB       LEU   5 -11.416   4.038  -1.217
   62    HG   LEU   5           HG       LEU   5 -11.650   6.509  -1.374
   63   1HD1  LEU   5          1HD1      LEU   5 -12.926   6.790  -3.376
   64   2HD1  LEU   5          2HD1      LEU   5 -13.972   7.324  -2.060
   65   3HD1  LEU   5          3HD1      LEU   5 -14.210   5.736  -2.786
   66   1HD2  LEU   5          1HD2      LEU   5 -13.717   6.643   0.108
   67   2HD2  LEU   5          2HD2      LEU   5 -12.491   5.484   0.627
   68   3HD2  LEU   5          3HD2      LEU   5 -13.944   4.921  -0.198
   69    H    ASP   6           H        ASP   6 -11.900   2.259  -4.019
   70    HA   ASP   6           HA       ASP   6  -9.593   0.826  -3.151
   71   1HB   ASP   6          1HB       ASP   6 -11.605   0.182  -5.326
   72   2HB   ASP   6          2HB       ASP   6 -10.404  -0.957  -4.715
   73    H    GLY   7           H        GLY   7 -10.383   2.347  -6.265
   74   1HA   GLY   7          1HA       GLY   7  -8.166   1.341  -7.742
   75   2HA   GLY   7          2HA       GLY   7  -9.005   2.851  -8.096
   76    H    ILE   8           H        ILE   8  -8.488   4.423  -5.940
   77    HA   ILE   8           HA       ILE   8  -5.774   5.238  -6.383
   78    HB   ILE   8           HB       ILE   8  -7.636   5.966  -4.099
   79   1HG1  ILE   8          1HG1      ILE   8  -7.099   7.404  -6.716
   80   2HG1  ILE   8          2HG1      ILE   8  -8.515   6.396  -6.419
   81   1HG2  ILE   8          1HG2      ILE   8  -5.131   7.282  -5.195
   82   2HG2  ILE   8          2HG2      ILE   8  -5.323   6.557  -3.598
   83   3HG2  ILE   8          3HG2      ILE   8  -6.211   8.023  -4.014
   84   1HD1  ILE   8          1HD1      ILE   8  -9.121   8.708  -5.995
   85   2HD1  ILE   8          2HD1      ILE   8  -7.737   8.914  -4.921
   86   3HD1  ILE   8          3HD1      ILE   8  -9.067   7.856  -4.453
   87    H    LEU   9           H        LEU   9  -7.313   3.503  -3.665
   88    HA   LEU   9           HA       LEU   9  -4.875   3.271  -2.146
   89   1HB   LEU   9          1HB       LEU   9  -7.371   1.548  -2.101
   90   2HB   LEU   9          2HB       LEU   9  -6.107   1.530  -0.876
   91    HG   LEU   9           HG       LEU   9  -7.606   4.052  -1.625
   92   1HD1  LEU   9          1HD1      LEU   9  -9.318   2.592  -0.843
   93   2HD1  LEU   9          2HD1      LEU   9  -8.873   3.578   0.550
   94   3HD1  LEU   9          3HD1      LEU   9  -8.278   1.923   0.415
   95   1HD2  LEU   9          1HD2      LEU   9  -6.885   4.574   0.818
   96   2HD2  LEU   9          2HD2      LEU   9  -5.639   4.617  -0.424
   97   3HD2  LEU   9          3HD2      LEU   9  -5.775   3.217   0.639
   98    H    PHE  10           H        PHE  10  -6.488   1.161  -4.514
   99    HA   PHE  10           HA       PHE  10  -4.688  -1.050  -4.242
  100   1HB   PHE  10          1HB       PHE  10  -6.850  -1.230  -5.418
  101   2HB   PHE  10          2HB       PHE  10  -6.255  -0.150  -6.680
  102    HD1  PHE  10           HD1      PHE  10  -5.572  -3.412  -4.990
  103    HD2  PHE  10           HD2      PHE  10  -4.977  -0.991  -8.488
  104    HE1  PHE  10           HE1      PHE  10  -4.539  -5.343  -6.152
  105    HE2  PHE  10           HE2      PHE  10  -3.943  -2.922  -9.650
  106    HZ   PHE  10           HZ       PHE  10  -3.724  -5.099  -8.480
  107    H    ILE  11           H        ILE  11  -4.747   1.536  -6.730
  108    HA   ILE  11           HA       ILE  11  -2.317   0.839  -7.989
  109    HB   ILE  11           HB       ILE  11  -3.542   3.580  -7.550
  110   1HG1  ILE  11          1HG1      ILE  11  -3.572   1.789  -9.998
  111   2HG1  ILE  11          2HG1      ILE  11  -4.875   1.826  -8.810
  112   1HG2  ILE  11          1HG2      ILE  11  -1.256   2.637  -9.295
  113   2HG2  ILE  11          2HG2      ILE  11  -1.244   3.939  -8.107
  114   3HG2  ILE  11          3HG2      ILE  11  -2.136   4.130  -9.615
  115   1HD1  ILE  11          1HD1      ILE  11  -3.907   4.120 -10.537
  116   2HD1  ILE  11          2HD1      ILE  11  -5.041   4.318  -9.199
  117   3HD1  ILE  11          3HD1      ILE  11  -5.485   3.333 -10.593
  118    H    TYR  12           H        TYR  12  -2.909   2.812  -5.104
  119    HA   TYR  12           HA       TYR  12  -0.264   3.759  -4.694
  120   1HB   TYR  12          1HB       TYR  12  -2.182   4.575  -3.389
  121   2HB   TYR  12          2HB       TYR  12  -2.360   2.989  -2.640
  122    HD1  TYR  12           HD1      TYR  12  -0.814   2.213  -0.934
  123    HD2  TYR  12           HD2      TYR  12  -0.250   6.015  -2.855
  124    HE1  TYR  12           HE1      TYR  12   0.846   2.842   0.796
  125    HE2  TYR  12           HE2      TYR  12   1.412   6.641  -1.122
  126    HH   TYR  12           HH       TYR  12   1.736   5.050   1.771
  127    H    GLY  13           H        GLY  13  -1.801   0.703  -3.718
  128   1HA   GLY  13          1HA       GLY  13   0.448  -0.266  -2.209
  129   2HA   GLY  13          2HA       GLY  13  -0.856  -1.264  -2.855
  130    H    VAL  14           H        VAL  14  -0.478  -0.565  -5.625
  131    HA   VAL  14           HA       VAL  14   1.590  -2.458  -6.296
  132    HB   VAL  14           HB       VAL  14   0.087  -0.476  -8.028
  133   1HG1  VAL  14          1HG1      VAL  14   1.950  -2.768  -8.679
  134   2HG1  VAL  14          2HG1      VAL  14   2.043  -1.098  -9.241
  135   3HG1  VAL  14          3HG1      VAL  14   0.769  -2.161  -9.839
  136   1HG2  VAL  14          1HG2      VAL  14  -1.258  -2.226  -6.801
  137   2HG2  VAL  14          2HG2      VAL  14  -0.320  -3.457  -7.647
  138   3HG2  VAL  14          3HG2      VAL  14  -1.349  -2.353  -8.558
  139    H    ILE  15           H        ILE  15   1.405   1.103  -6.593
  140    HA   ILE  15           HA       ILE  15   3.997   1.400  -7.770
  141    HB   ILE  15           HB       ILE  15   2.413   3.348  -6.068
  142   1HG1  ILE  15          1HG1      ILE  15   2.673   3.135  -9.084
  143   2HG1  ILE  15          2HG1      ILE  15   1.312   2.481  -8.171
  144   1HG2  ILE  15          1HG2      ILE  15   3.828   5.039  -7.324
  145   2HG2  ILE  15          2HG2      ILE  15   4.827   3.692  -7.868
  146   3HG2  ILE  15          3HG2      ILE  15   4.714   4.068  -6.149
  147   1HD1  ILE  15          1HD1      ILE  15   2.171   5.390  -8.233
  148   2HD1  ILE  15          2HD1      ILE  15   0.831   4.744  -7.286
  149   3HD1  ILE  15          3HD1      ILE  15   0.762   4.711  -9.048
  150    H    LEU  16           H        LEU  16   2.928   1.400  -4.370
  151    HA   LEU  16           HA       LEU  16   5.512   2.055  -3.299
  152   1HB   LEU  16          1HB       LEU  16   2.957   1.734  -2.259
  153   2HB   LEU  16          2HB       LEU  16   3.786   0.338  -1.596
  154    HG   LEU  16           HG       LEU  16   4.098   2.013   0.029
  155   1HD1  LEU  16          1HD1      LEU  16   6.306   0.957  -1.119
  156   2HD1  LEU  16          2HD1      LEU  16   6.372   2.061   0.248
  157   3HD1  LEU  16          3HD1      LEU  16   6.645   2.667  -1.384
  158   1HD2  LEU  16          1HD2      LEU  16   3.271   3.880  -1.415
  159   2HD2  LEU  16          2HD2      LEU  16   4.865   3.968  -2.163
  160   3HD2  LEU  16          3HD2      LEU  16   4.676   4.329  -0.449
  161    H    THR  17           H        THR  17   3.865  -1.060  -3.859
  162    HA   THR  17           HA       THR  17   5.909  -2.725  -2.796
  163    HB   THR  17           HB       THR  17   4.105  -3.361  -5.149
  164    HG1  THR  17           HG1      THR  17   3.100  -4.364  -3.006
  165   1HG2  THR  17          1HG2      THR  17   4.326  -5.681  -4.233
  166   2HG2  THR  17          2HG2      THR  17   5.516  -5.072  -3.083
  167   3HG2  THR  17          3HG2      THR  17   5.854  -5.016  -4.813
  168    H    ALA  18           H        ALA  18   5.498  -1.359  -6.056
  169    HA   ALA  18           HA       ALA  18   7.641  -2.747  -7.309
  170   1HB   ALA  18          1HB       ALA  18   6.074  -1.472  -8.642
  171   2HB   ALA  18          2HB       ALA  18   7.679  -0.781  -8.880
  172   3HB   ALA  18          3HB       ALA  18   6.520   0.022  -7.820
  173    H    LEU  19           H        LEU  19   7.652   0.480  -5.746
  174    HA   LEU  19           HA       LEU  19  10.476   0.892  -6.030
  175   1HB   LEU  19          1HB       LEU  19   8.636   1.960  -3.866
  176   2HB   LEU  19          2HB       LEU  19  10.205   2.625  -4.316
  177    HG   LEU  19           HG       LEU  19   7.868   2.390  -6.236
  178   1HD1  LEU  19          1HD1      LEU  19   7.779   4.923  -5.886
  179   2HD1  LEU  19          2HD1      LEU  19   8.766   4.659  -4.449
  180   3HD1  LEU  19          3HD1      LEU  19   7.161   3.935  -4.562
  181   1HD2  LEU  19          1HD2      LEU  19  10.607   3.677  -6.339
  182   2HD2  LEU  19          2HD2      LEU  19   9.299   4.235  -7.381
  183   3HD2  LEU  19          3HD2      LEU  19   9.869   2.573  -7.500
  184    H    PHE  20           H        PHE  20   8.546  -0.796  -3.606
  185    HA   PHE  20           HA       PHE  20  10.637  -1.093  -1.664
  186   1HB   PHE  20          1HB       PHE  20   8.276  -1.523  -1.120
  187   2HB   PHE  20          2HB       PHE  20   8.256  -2.885  -2.242
  188    HD1  PHE  20           HD1      PHE  20   9.035  -5.025  -1.580
  189    HD2  PHE  20           HD2      PHE  20   9.878  -1.594   0.864
  190    HE1  PHE  20           HE1      PHE  20   9.898  -6.511   0.207
  191    HE2  PHE  20           HE2      PHE  20  10.741  -3.082   2.652
  192    HZ   PHE  20           HZ       PHE  20  10.749  -5.540   2.324
  193    H    LEU  21           H        LEU  21   9.494  -3.308  -4.240
  194    HA   LEU  21           HA       LEU  21  11.496  -5.299  -3.783
  195   1HB   LEU  21          1HB       LEU  21  10.060  -4.577  -6.355
  196   2HB   LEU  21          2HB       LEU  21  10.955  -6.069  -6.078
  197    HG   LEU  21           HG       LEU  21   8.588  -5.171  -4.406
  198   1HD1  LEU  21          1HD1      LEU  21   7.738  -5.622  -6.593
  199   2HD1  LEU  21          2HD1      LEU  21   7.434  -7.080  -5.648
  200   3HD1  LEU  21          3HD1      LEU  21   8.783  -7.030  -6.785
  201   1HD2  LEU  21          1HD2      LEU  21   8.682  -7.761  -3.922
  202   2HD2  LEU  21          2HD2      LEU  21   9.789  -6.688  -3.072
  203   3HD2  LEU  21          3HD2      LEU  21  10.356  -7.619  -4.458
  204    H    ARG  22           H        ARG  22  11.419  -2.537  -6.052
  205    HA   ARG  22           HA       ARG  22  13.878  -2.998  -7.338
  206   1HB   ARG  22          1HB       ARG  22  12.243  -1.165  -7.896
  207   2HB   ARG  22          2HB       ARG  22  12.829  -0.282  -6.485
  208   1HG   ARG  22          1HG       ARG  22  15.136  -0.367  -7.439
  209   2HG   ARG  22          2HG       ARG  22  14.478  -1.136  -8.884
  210   1HD   ARG  22          1HD       ARG  22  13.656   1.585  -7.831
  211   2HD   ARG  22          2HD       ARG  22  14.741   1.309  -9.193
  212    HE   ARG  22           HE       ARG  22  12.443  -0.104  -9.856
  213   1HH1  ARG  22          1HH1      ARG  22  13.238   3.116  -8.909
  214   2HH1  ARG  22          2HH1      ARG  22  11.938   3.839  -9.797
  215   1HH2  ARG  22          1HH2      ARG  22  10.740   0.824 -11.019
  216   2HH2  ARG  22          2HH2      ARG  22  10.525   2.543 -10.992
  217    H    VAL  23           H        VAL  23  13.240  -1.497  -4.185
  218    HA   VAL  23           HA       VAL  23  16.042  -0.852  -3.728
  219    HB   VAL  23           HB       VAL  23  13.664  -0.991  -1.852
  220   1HG1  VAL  23          1HG1      VAL  23  15.619  -1.276  -0.501
  221   2HG1  VAL  23          2HG1      VAL  23  15.196   0.433  -0.387
  222   3HG1  VAL  23          3HG1      VAL  23  16.520  -0.081  -1.434
  223   1HG2  VAL  23          1HG2      VAL  23  13.733   0.743  -3.739
  224   2HG2  VAL  23          2HG2      VAL  23  15.123   1.441  -2.908
  225   3HG2  VAL  23          3HG2      VAL  23  13.554   1.380  -2.104
  226    H    LYS  24           H        LYS  24  13.857  -3.499  -2.871
  227    HA   LYS  24           HA       LYS  24  15.437  -4.830  -0.955
  228   1HB   LYS  24          1HB       LYS  24  13.053  -5.369  -1.956
  229   2HB   LYS  24          2HB       LYS  24  13.955  -6.398  -3.062
  230   1HG   LYS  24          1HG       LYS  24  14.096  -6.543  -0.032
  231   2HG   LYS  24          2HG       LYS  24  13.184  -7.645  -1.062
  232   1HD   LYS  24          1HD       LYS  24  15.494  -8.008  -2.268
  233   2HD   LYS  24          2HD       LYS  24  16.168  -7.356  -0.775
  234   1HE   LYS  24          1HE       LYS  24  14.771  -9.082   0.471
  235   2HE   LYS  24          2HE       LYS  24  14.447  -9.822  -1.097
  236   1HZ   LYS  24          1HZ       LYS  24  16.837  -9.879   0.494
  237   2HZ   LYS  24          2HZ       LYS  24  17.128  -9.461  -1.127
  238   3HZ   LYS  24          3HZ       LYS  24  16.339 -10.918  -0.750
  239    H    PHE  25           H        PHE  25  15.463  -5.276  -4.513
  240    HA   PHE  25           HA       PHE  25  17.891  -6.935  -4.318
  241   1HB   PHE  25          1HB       PHE  25  16.249  -5.957  -6.670
  242   2HB   PHE  25          2HB       PHE  25  17.684  -6.971  -6.830
  243    HD1  PHE  25           HD1      PHE  25  14.147  -6.889  -6.028
  244    HD2  PHE  25           HD2      PHE  25  17.732  -9.234  -5.702
  245    HE1  PHE  25           HE1      PHE  25  12.786  -8.905  -5.546
  246    HE2  PHE  25           HE2      PHE  25  16.370 -11.249  -5.221
  247    HZ   PHE  25           HZ       PHE  25  13.897 -11.085  -5.142
  248    H    SER  26           H        SER  26  19.889  -6.056  -4.318
  249    HA   SER  26           HA       SER  26  20.302  -3.221  -4.707
  250   1HB   SER  26          1HB       SER  26  21.757  -4.398  -3.179
  251   2HB   SER  26          2HB       SER  26  22.226  -5.547  -4.430
  252    HG   SER  26           HG       SER  26  23.031  -3.639  -5.585
  253    H    ARG  27           H        ARG  27  20.270  -5.949  -6.825
  254    HA   ARG  27           HA       ARG  27  22.073  -5.222  -8.846
  255   1HB   ARG  27          1HB       ARG  27  19.272  -6.292  -9.311
  256   2HB   ARG  27          2HB       ARG  27  20.652  -6.454 -10.394
  257   1HG   ARG  27          1HG       ARG  27  20.633  -7.556  -7.571
  258   2HG   ARG  27          2HG       ARG  27  20.146  -8.501  -8.975
  259   1HD   ARG  27          1HD       ARG  27  22.425  -7.909  -9.987
  260   2HD   ARG  27          2HD       ARG  27  22.872  -7.332  -8.382
  261    HE   ARG  27           HE       ARG  27  21.916  -9.876  -7.899
  262   1HH1  ARG  27          1HH1      ARG  27  24.222  -8.453 -10.034
  263   2HH1  ARG  27          2HH1      ARG  27  25.253  -9.845 -10.062
  264   1HH2  ARG  27          1HH2      ARG  27  23.253 -11.700  -7.923
  265   2HH2  ARG  27          2HH2      ARG  27  24.704 -11.681  -8.869
  266    H    SER  28           H        SER  28  18.906  -3.856  -8.098
  267    HA   SER  28           HA       SER  28  18.756  -2.232 -10.493
  268   1HB   SER  28          1HB       SER  28  17.403  -1.620  -7.860
  269   2HB   SER  28          2HB       SER  28  16.855  -1.213  -9.483
  270    HG   SER  28           HG       SER  28  15.846  -3.094  -8.443
  271    H    ALA  29           H        ALA  29  19.514  -0.142 -10.807
  272    HA   ALA  29           HA       ALA  29  21.514   0.832  -8.875
  273   1HB   ALA  29          1HB       ALA  29  20.622   2.118 -11.470
  274   2HB   ALA  29          2HB       ALA  29  21.861   0.867 -11.380
  275   3HB   ALA  29          3HB       ALA  29  22.118   2.420 -10.587
  276    H    ASP  30           H        ASP  30  20.981   2.232  -7.281
  277    HA   ASP  30           HA       ASP  30  19.070   4.407  -7.775
  278   1HB   ASP  30          1HB       ASP  30  17.552   3.812  -5.962
  279   2HB   ASP  30          2HB       ASP  30  17.613   2.483  -7.120
  280   1H    ASP  -3          1H        ASP  -3 -27.000  -0.946  -2.669
  281    HA   ASP  -3           HA       ASP  -3 -24.222  -0.547  -2.499
  282   1HB   ASP  -3          1HB       ASP  -3 -24.978   1.589  -1.465
  283   2HB   ASP  -3          2HB       ASP  -3 -25.874   1.208  -2.936
  284    H    SER  -2           H        SER  -2 -24.311  -2.757  -0.981
  285    HA   SER  -2           HA       SER  -2 -24.830  -2.277   1.822
  286   1HB   SER  -2          1HB       SER  -2 -23.079  -4.359   0.482
  287   2HB   SER  -2          2HB       SER  -2 -23.571  -4.383   2.173
  288    HG   SER  -2           HG       SER  -2 -25.686  -4.620   1.532
  289    H    LYS  -1           H        LYS  -1 -23.134  -2.180   3.508
  290    HA   LYS  -1           HA       LYS  -1 -21.030  -0.289   2.760
  291   1HB   LYS  -1          1HB       LYS  -1 -21.696  -1.626   5.405
  292   2HB   LYS  -1          2HB       LYS  -1 -20.466  -0.377   5.196
  293   1HG   LYS  -1          1HG       LYS  -1 -22.120   1.232   4.487
  294   2HG   LYS  -1          2HG       LYS  -1 -23.374  -0.008   4.429
  295   1HD   LYS  -1          1HD       LYS  -1 -23.589   1.306   6.490
  296   2HD   LYS  -1          2HD       LYS  -1 -23.126  -0.350   6.874
  297   1HE   LYS  -1          1HE       LYS  -1 -20.918   0.253   7.401
  298   2HE   LYS  -1          2HE       LYS  -1 -21.012   1.767   6.500
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.152   2.326   8.767
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.292   1.108   9.090
  301   3HZ   LYS  -1          3HZ       LYS  -1 -22.732   2.465   8.167
  302    H    LEU   1           H        LEU   1 -21.187  -3.437   2.180
  303    HA   LEU   1           HA       LEU   1 -18.878  -4.596   3.374
  304   1HB   LEU   1          1HB       LEU   1 -20.667  -5.811   2.049
  305   2HB   LEU   1          2HB       LEU   1 -19.930  -5.158   0.588
  306    HG   LEU   1           HG       LEU   1 -17.711  -6.202   1.544
  307   1HD1  LEU   1          1HD1      LEU   1 -18.504  -6.851   3.739
  308   2HD1  LEU   1          2HD1      LEU   1 -18.205  -8.320   2.815
  309   3HD1  LEU   1          3HD1      LEU   1 -19.855  -7.743   3.039
  310   1HD2  LEU   1          1HD2      LEU   1 -18.689  -7.013  -0.504
  311   2HD2  LEU   1          2HD2      LEU   1 -19.996  -7.810   0.373
  312   3HD2  LEU   1          3HD2      LEU   1 -18.347  -8.421   0.502
  313    H    CYS   2           H        CYS   2 -19.268  -2.479   0.583
  314    HA   CYS   2           HA       CYS   2 -16.748  -2.793  -0.641
  315   1HB   CYS   2          1HB       CYS   2 -18.635  -1.366  -1.497
  316   2HB   CYS   2          2HB       CYS   2 -18.217  -0.166  -0.275
  317    H    TYR   3           H        TYR   3 -17.658  -0.932   2.228
  318    HA   TYR   3           HA       TYR   3 -15.272   0.541   2.587
  319   1HB   TYR   3          1HB       TYR   3 -17.421   0.692   3.956
  320   2HB   TYR   3          2HB       TYR   3 -16.845  -0.721   4.842
  321    HD1  TYR   3           HD1      TYR   3 -16.042   2.795   3.944
  322    HD2  TYR   3           HD2      TYR   3 -15.116  -0.543   6.485
  323    HE1  TYR   3           HE1      TYR   3 -14.608   4.256   5.343
  324    HE2  TYR   3           HE2      TYR   3 -13.682   0.919   7.882
  325    HH   TYR   3           HH       TYR   3 -13.824   4.106   7.954
  326    H    LEU   4           H        LEU   4 -15.938  -2.858   3.089
  327    HA   LEU   4           HA       LEU   4 -13.711  -3.444   4.792
  328   1HB   LEU   4          1HB       LEU   4 -15.681  -4.967   4.298
  329   2HB   LEU   4          2HB       LEU   4 -14.944  -5.289   2.732
  330    HG   LEU   4           HG       LEU   4 -12.812  -5.908   4.108
  331   1HD1  LEU   4          1HD1      LEU   4 -14.978  -5.995   6.229
  332   2HD1  LEU   4          2HD1      LEU   4 -13.427  -5.162   6.302
  333   3HD1  LEU   4          3HD1      LEU   4 -13.484  -6.920   6.352
  334   1HD2  LEU   4          1HD2      LEU   4 -15.272  -7.680   4.251
  335   2HD2  LEU   4          2HD2      LEU   4 -13.596  -8.223   4.335
  336   3HD2  LEU   4          3HD2      LEU   4 -14.222  -7.519   2.844
  337    H    LEU   5           H        LEU   5 -14.045  -3.249   1.267
  338    HA   LEU   5           HA       LEU   5 -11.479  -4.324   0.612
  339   1HB   LEU   5          1HB       LEU   5 -13.400  -2.463  -0.781
  340   2HB   LEU   5          2HB       LEU   5 -11.808  -2.759  -1.478
  341    HG   LEU   5           HG       LEU   5 -12.262  -5.204  -1.417
  342   1HD1  LEU   5          1HD1      LEU   5 -13.832  -5.402   0.374
  343   2HD1  LEU   5          2HD1      LEU   5 -14.716  -5.831  -1.090
  344   3HD1  LEU   5          3HD1      LEU   5 -14.929  -4.238  -0.366
  345   1HD2  LEU   5          1HD2      LEU   5 -13.915  -5.203  -3.254
  346   2HD2  LEU   5          2HD2      LEU   5 -12.752  -3.891  -3.450
  347   3HD2  LEU   5          3HD2      LEU   5 -14.372  -3.551  -2.842
  348    H    ASP   6           H        ASP   6 -12.531  -0.954   1.170
  349    HA   ASP   6           HA       ASP   6  -9.988   0.252   0.729
  350   1HB   ASP   6          1HB       ASP   6 -12.274   1.103   2.530
  351   2HB   ASP   6          2HB       ASP   6 -10.895   2.125   2.122
  352    H    GLY   7           H        GLY   7 -11.419  -1.216   3.619
  353   1HA   GLY   7          1HA       GLY   7  -9.438  -0.372   5.489
  354   2HA   GLY   7          2HA       GLY   7 -10.445  -1.808   5.667
  355    H    ILE   8           H        ILE   8  -9.659  -3.415   3.605
  356    HA   ILE   8           HA       ILE   8  -7.154  -4.455   4.536
  357    HB   ILE   8           HB       ILE   8  -8.665  -5.010   1.964
  358   1HG1  ILE   8          1HG1      ILE   8  -8.532  -6.622   4.529
  359   2HG1  ILE   8          2HG1      ILE   8  -9.823  -5.473   4.180
  360   1HG2  ILE   8          1HG2      ILE   8  -7.325  -7.189   2.122
  361   2HG2  ILE   8          2HG2      ILE   8  -6.299  -6.352   3.287
  362   3HG2  ILE   8          3HG2      ILE   8  -6.422  -5.756   1.632
  363   1HD1  ILE   8          1HD1      ILE   8 -10.274  -7.925   3.565
  364   2HD1  ILE   8          2HD1      ILE   8  -9.105  -7.698   2.263
  365   3HD1  ILE   8          3HD1      ILE   8 -10.578  -6.728   2.306
  366    H    LEU   9           H        LEU   9  -7.984  -2.687   1.533
  367    HA   LEU   9           HA       LEU   9  -5.313  -2.647   0.512
  368   1HB   LEU   9          1HB       LEU   9  -7.527  -0.620   0.077
  369   2HB   LEU   9          2HB       LEU   9  -6.104  -0.826  -0.940
  370    HG   LEU   9           HG       LEU   9  -8.014  -3.112  -0.414
  371   1HD1  LEU   9          1HD1      LEU   9  -9.353  -1.306  -1.362
  372   2HD1  LEU   9          2HD1      LEU   9  -9.076  -2.537  -2.595
  373   3HD1  LEU   9          3HD1      LEU   9  -8.148  -1.037  -2.620
  374   1HD2  LEU   9          1HD2      LEU   9  -7.097  -3.794  -2.697
  375   2HD2  LEU   9          2HD2      LEU   9  -5.931  -3.831  -1.378
  376   3HD2  LEU   9          3HD2      LEU   9  -5.923  -2.492  -2.525
  377    H    PHE  10           H        PHE  10  -7.084  -0.353   2.588
  378    HA   PHE  10           HA       PHE  10  -5.053   1.648   2.681
  379   1HB   PHE  10          1HB       PHE  10  -7.340   2.036   3.511
  380   2HB   PHE  10          2HB       PHE  10  -7.068   0.878   4.815
  381    HD1  PHE  10           HD1      PHE  10  -5.883   1.492   6.790
  382    HD2  PHE  10           HD2      PHE  10  -5.933   4.129   3.402
  383    HE1  PHE  10           HE1      PHE  10  -4.860   3.281   8.169
  384    HE2  PHE  10           HE2      PHE  10  -4.911   5.920   4.780
  385    HZ   PHE  10           HZ       PHE  10  -4.374   5.496   7.163
  386    H    ILE  11           H        ILE  11  -5.735  -0.992   5.011
  387    HA   ILE  11           HA       ILE  11  -3.506  -0.543   6.691
  388    HB   ILE  11           HB       ILE  11  -4.883  -3.142   5.948
  389   1HG1  ILE  11          1HG1      ILE  11  -5.131  -1.432   8.440
  390   2HG1  ILE  11          2HG1      ILE  11  -6.223  -1.296   7.062
  391   1HG2  ILE  11          1HG2      ILE  11  -2.742  -3.740   6.841
  392   2HG2  ILE  11          2HG2      ILE  11  -3.885  -3.897   8.175
  393   3HG2  ILE  11          3HG2      ILE  11  -2.832  -2.485   8.075
  394   1HD1  ILE  11          1HD1      ILE  11  -6.972  -3.565   7.327
  395   2HD1  ILE  11          2HD1      ILE  11  -7.039  -2.815   8.922
  396   3HD1  ILE  11          3HD1      ILE  11  -5.712  -3.903   8.515
  397    H    TYR  12           H        TYR  12  -3.757  -2.380   3.668
  398    HA   TYR  12           HA       TYR  12  -1.147  -3.518   3.703
  399   1HB   TYR  12          1HB       TYR  12  -2.838  -4.232   2.086
  400   2HB   TYR  12          2HB       TYR  12  -2.841  -2.629   1.350
  401    HD1  TYR  12           HD1      TYR  12  -0.769  -5.652   1.973
  402    HD2  TYR  12           HD2      TYR  12  -1.147  -1.966  -0.200
  403    HE1  TYR  12           HE1      TYR  12   1.134  -6.309   0.525
  404    HE2  TYR  12           HE2      TYR  12   0.755  -2.623  -1.649
  405    HH   TYR  12           HH       TYR  12   1.837  -4.817  -2.374
  406    H    GLY  13           H        GLY  13  -2.310  -0.369   2.511
  407   1HA   GLY  13          1HA       GLY  13   0.174   0.483   1.381
  408   2HA   GLY  13          2HA       GLY  13  -1.109   1.563   1.927
  409    H    VAL  14           H        VAL  14  -1.157   0.786   4.665
  410    HA   VAL  14           HA       VAL  14   0.990   2.405   5.685
  411    HB   VAL  14           HB       VAL  14  -0.873   0.501   7.135
  412   1HG1  VAL  14          1HG1      VAL  14   0.970   0.965   8.583
  413   2HG1  VAL  14          2HG1      VAL  14  -0.314   2.070   9.074
  414   3HG1  VAL  14          3HG1      VAL  14   1.024   2.657   8.086
  415   1HG2  VAL  14          1HG2      VAL  14  -1.015   3.475   6.554
  416   2HG2  VAL  14          2HG2      VAL  14  -2.096   2.629   7.660
  417   3HG2  VAL  14          3HG2      VAL  14  -2.103   2.231   5.942
  418    H    ILE  15           H        ILE  15   0.402  -1.122   5.778
  419    HA   ILE  15           HA       ILE  15   2.819  -1.734   7.200
  420    HB   ILE  15           HB       ILE  15   1.159  -3.452   5.330
  421   1HG1  ILE  15          1HG1      ILE  15   1.238  -3.349   8.361
  422   2HG1  ILE  15          2HG1      ILE  15   0.030  -2.510   7.386
  423   1HG2  ILE  15          1HG2      ILE  15   3.393  -4.118   7.265
  424   2HG2  ILE  15          2HG2      ILE  15   3.342  -4.450   5.535
  425   3HG2  ILE  15          3HG2      ILE  15   2.277  -5.326   6.630
  426   1HD1  ILE  15          1HD1      ILE  15  -0.613  -4.698   6.369
  427   2HD1  ILE  15          2HD1      ILE  15  -0.878  -4.657   8.112
  428   3HD1  ILE  15          3HD1      ILE  15   0.523  -5.503   7.452
  429    H    LEU  16           H        LEU  16   2.099  -1.380   3.745
  430    HA   LEU  16           HA       LEU  16   4.685  -2.396   2.907
  431   1HB   LEU  16          1HB       LEU  16   2.369  -2.085   1.590
  432   2HB   LEU  16          2HB       LEU  16   3.089  -0.541   1.164
  433    HG   LEU  16           HG       LEU  16   3.667  -2.106  -0.568
  434   1HD1  LEU  16          1HD1      LEU  16   5.460  -0.546   0.436
  435   2HD1  LEU  16          2HD1      LEU  16   6.008  -1.852  -0.612
  436   3HD1  LEU  16          3HD1      LEU  16   6.151  -2.008   1.138
  437   1HD2  LEU  16          1HD2      LEU  16   3.389  -4.114   1.188
  438   2HD2  LEU  16          2HD2      LEU  16   5.143  -3.958   1.282
  439   3HD2  LEU  16          3HD2      LEU  16   4.369  -4.290  -0.264
  440    H    THR  17           H        THR  17   3.306   0.844   3.420
  441    HA   THR  17           HA       THR  17   5.621   2.286   2.513
  442    HB   THR  17           HB       THR  17   3.632   3.200   4.607
  443    HG1  THR  17           HG1      THR  17   2.941   4.137   2.306
  444   1HG2  THR  17          1HG2      THR  17   5.707   4.569   4.182
  445   2HG2  THR  17          2HG2      THR  17   4.200   5.414   3.831
  446   3HG2  THR  17          3HG2      THR  17   5.170   4.755   2.513
  447    H    ALA  18           H        ALA  18   4.656   1.021   5.687
  448    HA   ALA  18           HA       ALA  18   6.683   2.251   7.248
  449   1HB   ALA  18          1HB       ALA  18   5.325  -0.441   7.546
  450   2HB   ALA  18          2HB       ALA  18   4.876   1.071   8.335
  451   3HB   ALA  18          3HB       ALA  18   6.382   0.262   8.771
  452    H    LEU  19           H        LEU  19   6.722  -0.934   5.612
  453    HA   LEU  19           HA       LEU  19   9.420  -1.572   6.334
  454   1HB   LEU  19          1HB       LEU  19   7.872  -2.435   3.871
  455   2HB   LEU  19          2HB       LEU  19   9.306  -3.227   4.518
  456    HG   LEU  19           HG       LEU  19   6.745  -2.863   6.100
  457   1HD1  LEU  19          1HD1      LEU  19   7.703  -5.246   4.486
  458   2HD1  LEU  19          2HD1      LEU  19   6.275  -4.263   4.156
  459   3HD1  LEU  19          3HD1      LEU  19   6.338  -5.269   5.603
  460   1HD2  LEU  19          1HD2      LEU  19   9.332  -4.373   6.522
  461   2HD2  LEU  19          2HD2      LEU  19   7.852  -4.879   7.333
  462   3HD2  LEU  19          3HD2      LEU  19   8.508  -3.271   7.623
  463    H    PHE  20           H        PHE  20   8.061   0.315   3.676
  464    HA   PHE  20           HA       PHE  20  10.490   0.488   2.148
  465   1HB   PHE  20          1HB       PHE  20   8.265   1.068   1.223
  466   2HB   PHE  20          2HB       PHE  20   8.186   2.457   2.306
  467    HD1  PHE  20           HD1      PHE  20   9.992   0.975  -0.574
  468    HD2  PHE  20           HD2      PHE  20   9.428   4.460   1.868
  469    HE1  PHE  20           HE1      PHE  20  11.273   2.329  -2.209
  470    HE2  PHE  20           HE2      PHE  20  10.710   5.816   0.237
  471    HZ   PHE  20           HZ       PHE  20  11.633   4.751  -1.802
  472    H    LEU  21           H        LEU  21   9.035   2.751   4.520
  473    HA   LEU  21           HA       LEU  21  11.245   4.587   4.450
  474   1HB   LEU  21          1HB       LEU  21   9.192   4.071   6.620
  475   2HB   LEU  21          2HB       LEU  21  10.288   5.450   6.587
  476    HG   LEU  21           HG       LEU  21   8.311   4.797   4.380
  477   1HD1  LEU  21          1HD1      LEU  21   8.120   6.878   6.578
  478   2HD1  LEU  21          2HD1      LEU  21   7.198   5.375   6.530
  479   3HD1  LEU  21          3HD1      LEU  21   6.942   6.606   5.294
  480   1HD2  LEU  21          1HD2      LEU  21  10.284   7.027   4.884
  481   2HD2  LEU  21          2HD2      LEU  21   8.808   7.364   3.981
  482   3HD2  LEU  21          3HD2      LEU  21   9.945   6.161   3.385
  483    H    ARG  22           H        ARG  22  10.491   1.847   6.609
  484    HA   ARG  22           HA       ARG  22  12.606   2.195   8.443
  485   1HB   ARG  22          1HB       ARG  22  10.776   0.460   8.590
  486   2HB   ARG  22          2HB       ARG  22  11.658  -0.481   7.387
  487   1HG   ARG  22          1HG       ARG  22  13.651  -0.472   8.877
  488   2HG   ARG  22          2HG       ARG  22  12.710   0.390  10.094
  489   1HD   ARG  22          1HD       ARG  22  11.088  -1.495  10.138
  490   2HD   ARG  22          2HD       ARG  22  12.100  -2.366   8.985
  491    HE   ARG  22           HE       ARG  22  13.834  -1.753  11.058
  492   1HH1  ARG  22          1HH1      ARG  22  10.764  -3.287  10.721
  493   2HH1  ARG  22          2HH1      ARG  22  10.988  -4.331  12.085
  494   1HH2  ARG  22          1HH2      ARG  22  14.146  -3.111  12.836
  495   2HH2  ARG  22          2HH2      ARG  22  12.903  -4.232  13.283
  496    H    VAL  23           H        VAL  23  12.632   0.609   5.256
  497    HA   VAL  23           HA       VAL  23  15.379  -0.256   5.434
  498    HB   VAL  23           HB       VAL  23  13.601   0.271   3.034
  499   1HG1  VAL  23          1HG1      VAL  23  15.855   0.385   2.244
  500   2HG1  VAL  23          2HG1      VAL  23  15.313  -1.258   1.903
  501   3HG1  VAL  23          3HG1      VAL  23  16.361  -0.944   3.287
  502   1HG2  VAL  23          1HG2      VAL  23  13.180  -2.077   3.059
  503   2HG2  VAL  23          2HG2      VAL  23  13.002  -1.559   4.735
  504   3HG2  VAL  23          3HG2      VAL  23  14.478  -2.373   4.216
  505    H    LYS  24           H        LYS  24  13.809   2.709   4.309
  506    HA   LYS  24           HA       LYS  24  16.064   3.885   3.025
  507   1HB   LYS  24          1HB       LYS  24  13.727   4.785   2.932
  508   2HB   LYS  24          2HB       LYS  24  13.909   5.322   4.603
  509   1HG   LYS  24          1HG       LYS  24  15.812   6.734   3.964
  510   2HG   LYS  24          2HG       LYS  24  15.681   6.176   2.295
  511   1HD   LYS  24          1HD       LYS  24  13.279   7.052   2.338
  512   2HD   LYS  24          2HD       LYS  24  13.704   7.853   3.851
  513   1HE   LYS  24          1HE       LYS  24  15.514   9.066   2.734
  514   2HE   LYS  24          2HE       LYS  24  15.171   8.224   1.222
  515   1HZ   LYS  24          1HZ       LYS  24  14.091  10.293   1.087
  516   2HZ   LYS  24          2HZ       LYS  24  13.452  10.164   2.656
  517   3HZ   LYS  24          3HZ       LYS  24  12.865   9.167   1.412
  518    H    PHE  25           H        PHE  25  15.028   3.904   6.425
  519    HA   PHE  25           HA       PHE  25  17.486   5.399   7.185
  520   1HB   PHE  25          1HB       PHE  25  15.102   4.480   8.822
  521   2HB   PHE  25          2HB       PHE  25  16.450   5.433   9.444
  522    HD1  PHE  25           HD1      PHE  25  13.237   5.589   7.910
  523    HD2  PHE  25           HD2      PHE  25  17.004   7.640   8.140
  524    HE1  PHE  25           HE1      PHE  25  12.153   7.669   7.106
  525    HE2  PHE  25           HE2      PHE  25  15.920   9.721   7.337
  526    HZ   PHE  25           HZ       PHE  25  13.494   9.736   6.819
  527    H    SER  26           H        SER  26  19.264   4.278   7.822
  528    HA   SER  26           HA       SER  26  19.196   1.391   8.089
  529   1HB   SER  26          1HB       SER  26  21.580   1.586   8.572
  530   2HB   SER  26          2HB       SER  26  21.172   2.649   7.227
  531    HG   SER  26           HG       SER  26  22.380   3.830   8.662
  532    H    ARG  27           H        ARG  27  18.667   4.003  10.259
  533    HA   ARG  27           HA       ARG  27  19.589   2.899  12.708
  534   1HB   ARG  27          1HB       ARG  27  17.237   4.703  12.087
  535   2HB   ARG  27          2HB       ARG  27  17.721   4.289  13.733
  536   1HG   ARG  27          1HG       ARG  27  19.993   5.184  13.268
  537   2HG   ARG  27          2HG       ARG  27  19.453   5.658  11.656
  538   1HD   ARG  27          1HD       ARG  27  18.332   6.659  14.289
  539   2HD   ARG  27          2HD       ARG  27  19.313   7.584  13.152
  540    HE   ARG  27           HE       ARG  27  17.151   6.740  11.636
  541   1HH1  ARG  27          1HH1      ARG  27  17.628   8.408  14.613
  542   2HH1  ARG  27          2HH1      ARG  27  16.171   9.336  14.479
  543   1HH2  ARG  27          1HH2      ARG  27  15.250   7.940  11.443
  544   2HH2  ARG  27          2HH2      ARG  27  14.825   9.071  12.684
  545    H    SER  28           H        SER  28  16.609   2.328  10.876
  546    HA   SER  28           HA       SER  28  15.258   0.794  12.880
  547   1HB   SER  28          1HB       SER  28  13.831   0.030  11.100
  548   2HB   SER  28          2HB       SER  28  14.249   1.701  10.735
  549    HG   SER  28           HG       SER  28  14.499   0.287   8.931
  550    H    ALA  29           H        ALA  29  17.609  -0.085  10.380
  551    HA   ALA  29           HA       ALA  29  17.446  -2.936  10.964
  552   1HB   ALA  29          1HB       ALA  29  18.158  -2.416   8.762
  553   2HB   ALA  29          2HB       ALA  29  19.630  -2.937   9.581
  554   3HB   ALA  29          3HB       ALA  29  19.320  -1.219   9.332
  555    H    ASP  30           H        ASP  30  19.681  -0.288  11.779
  556    HA   ASP  30           HA       ASP  30  20.439  -1.635  14.250
  557   1HB   ASP  30          1HB       ASP  30  21.880  -2.863  12.707
  558   2HB   ASP  30          2HB       ASP  30  22.467  -1.352  12.012
  Start of MODEL    7
    1   1H    ASP  -3          1H        ASP  -3 -22.712   7.354  -5.459
    2    HA   ASP  -3           HA       ASP  -3 -23.851   6.671  -7.803
    3   1HB   ASP  -3          1HB       ASP  -3 -22.037   7.934  -8.978
    4   2HB   ASP  -3          2HB       ASP  -3 -20.854   6.866  -8.222
    5    H    SER  -2           H        SER  -2 -23.766   4.377  -7.983
    6    HA   SER  -2           HA       SER  -2 -23.048   2.973  -5.593
    7   1HB   SER  -2          1HB       SER  -2 -23.510   1.788  -8.344
    8   2HB   SER  -2          2HB       SER  -2 -23.669   0.961  -6.797
    9    HG   SER  -2           HG       SER  -2 -25.268   2.999  -7.919
   10    H    LYS  -1           H        LYS  -1 -21.337   3.559  -8.613
   11    HA   LYS  -1           HA       LYS  -1 -19.226   1.624  -8.007
   12   1HB   LYS  -1          1HB       LYS  -1 -19.144   3.879 -10.027
   13   2HB   LYS  -1          2HB       LYS  -1 -18.179   2.404 -10.028
   14   1HG   LYS  -1          1HG       LYS  -1 -21.198   2.494 -10.315
   15   2HG   LYS  -1          2HG       LYS  -1 -20.064   2.299 -11.650
   16   1HD   LYS  -1          1HD       LYS  -1 -19.145   0.275 -10.319
   17   2HD   LYS  -1          2HD       LYS  -1 -20.636   0.387  -9.383
   18   1HE   LYS  -1          1HE       LYS  -1 -21.107  -1.159 -11.133
   19   2HE   LYS  -1          2HE       LYS  -1 -21.874   0.351 -11.623
   20   1HZ   LYS  -1          1HZ       LYS  -1 -19.121   0.058 -12.454
   21   2HZ   LYS  -1          2HZ       LYS  -1 -20.469   0.610 -13.328
   22   3HZ   LYS  -1          3HZ       LYS  -1 -20.189  -1.057 -13.157
   23    H    LEU   1           H        LEU   1 -19.975   4.288  -6.406
   24    HA   LEU   1           HA       LEU   1 -17.754   6.010  -6.402
   25   1HB   LEU   1          1HB       LEU   1 -19.819   6.403  -5.083
   26   2HB   LEU   1          2HB       LEU   1 -19.372   5.083  -4.005
   27    HG   LEU   1           HG       LEU   1 -17.274   6.320  -3.423
   28   1HD1  LEU   1          1HD1      LEU   1 -18.465   8.292  -5.369
   29   2HD1  LEU   1          2HD1      LEU   1 -16.793   7.753  -5.215
   30   3HD1  LEU   1          3HD1      LEU   1 -17.467   8.873  -4.036
   31   1HD2  LEU   1          1HD2      LEU   1 -18.353   7.871  -1.935
   32   2HD2  LEU   1          2HD2      LEU   1 -19.455   6.509  -2.138
   33   3HD2  LEU   1          3HD2      LEU   1 -19.748   8.018  -3.005
   34    H    CYS   2           H        CYS   2 -18.186   2.902  -4.740
   35    HA   CYS   2           HA       CYS   2 -15.756   2.944  -3.250
   36   1HB   CYS   2          1HB       CYS   2 -17.714   1.279  -3.083
   37   2HB   CYS   2          2HB       CYS   2 -16.964   0.443  -4.443
   38    H    TYR   3           H        TYR   3 -16.384   2.364  -6.627
   39    HA   TYR   3           HA       TYR   3 -13.949   0.970  -7.247
   40   1HB   TYR   3          1HB       TYR   3 -16.021   1.204  -8.725
   41   2HB   TYR   3          2HB       TYR   3 -15.448   2.827  -9.108
   42    HD1  TYR   3           HD1      TYR   3 -14.559  -0.782  -9.245
   43    HD2  TYR   3           HD2      TYR   3 -13.646   3.180 -10.636
   44    HE1  TYR   3           HE1      TYR   3 -13.006  -1.730 -10.932
   45    HE2  TYR   3           HE2      TYR   3 -12.095   2.231 -12.321
   46    HH   TYR   3           HH       TYR   3 -11.460   0.317 -13.362
   47    H    LEU   4           H        LEU   4 -14.703   4.336  -6.691
   48    HA   LEU   4           HA       LEU   4 -12.277   5.347  -7.948
   49   1HB   LEU   4          1HB       LEU   4 -14.206   6.811  -7.793
   50   2HB   LEU   4          2HB       LEU   4 -14.268   6.612  -6.043
   51    HG   LEU   4           HG       LEU   4 -12.163   7.785  -5.769
   52   1HD1  LEU   4          1HD1      LEU   4 -10.823   7.135  -7.600
   53   2HD1  LEU   4          2HD1      LEU   4 -11.161   8.831  -7.936
   54   3HD1  LEU   4          3HD1      LEU   4 -12.060   7.569  -8.779
   55   1HD2  LEU   4          1HD2      LEU   4 -14.067   9.157  -7.687
   56   2HD2  LEU   4          2HD2      LEU   4 -12.779   9.996  -6.823
   57   3HD2  LEU   4          3HD2      LEU   4 -14.092   9.233  -5.926
   58    H    LEU   5           H        LEU   5 -13.334   4.881  -4.557
   59    HA   LEU   5           HA       LEU   5 -10.840   5.723  -3.415
   60   1HB   LEU   5          1HB       LEU   5 -13.152   4.064  -2.406
   61   2HB   LEU   5          2HB       LEU   5 -11.701   4.261  -1.424
   62    HG   LEU   5           HG       LEU   5 -11.953   6.743  -1.635
   63   1HD1  LEU   5          1HD1      LEU   5 -14.464   5.890  -3.088
   64   2HD1  LEU   5          2HD1      LEU   5 -13.205   6.990  -3.648
   65   3HD1  LEU   5          3HD1      LEU   5 -14.298   7.487  -2.358
   66   1HD2  LEU   5          1HD2      LEU   5 -13.756   6.916  -0.021
   67   2HD2  LEU   5          2HD2      LEU   5 -12.880   5.418   0.293
   68   3HD2  LEU   5          3HD2      LEU   5 -14.431   5.374  -0.547
   69    H    ASP   6           H        ASP   6 -12.118   2.475  -4.180
   70    HA   ASP   6           HA       ASP   6  -9.828   1.026  -3.291
   71   1HB   ASP   6          1HB       ASP   6 -11.837   0.396  -5.475
   72   2HB   ASP   6          2HB       ASP   6 -10.645  -0.754  -4.867
   73    H    GLY   7           H        GLY   7 -10.582   2.573  -6.392
   74   1HA   GLY   7          1HA       GLY   7  -8.414   1.546  -7.901
   75   2HA   GLY   7          2HA       GLY   7  -9.179   3.107  -8.193
   76    H    ILE   8           H        ILE   8  -8.558   4.605  -6.024
   77    HA   ILE   8           HA       ILE   8  -5.818   5.285  -6.462
   78    HB   ILE   8           HB       ILE   8  -7.569   6.006  -4.093
   79   1HG1  ILE   8          1HG1      ILE   8  -7.111   7.466  -6.717
   80   2HG1  ILE   8          2HG1      ILE   8  -8.564   6.547  -6.324
   81   1HG2  ILE   8          1HG2      ILE   8  -5.184   6.480  -3.722
   82   2HG2  ILE   8          2HG2      ILE   8  -6.067   7.984  -3.966
   83   3HG2  ILE   8          3HG2      ILE   8  -5.095   7.311  -5.274
   84   1HD1  ILE   8          1HD1      ILE   8  -9.015   8.871  -5.840
   85   2HD1  ILE   8          2HD1      ILE   8  -7.527   9.015  -4.906
   86   3HD1  ILE   8          3HD1      ILE   8  -8.855   8.025  -4.302
   87    H    LEU   9           H        LEU   9  -7.333   3.747  -3.587
   88    HA   LEU   9           HA       LEU   9  -4.910   3.282  -2.191
   89   1HB   LEU   9          1HB       LEU   9  -7.369   1.507  -2.191
   90   2HB   LEU   9          2HB       LEU   9  -6.140   1.589  -0.934
   91    HG   LEU   9           HG       LEU   9  -7.766   4.002  -1.770
   92   1HD1  LEU   9          1HD1      LEU   9  -9.143   3.535   0.263
   93   2HD1  LEU   9          2HD1      LEU   9  -8.325   1.979   0.417
   94   3HD1  LEU   9          3HD1      LEU   9  -9.333   2.309  -0.991
   95   1HD2  LEU   9          1HD2      LEU   9  -5.813   4.643  -0.542
   96   2HD2  LEU   9          2HD2      LEU   9  -6.001   3.310   0.596
   97   3HD2  LEU   9          3HD2      LEU   9  -7.131   4.661   0.627
   98    H    PHE  10           H        PHE  10  -6.613   1.247  -4.567
   99    HA   PHE  10           HA       PHE  10  -4.849  -0.985  -4.436
  100   1HB   PHE  10          1HB       PHE  10  -7.056  -0.976  -5.603
  101   2HB   PHE  10          2HB       PHE  10  -6.354   0.040  -6.862
  102    HD1  PHE  10           HD1      PHE  10  -6.296  -3.305  -5.287
  103    HD2  PHE  10           HD2      PHE  10  -4.799  -0.857  -8.483
  104    HE1  PHE  10           HE1      PHE  10  -5.411  -5.326  -6.421
  105    HE2  PHE  10           HE2      PHE  10  -3.914  -2.878  -9.617
  106    HZ   PHE  10           HZ       PHE  10  -4.221  -5.113  -8.586
  107    H    ILE  11           H        ILE  11  -4.866   1.714  -6.801
  108    HA   ILE  11           HA       ILE  11  -2.468   1.019  -8.123
  109    HB   ILE  11           HB       ILE  11  -3.642   3.758  -7.563
  110   1HG1  ILE  11          1HG1      ILE  11  -3.699   2.100 -10.096
  111   2HG1  ILE  11          2HG1      ILE  11  -4.985   2.047  -8.891
  112   1HG2  ILE  11          1HG2      ILE  11  -1.356   4.136  -8.125
  113   2HG2  ILE  11          2HG2      ILE  11  -2.247   4.358  -9.630
  114   3HG2  ILE  11          3HG2      ILE  11  -1.367   2.857  -9.340
  115   1HD1  ILE  11          1HD1      ILE  11  -4.037   4.647 -10.104
  116   2HD1  ILE  11          2HD1      ILE  11  -5.532   4.339  -9.221
  117   3HD1  ILE  11          3HD1      ILE  11  -5.316   3.683 -10.843
  118    H    TYR  12           H        TYR  12  -2.971   2.869  -5.141
  119    HA   TYR  12           HA       TYR  12  -0.286   3.739  -4.765
  120   1HB   TYR  12          1HB       TYR  12  -2.138   4.598  -3.402
  121   2HB   TYR  12          2HB       TYR  12  -2.375   3.001  -2.693
  122    HD1  TYR  12           HD1      TYR  12  -0.197   5.968  -2.813
  123    HD2  TYR  12           HD2      TYR  12  -0.772   2.072  -1.095
  124    HE1  TYR  12           HE1      TYR  12   1.528   6.466  -1.101
  125    HE2  TYR  12           HE2      TYR  12   0.953   2.571   0.614
  126    HH   TYR  12           HH       TYR  12   2.642   3.993   1.157
  127    H    GLY  13           H        GLY  13  -1.897   0.693  -3.894
  128   1HA   GLY  13          1HA       GLY  13   0.283  -0.395  -2.388
  129   2HA   GLY  13          2HA       GLY  13  -0.994  -1.341  -3.151
  130    H    VAL  14           H        VAL  14  -0.537  -0.560  -5.846
  131    HA   VAL  14           HA       VAL  14   1.581  -2.376  -6.545
  132    HB   VAL  14           HB       VAL  14   0.103  -0.317  -8.209
  133   1HG1  VAL  14          1HG1      VAL  14   2.136  -0.806  -9.368
  134   2HG1  VAL  14          2HG1      VAL  14   0.904  -1.829 -10.109
  135   3HG1  VAL  14          3HG1      VAL  14   2.043  -2.518  -8.952
  136   1HG2  VAL  14          1HG2      VAL  14  -0.250  -3.297  -7.770
  137   2HG2  VAL  14          2HG2      VAL  14  -1.084  -2.385  -9.027
  138   3HG2  VAL  14          3HG2      VAL  14  -1.383  -2.021  -7.328
  139    H    ILE  15           H        ILE  15   1.369   1.191  -6.599
  140    HA   ILE  15           HA       ILE  15   4.029   1.540  -7.655
  141    HB   ILE  15           HB       ILE  15   2.322   3.467  -6.056
  142   1HG1  ILE  15          1HG1      ILE  15   2.690   3.219  -9.056
  143   2HG1  ILE  15          2HG1      ILE  15   1.310   2.551  -8.183
  144   1HG2  ILE  15          1HG2      ILE  15   4.770   3.846  -7.804
  145   2HG2  ILE  15          2HG2      ILE  15   4.634   4.199  -6.083
  146   3HG2  ILE  15          3HG2      ILE  15   3.745   5.171  -7.254
  147   1HD1  ILE  15          1HD1      ILE  15   0.811   4.839  -7.309
  148   2HD1  ILE  15          2HD1      ILE  15   0.706   4.740  -9.067
  149   3HD1  ILE  15          3HD1      ILE  15   2.120   5.470  -8.308
  150    H    LEU  16           H        LEU  16   2.735   1.380  -4.348
  151    HA   LEU  16           HA       LEU  16   5.231   2.167  -3.112
  152   1HB   LEU  16          1HB       LEU  16   2.733   2.057  -2.174
  153   2HB   LEU  16          2HB       LEU  16   3.227   0.446  -1.675
  154    HG   LEU  16           HG       LEU  16   3.668   1.928   0.165
  155   1HD1  LEU  16          1HD1      LEU  16   5.948   1.475   0.565
  156   2HD1  LEU  16          2HD1      LEU  16   6.367   1.613  -1.140
  157   3HD1  LEU  16          3HD1      LEU  16   5.450   0.221  -0.567
  158   1HD2  LEU  16          1HD2      LEU  16   3.844   3.978  -1.544
  159   2HD2  LEU  16          2HD2      LEU  16   5.570   3.656  -1.394
  160   3HD2  LEU  16          3HD2      LEU  16   4.616   4.037   0.036
  161    H    THR  17           H        THR  17   3.688  -0.985  -3.751
  162    HA   THR  17           HA       THR  17   5.784  -2.538  -2.543
  163    HB   THR  17           HB       THR  17   3.968  -3.416  -4.802
  164    HG1  THR  17           HG1      THR  17   2.498  -3.915  -3.194
  165   1HG2  THR  17          1HG2      THR  17   5.867  -4.905  -4.095
  166   2HG2  THR  17          2HG2      THR  17   4.273  -5.619  -3.850
  167   3HG2  THR  17          3HG2      THR  17   5.160  -4.952  -2.481
  168    H    ALA  18           H        ALA  18   5.277  -1.315  -5.834
  169    HA   ALA  18           HA       ALA  18   7.350  -2.779  -7.118
  170   1HB   ALA  18          1HB       ALA  18   7.346  -0.905  -8.774
  171   2HB   ALA  18          2HB       ALA  18   6.291   0.003  -7.690
  172   3HB   ALA  18          3HB       ALA  18   5.727  -1.505  -8.410
  173    H    LEU  19           H        LEU  19   7.461   0.435  -5.554
  174    HA   LEU  19           HA       LEU  19  10.274   0.833  -6.036
  175   1HB   LEU  19          1HB       LEU  19   8.553   1.995  -3.825
  176   2HB   LEU  19          2HB       LEU  19  10.099   2.630  -4.380
  177    HG   LEU  19           HG       LEU  19   7.710   2.305  -6.213
  178   1HD1  LEU  19          1HD1      LEU  19   7.342   4.737  -5.894
  179   2HD1  LEU  19          2HD1      LEU  19   8.590   4.750  -4.648
  180   3HD1  LEU  19          3HD1      LEU  19   7.102   3.837  -4.396
  181   1HD2  LEU  19          1HD2      LEU  19   9.698   2.536  -7.498
  182   2HD2  LEU  19          2HD2      LEU  19  10.377   3.729  -6.390
  183   3HD2  LEU  19          3HD2      LEU  19   9.026   4.163  -7.435
  184    H    PHE  20           H        PHE  20   8.481  -0.808  -3.482
  185    HA   PHE  20           HA       PHE  20  10.686  -1.023  -1.644
  186   1HB   PHE  20          1HB       PHE  20   8.386  -1.453  -0.915
  187   2HB   PHE  20          2HB       PHE  20   8.271  -2.821  -2.022
  188    HD1  PHE  20           HD1      PHE  20   9.646  -4.861  -1.652
  189    HD2  PHE  20           HD2      PHE  20   9.580  -1.625   1.173
  190    HE1  PHE  20           HE1      PHE  20  10.648  -6.341   0.068
  191    HE2  PHE  20           HE2      PHE  20  10.580  -3.106   2.892
  192    HZ   PHE  20           HZ       PHE  20  11.114  -5.464   2.340
  193    H    LEU  21           H        LEU  21   9.399  -3.307  -4.084
  194    HA   LEU  21           HA       LEU  21  11.421  -5.291  -3.685
  195   1HB   LEU  21          1HB       LEU  21   9.848  -4.653  -6.199
  196   2HB   LEU  21          2HB       LEU  21  10.731  -6.146  -5.900
  197    HG   LEU  21           HG       LEU  21   8.531  -5.157  -4.068
  198   1HD1  LEU  21          1HD1      LEU  21   8.386  -6.903  -6.531
  199   2HD1  LEU  21          2HD1      LEU  21   7.440  -5.461  -6.164
  200   3HD1  LEU  21          3HD1      LEU  21   7.156  -6.953  -5.268
  201   1HD2  LEU  21          1HD2      LEU  21  10.028  -7.768  -4.423
  202   2HD2  LEU  21          2HD2      LEU  21   8.468  -7.704  -3.607
  203   3HD2  LEU  21          3HD2      LEU  21   9.835  -6.807  -2.957
  204    H    ARG  22           H        ARG  22  11.254  -2.481  -5.857
  205    HA   ARG  22           HA       ARG  22  13.586  -3.006  -7.375
  206   1HB   ARG  22          1HB       ARG  22  11.930  -1.132  -7.763
  207   2HB   ARG  22          2HB       ARG  22  12.695  -0.269  -6.429
  208   1HG   ARG  22          1HG       ARG  22  14.875  -0.414  -7.613
  209   2HG   ARG  22          2HG       ARG  22  14.066  -1.203  -8.967
  210   1HD   ARG  22          1HD       ARG  22  12.566   0.807  -9.154
  211   2HD   ARG  22          2HD       ARG  22  13.561   1.600  -7.933
  212    HE   ARG  22           HE       ARG  22  15.386   0.785  -9.856
  213   1HH1  ARG  22          1HH1      ARG  22  12.464   2.614  -9.777
  214   2HH1  ARG  22          2HH1      ARG  22  12.899   3.615 -11.121
  215   1HH2  ARG  22          1HH2      ARG  22  15.970   2.081 -11.609
  216   2HH2  ARG  22          2HH2      ARG  22  14.885   3.314 -12.160
  217    H    VAL  23           H        VAL  23  13.226  -1.448  -4.196
  218    HA   VAL  23           HA       VAL  23  16.040  -0.827  -3.918
  219    HB   VAL  23           HB       VAL  23  13.836  -1.138  -1.855
  220   1HG1  VAL  23          1HG1      VAL  23  15.893  -1.453  -0.686
  221   2HG1  VAL  23          2HG1      VAL  23  15.475   0.245  -0.453
  222   3HG1  VAL  23          3HG1      VAL  23  16.706  -0.207  -1.632
  223   1HG2  VAL  23          1HG2      VAL  23  13.702   1.260  -1.929
  224   2HG2  VAL  23          2HG2      VAL  23  13.670   0.707  -3.603
  225   3HG2  VAL  23          3HG2      VAL  23  15.156   1.371  -2.923
  226    H    LYS  24           H        LYS  24  14.043  -3.633  -3.213
  227    HA   LYS  24           HA       LYS  24  15.782  -5.020  -1.460
  228   1HB   LYS  24          1HB       LYS  24  13.432  -5.707  -2.112
  229   2HB   LYS  24          2HB       LYS  24  14.092  -6.276  -3.641
  230   1HG   LYS  24          1HG       LYS  24  14.095  -8.230  -2.345
  231   2HG   LYS  24          2HG       LYS  24  15.746  -7.652  -2.151
  232   1HD   LYS  24          1HD       LYS  24  15.236  -6.709   0.017
  233   2HD   LYS  24          2HD       LYS  24  13.511  -7.010  -0.201
  234   1HE   LYS  24          1HE       LYS  24  15.638  -9.169  -0.107
  235   2HE   LYS  24          2HE       LYS  24  14.605  -8.717   1.251
  236   1HZ   LYS  24          1HZ       LYS  24  13.975 -10.245  -1.124
  237   2HZ   LYS  24          2HZ       LYS  24  12.807  -9.087  -0.696
  238   3HZ   LYS  24          3HZ       LYS  24  13.265 -10.287   0.415
  239    H    PHE  25           H        PHE  25  15.810  -4.741  -4.991
  240    HA   PHE  25           HA       PHE  25  18.206  -6.498  -5.144
  241   1HB   PHE  25          1HB       PHE  25  16.530  -5.179  -7.303
  242   2HB   PHE  25          2HB       PHE  25  17.906  -6.240  -7.603
  243    HD1  PHE  25           HD1      PHE  25  17.830  -8.630  -6.795
  244    HD2  PHE  25           HD2      PHE  25  14.386  -6.063  -6.743
  245    HE1  PHE  25           HE1      PHE  25  16.356 -10.612  -6.576
  246    HE2  PHE  25           HE2      PHE  25  12.912  -8.045  -6.523
  247    HZ   PHE  25           HZ       PHE  25  13.896 -10.319  -6.439
  248    H    SER  26           H        SER  26  20.195  -5.700  -5.994
  249    HA   SER  26           HA       SER  26  20.444  -2.843  -6.635
  250   1HB   SER  26          1HB       SER  26  20.669  -2.492  -4.327
  251   2HB   SER  26          2HB       SER  26  21.466  -4.042  -4.071
  252    HG   SER  26           HG       SER  26  22.866  -2.536  -5.805
  253    H    ARG  27           H        ARG  27  22.201  -5.847  -5.836
  254    HA   ARG  27           HA       ARG  27  24.592  -5.205  -7.254
  255   1HB   ARG  27          1HB       ARG  27  23.338  -7.923  -6.751
  256   2HB   ARG  27          2HB       ARG  27  25.009  -7.644  -7.243
  257   1HG   ARG  27          1HG       ARG  27  25.380  -6.311  -5.186
  258   2HG   ARG  27          2HG       ARG  27  23.723  -6.643  -4.685
  259   1HD   ARG  27          1HD       ARG  27  24.310  -9.125  -4.892
  260   2HD   ARG  27          2HD       ARG  27  25.993  -8.613  -5.012
  261    HE   ARG  27           HE       ARG  27  25.065  -7.334  -2.730
  262   1HH1  ARG  27          1HH1      ARG  27  25.153 -10.556  -3.953
  263   2HH1  ARG  27          2HH1      ARG  27  25.247 -11.290  -2.386
  264   1HH2  ARG  27          1HH2      ARG  27  25.187  -8.274  -0.677
  265   2HH2  ARG  27          2HH2      ARG  27  25.266  -9.998  -0.533
  266    H    SER  28           H        SER  28  21.561  -6.716  -8.311
  267    HA   SER  28           HA       SER  28  20.825  -7.303 -10.469
  268   1HB   SER  28          1HB       SER  28  21.064  -5.537 -12.087
  269   2HB   SER  28          2HB       SER  28  20.927  -4.771 -10.507
  270    HG   SER  28           HG       SER  28  22.686  -3.828 -11.301
  271    H    ALA  29           H        ALA  29  23.429  -8.465  -9.563
  272    HA   ALA  29           HA       ALA  29  25.265  -8.488 -11.777
  273   1HB   ALA  29          1HB       ALA  29  26.140 -10.581 -10.681
  274   2HB   ALA  29          2HB       ALA  29  24.808 -10.472  -9.530
  275   3HB   ALA  29          3HB       ALA  29  26.027  -9.199  -9.591
  276    H    ASP  30           H        ASP  30  22.420 -10.417 -10.964
  277    HA   ASP  30           HA       ASP  30  21.331 -12.120 -12.171
  278   1HB   ASP  30          1HB       ASP  30  22.391 -10.473 -14.489
  279   2HB   ASP  30          2HB       ASP  30  21.046 -11.612 -14.558
  280   1H    ASP  -3          1H        ASP  -3 -21.732  -8.931   5.831
  281    HA   ASP  -3           HA       ASP  -3 -21.086  -7.753   3.564
  282   1HB   ASP  -3          1HB       ASP  -3 -23.895  -8.223   4.612
  283   2HB   ASP  -3          2HB       ASP  -3 -23.465  -8.064   2.909
  284    H    SER  -2           H        SER  -2 -22.986  -6.155   6.088
  285    HA   SER  -2           HA       SER  -2 -23.872  -3.912   4.583
  286   1HB   SER  -2          1HB       SER  -2 -23.070  -4.001   7.507
  287   2HB   SER  -2          2HB       SER  -2 -24.071  -2.765   6.750
  288    HG   SER  -2           HG       SER  -2 -25.700  -4.062   6.968
  289    H    LYS  -1           H        LYS  -1 -22.861  -1.981   4.018
  290    HA   LYS  -1           HA       LYS  -1 -21.023  -0.638   3.420
  291   1HB   LYS  -1          1HB       LYS  -1 -20.178  -1.336   6.251
  292   2HB   LYS  -1          2HB       LYS  -1 -19.622   0.048   5.308
  293   1HG   LYS  -1          1HG       LYS  -1 -22.063   0.753   5.130
  294   2HG   LYS  -1          2HG       LYS  -1 -22.416  -0.480   6.341
  295   1HD   LYS  -1          1HD       LYS  -1 -20.645   0.620   7.803
  296   2HD   LYS  -1          2HD       LYS  -1 -20.642   1.951   6.645
  297   1HE   LYS  -1          1HE       LYS  -1 -23.032   2.323   7.018
  298   2HE   LYS  -1          2HE       LYS  -1 -23.094   0.944   8.117
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.629   2.047   9.618
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.889   3.123   9.243
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.362   3.318   8.527
  302    H    LEU   1           H        LEU   1 -20.792  -3.319   2.578
  303    HA   LEU   1           HA       LEU   1 -18.433  -4.675   3.290
  304   1HB   LEU   1          1HB       LEU   1 -20.196  -5.554   1.752
  305   2HB   LEU   1          2HB       LEU   1 -19.620  -4.449   0.507
  306    HG   LEU   1           HG       LEU   1 -17.366  -5.527   0.648
  307   1HD1  LEU   1          1HD1      LEU   1 -18.803  -7.155   2.734
  308   2HD1  LEU   1          2HD1      LEU   1 -17.157  -6.524   2.746
  309   3HD1  LEU   1          3HD1      LEU   1 -17.551  -7.927   1.762
  310   1HD2  LEU   1          1HD2      LEU   1 -19.754  -7.294   0.038
  311   2HD2  LEU   1          2HD2      LEU   1 -18.101  -7.682  -0.436
  312   3HD2  LEU   1          3HD2      LEU   1 -18.892  -6.247  -1.089
  313    H    CYS   2           H        CYS   2 -18.880  -2.023   0.959
  314    HA   CYS   2           HA       CYS   2 -16.301  -1.965  -0.161
  315   1HB   CYS   2          1HB       CYS   2 -18.036  -0.499  -1.002
  316   2HB   CYS   2          2HB       CYS   2 -18.150   0.328   0.552
  317    H    TYR   3           H        TYR   3 -17.434  -0.664   2.939
  318    HA   TYR   3           HA       TYR   3 -15.122   0.801   3.656
  319   1HB   TYR   3          1HB       TYR   3 -17.361   0.655   4.898
  320   2HB   TYR   3          2HB       TYR   3 -16.750  -0.841   5.607
  321    HD1  TYR   3           HD1      TYR   3 -16.007   2.790   5.191
  322    HD2  TYR   3           HD2      TYR   3 -15.213  -0.796   7.420
  323    HE1  TYR   3           HE1      TYR   3 -14.732   4.109   6.860
  324    HE2  TYR   3           HE2      TYR   3 -13.938   0.524   9.088
  325    HH   TYR   3           HH       TYR   3 -13.643   2.708   9.864
  326    H    LEU   4           H        LEU   4 -15.747  -2.658   3.682
  327    HA   LEU   4           HA       LEU   4 -13.409  -3.336   5.265
  328   1HB   LEU   4          1HB       LEU   4 -15.450  -4.813   4.952
  329   2HB   LEU   4          2HB       LEU   4 -14.900  -5.100   3.303
  330    HG   LEU   4           HG       LEU   4 -12.624  -5.771   4.467
  331   1HD1  LEU   4          1HD1      LEU   4 -14.644  -6.120   6.706
  332   2HD1  LEU   4          2HD1      LEU   4 -13.202  -5.107   6.740
  333   3HD1  LEU   4          3HD1      LEU   4 -13.046  -6.860   6.683
  334   1HD2  LEU   4          1HD2      LEU   4 -15.083  -7.544   4.636
  335   2HD2  LEU   4          2HD2      LEU   4 -13.410  -8.101   4.623
  336   3HD2  LEU   4          3HD2      LEU   4 -14.087  -7.312   3.198
  337    H    LEU   5           H        LEU   5 -14.141  -3.314   1.771
  338    HA   LEU   5           HA       LEU   5 -11.672  -4.332   0.847
  339   1HB   LEU   5          1HB       LEU   5 -13.692  -2.422  -0.324
  340   2HB   LEU   5          2HB       LEU   5 -12.184  -2.731  -1.183
  341    HG   LEU   5           HG       LEU   5 -12.689  -5.190  -1.065
  342   1HD1  LEU   5          1HD1      LEU   5 -14.170  -5.281   0.831
  343   2HD1  LEU   5          2HD1      LEU   5 -15.113  -5.751  -0.583
  344   3HD1  LEU   5          3HD1      LEU   5 -15.282  -4.130   0.089
  345   1HD2  LEU   5          1HD2      LEU   5 -14.851  -3.502  -2.362
  346   2HD2  LEU   5          2HD2      LEU   5 -14.378  -5.134  -2.834
  347   3HD2  LEU   5          3HD2      LEU   5 -13.254  -3.793  -3.051
  348    H    ASP   6           H        ASP   6 -12.588  -0.943   1.521
  349    HA   ASP   6           HA       ASP   6 -10.045   0.184   0.863
  350   1HB   ASP   6          1HB       ASP   6 -12.145   1.131   2.838
  351   2HB   ASP   6          2HB       ASP   6 -10.791   2.104   2.264
  352    H    GLY   7           H        GLY   7 -11.313  -1.250   3.836
  353   1HA   GLY   7          1HA       GLY   7  -9.239  -0.448   5.603
  354   2HA   GLY   7          2HA       GLY   7 -10.203  -1.913   5.792
  355    H    ILE   8           H        ILE   8  -9.518  -3.485   3.711
  356    HA   ILE   8           HA       ILE   8  -6.945  -4.484   4.436
  357    HB   ILE   8           HB       ILE   8  -8.540  -4.968   1.901
  358   1HG1  ILE   8          1HG1      ILE   8  -8.387  -6.587   4.464
  359   2HG1  ILE   8          2HG1      ILE   8  -9.701  -5.475   4.078
  360   1HG2  ILE   8          1HG2      ILE   8  -6.239  -5.679   1.597
  361   2HG2  ILE   8          2HG2      ILE   8  -7.220  -7.116   1.881
  362   3HG2  ILE   8          3HG2      ILE   8  -6.227  -6.458   3.179
  363   1HD1  ILE   8          1HD1      ILE   8 -10.239  -6.765   2.066
  364   2HD1  ILE   8          2HD1      ILE   8 -10.261  -7.822   3.478
  365   3HD1  ILE   8          3HD1      ILE   8  -8.884  -7.850   2.379
  366    H    LEU   9           H        LEU   9  -7.953  -2.762   1.453
  367    HA   LEU   9           HA       LEU   9  -5.357  -2.563   0.325
  368   1HB   LEU   9          1HB       LEU   9  -7.618  -0.555   0.094
  369   2HB   LEU   9          2HB       LEU   9  -6.270  -0.737  -1.024
  370    HG   LEU   9           HG       LEU   9  -8.200  -2.990  -0.414
  371   1HD1  LEU   9          1HD1      LEU   9  -9.373  -0.995  -1.384
  372   2HD1  LEU   9          2HD1      LEU   9  -9.402  -2.408  -2.438
  373   3HD1  LEU   9          3HD1      LEU   9  -8.286  -1.084  -2.769
  374   1HD2  LEU   9          1HD2      LEU   9  -6.216  -3.853  -1.405
  375   2HD2  LEU   9          2HD2      LEU   9  -6.071  -2.484  -2.508
  376   3HD2  LEU   9          3HD2      LEU   9  -7.339  -3.683  -2.751
  377    H    PHE  10           H        PHE  10  -7.067  -0.358   2.552
  378    HA   PHE  10           HA       PHE  10  -5.010   1.632   2.620
  379   1HB   PHE  10          1HB       PHE  10  -7.353   1.937   3.478
  380   2HB   PHE  10          2HB       PHE  10  -6.931   0.916   4.853
  381    HD1  PHE  10           HD1      PHE  10  -5.786   3.969   3.009
  382    HD2  PHE  10           HD2      PHE  10  -5.951   1.886   6.762
  383    HE1  PHE  10           HE1      PHE  10  -4.778   5.930   4.141
  384    HE2  PHE  10           HE2      PHE  10  -4.943   3.849   7.895
  385    HZ   PHE  10           HZ       PHE  10  -4.356   5.870   6.585
  386    H    ILE  11           H        ILE  11  -5.729  -0.996   4.953
  387    HA   ILE  11           HA       ILE  11  -3.469  -0.605   6.608
  388    HB   ILE  11           HB       ILE  11  -4.931  -3.159   5.876
  389   1HG1  ILE  11          1HG1      ILE  11  -5.063  -1.485   8.397
  390   2HG1  ILE  11          2HG1      ILE  11  -6.171  -1.267   7.044
  391   1HG2  ILE  11          1HG2      ILE  11  -2.798  -2.588   7.945
  392   2HG2  ILE  11          2HG2      ILE  11  -2.807  -3.853   6.717
  393   3HG2  ILE  11          3HG2      ILE  11  -3.911  -3.949   8.089
  394   1HD1  ILE  11          1HD1      ILE  11  -5.752  -3.906   8.472
  395   2HD1  ILE  11          2HD1      ILE  11  -6.974  -3.542   7.254
  396   3HD1  ILE  11          3HD1      ILE  11  -7.061  -2.783   8.844
  397    H    TYR  12           H        TYR  12  -3.808  -2.428   3.590
  398    HA   TYR  12           HA       TYR  12  -1.237  -3.643   3.565
  399   1HB   TYR  12          1HB       TYR  12  -2.979  -4.265   1.960
  400   2HB   TYR  12          2HB       TYR  12  -2.927  -2.652   1.250
  401    HD1  TYR  12           HD1      TYR  12  -1.207  -2.015  -0.292
  402    HD2  TYR  12           HD2      TYR  12  -0.988  -5.776   1.774
  403    HE1  TYR  12           HE1      TYR  12   0.647  -2.723  -1.777
  404    HE2  TYR  12           HE2      TYR  12   0.865  -6.484   0.287
  405    HH   TYR  12           HH       TYR  12   2.733  -4.927  -1.191
  406    H    GLY  13           H        GLY  13  -2.298  -0.432   2.452
  407   1HA   GLY  13          1HA       GLY  13   0.271   0.308   1.371
  408   2HA   GLY  13          2HA       GLY  13  -1.028   1.429   1.777
  409    H    VAL  14           H        VAL  14  -1.257   0.759   4.551
  410    HA   VAL  14           HA       VAL  14   0.792   2.441   5.641
  411    HB   VAL  14           HB       VAL  14  -1.064   0.496   7.046
  412   1HG1  VAL  14          1HG1      VAL  14  -0.652   2.069   8.989
  413   2HG1  VAL  14          2HG1      VAL  14   0.657   2.781   8.046
  414   3HG1  VAL  14          3HG1      VAL  14   0.739   1.087   8.531
  415   1HG2  VAL  14          1HG2      VAL  14  -2.428   2.534   7.439
  416   2HG2  VAL  14          2HG2      VAL  14  -2.258   2.187   5.719
  417   3HG2  VAL  14          3HG2      VAL  14  -1.297   3.466   6.460
  418    H    ILE  15           H        ILE  15   0.341  -1.105   5.766
  419    HA   ILE  15           HA       ILE  15   2.686  -1.608   7.333
  420    HB   ILE  15           HB       ILE  15   1.281  -3.403   5.332
  421   1HG1  ILE  15          1HG1      ILE  15   1.034  -3.254   8.354
  422   2HG1  ILE  15          2HG1      ILE  15  -0.108  -2.509   7.238
  423   1HG2  ILE  15          1HG2      ILE  15   2.352  -5.216   6.735
  424   2HG2  ILE  15          2HG2      ILE  15   3.311  -3.958   7.515
  425   3HG2  ILE  15          3HG2      ILE  15   3.495  -4.265   5.788
  426   1HD1  ILE  15          1HD1      ILE  15   0.579  -5.462   7.265
  427   2HD1  ILE  15          2HD1      ILE  15  -0.654  -4.680   6.276
  428   3HD1  ILE  15          3HD1      ILE  15  -0.850  -4.764   8.026
  429    H    LEU  16           H        LEU  16   2.167  -1.521   3.804
  430    HA   LEU  16           HA       LEU  16   4.838  -2.307   3.127
  431   1HB   LEU  16          1HB       LEU  16   2.496  -1.773   1.722
  432   2HB   LEU  16          2HB       LEU  16   3.522  -0.438   1.230
  433    HG   LEU  16           HG       LEU  16   3.948  -2.106  -0.375
  434   1HD1  LEU  16          1HD1      LEU  16   6.216  -2.323  -0.247
  435   2HD1  LEU  16          2HD1      LEU  16   6.189  -2.996   1.380
  436   3HD1  LEU  16          3HD1      LEU  16   6.029  -1.259   1.141
  437   1HD2  LEU  16          1HD2      LEU  16   4.189  -4.143   1.866
  438   2HD2  LEU  16          2HD2      LEU  16   4.279  -4.473   0.137
  439   3HD2  LEU  16          3HD2      LEU  16   2.765  -3.924   0.851
  440    H    THR  17           H        THR  17   3.329   0.898   3.537
  441    HA   THR  17           HA       THR  17   5.630   2.442   2.864
  442    HB   THR  17           HB       THR  17   3.504   3.188   4.889
  443    HG1  THR  17           HG1      THR  17   3.361   3.916   2.208
  444   1HG2  THR  17          1HG2      THR  17   4.000   5.477   4.038
  445   2HG2  THR  17          2HG2      THR  17   5.296   4.799   3.053
  446   3HG2  THR  17          3HG2      THR  17   5.392   4.726   4.813
  447    H    ALA  18           H        ALA  18   4.563   1.094   5.989
  448    HA   ALA  18           HA       ALA  18   6.574   2.330   7.587
  449   1HB   ALA  18          1HB       ALA  18   6.199   0.295   9.100
  450   2HB   ALA  18          2HB       ALA  18   5.045  -0.262   7.888
  451   3HB   ALA  18          3HB       ALA  18   4.772   1.263   8.730
  452    H    LEU  19           H        LEU  19   6.547  -0.915   6.070
  453    HA   LEU  19           HA       LEU  19   9.235  -1.568   6.825
  454   1HB   LEU  19          1HB       LEU  19   7.651  -2.539   4.425
  455   2HB   LEU  19          2HB       LEU  19   9.086  -3.315   5.094
  456    HG   LEU  19           HG       LEU  19   6.532  -2.848   6.665
  457   1HD1  LEU  19          1HD1      LEU  19   6.179  -4.397   4.751
  458   2HD1  LEU  19          2HD1      LEU  19   6.055  -5.224   6.304
  459   3HD1  LEU  19          3HD1      LEU  19   7.517  -5.390   5.331
  460   1HD2  LEU  19          1HD2      LEU  19   7.664  -4.777   8.028
  461   2HD2  LEU  19          2HD2      LEU  19   8.276  -3.140   8.229
  462   3HD2  LEU  19          3HD2      LEU  19   9.140  -4.281   7.200
  463    H    PHE  20           H        PHE  20   7.912   0.251   4.108
  464    HA   PHE  20           HA       PHE  20  10.296   0.273   2.516
  465   1HB   PHE  20          1HB       PHE  20   8.121   0.996   1.616
  466   2HB   PHE  20          2HB       PHE  20   8.103   2.360   2.733
  467    HD1  PHE  20           HD1      PHE  20   9.785   0.897  -0.229
  468    HD2  PHE  20           HD2      PHE  20   9.465   4.307   2.363
  469    HE1  PHE  20           HE1      PHE  20  11.113   2.245  -1.834
  470    HE2  PHE  20           HE2      PHE  20  10.791   5.653   0.758
  471    HZ   PHE  20           HZ       PHE  20  11.615   4.623  -1.340
  472    H    LEU  21           H        LEU  21   9.061   2.647   4.899
  473    HA   LEU  21           HA       LEU  21  11.345   4.366   4.763
  474   1HB   LEU  21          1HB       LEU  21   9.458   3.881   7.089
  475   2HB   LEU  21          2HB       LEU  21  10.548   5.255   6.930
  476    HG   LEU  21           HG       LEU  21   8.408   4.589   4.888
  477   1HD1  LEU  21          1HD1      LEU  21   8.317   6.514   7.231
  478   2HD1  LEU  21          2HD1      LEU  21   7.330   5.067   7.028
  479   3HD1  LEU  21          3HD1      LEU  21   7.115   6.440   5.941
  480   1HD2  LEU  21          1HD2      LEU  21   8.777   7.140   4.469
  481   2HD2  LEU  21          2HD2      LEU  21   9.993   6.018   3.867
  482   3HD2  LEU  21          3HD2      LEU  21  10.284   6.916   5.355
  483    H    ARG  22           H        ARG  22  10.642   1.505   6.739
  484    HA   ARG  22           HA       ARG  22  12.797   1.688   8.558
  485   1HB   ARG  22          1HB       ARG  22  10.948  -0.042   8.586
  486   2HB   ARG  22          2HB       ARG  22  11.799  -0.879   7.287
  487   1HG   ARG  22          1HG       ARG  22  13.818  -1.015   8.748
  488   2HG   ARG  22          2HG       ARG  22  12.888  -0.280  10.053
  489   1HD   ARG  22          1HD       ARG  22  12.144  -2.864   8.651
  490   2HD   ARG  22          2HD       ARG  22  12.954  -2.767  10.215
  491    HE   ARG  22           HE       ARG  22  10.677  -1.218  10.547
  492   1HH1  ARG  22          1HH1      ARG  22  11.396  -4.410   9.465
  493   2HH1  ARG  22          2HH1      ARG  22   9.907  -5.084  10.037
  494   1HH2  ARG  22          1HH2      ARG  22   8.727  -2.079  11.303
  495   2HH2  ARG  22          2HH2      ARG  22   8.394  -3.763  11.076
  496    H    VAL  23           H        VAL  23  12.728   0.486   5.222
  497    HA   VAL  23           HA       VAL  23  15.491  -0.409   5.254
  498    HB   VAL  23           HB       VAL  23  13.608   0.243   2.967
  499   1HG1  VAL  23          1HG1      VAL  23  15.812   0.434   2.080
  500   2HG1  VAL  23          2HG1      VAL  23  15.296  -1.205   1.684
  501   3HG1  VAL  23          3HG1      VAL  23  16.395  -0.928   3.035
  502   1HG2  VAL  23          1HG2      VAL  23  12.994  -1.671   4.476
  503   2HG2  VAL  23          2HG2      VAL  23  14.542  -2.419   4.082
  504   3HG2  VAL  23          3HG2      VAL  23  13.337  -2.169   2.819
  505    H    LYS  24           H        LYS  24  13.828   2.598   4.460
  506    HA   LYS  24           HA       LYS  24  15.976   3.909   3.116
  507   1HB   LYS  24          1HB       LYS  24  13.584   4.723   3.271
  508   2HB   LYS  24          2HB       LYS  24  13.932   5.226   4.926
  509   1HG   LYS  24          1HG       LYS  24  15.862   6.584   4.008
  510   2HG   LYS  24          2HG       LYS  24  15.255   6.221   2.391
  511   1HD   LYS  24          1HD       LYS  24  13.011   7.161   3.168
  512   2HD   LYS  24          2HD       LYS  24  13.867   7.770   4.586
  513   1HE   LYS  24          1HE       LYS  24  14.630   8.388   1.718
  514   2HE   LYS  24          2HE       LYS  24  13.715   9.469   2.768
  515   1HZ   LYS  24          1HZ       LYS  24  16.537   8.827   2.780
  516   2HZ   LYS  24          2HZ       LYS  24  15.810   8.873   4.315
  517   3HZ   LYS  24          3HZ       LYS  24  15.740  10.232   3.297
  518    H    PHE  25           H        PHE  25  15.130   3.715   6.568
  519    HA   PHE  25           HA       PHE  25  17.625   5.183   7.268
  520   1HB   PHE  25          1HB       PHE  25  15.264   4.246   8.925
  521   2HB   PHE  25          2HB       PHE  25  16.678   5.059   9.596
  522    HD1  PHE  25           HD1      PHE  25  13.633   5.447   7.588
  523    HD2  PHE  25           HD2      PHE  25  17.175   7.409   9.025
  524    HE1  PHE  25           HE1      PHE  25  12.663   7.647   6.979
  525    HE2  PHE  25           HE2      PHE  25  16.204   9.608   8.416
  526    HZ   PHE  25           HZ       PHE  25  13.949   9.727   7.394
  527    H    SER  26           H        SER  26  19.413   4.075   7.891
  528    HA   SER  26           HA       SER  26  19.605   1.251   7.784
  529   1HB   SER  26          1HB       SER  26  21.513   2.938   7.723
  530   2HB   SER  26          2HB       SER  26  21.369   3.038   9.476
  531    HG   SER  26           HG       SER  26  22.911   1.469   8.771
  532    H    ARG  27           H        ARG  27  18.881   3.412  10.485
  533    HA   ARG  27           HA       ARG  27  19.094   1.432  12.557
  534   1HB   ARG  27          1HB       ARG  27  17.451   3.978  12.397
  535   2HB   ARG  27          2HB       ARG  27  17.664   3.023  13.863
  536   1HG   ARG  27          1HG       ARG  27  20.087   3.361  13.770
  537   2HG   ARG  27          2HG       ARG  27  19.923   4.250  12.254
  538   1HD   ARG  27          1HD       ARG  27  18.450   5.896  13.457
  539   2HD   ARG  27          2HD       ARG  27  18.831   5.058  14.962
  540    HE   ARG  27           HE       ARG  27  21.317   5.635  13.909
  541   1HH1  ARG  27          1HH1      ARG  27  18.434   7.405  14.566
  542   2HH1  ARG  27          2HH1      ARG  27  19.264   8.884  14.917
  543   1HH2  ARG  27          1HH2      ARG  27  22.418   7.554  14.366
  544   2HH2  ARG  27          2HH2      ARG  27  21.520   8.968  14.805
  545    H    SER  28           H        SER  28  17.459   0.123  13.484
  546    HA   SER  28           HA       SER  28  15.415  -0.803  11.665
  547   1HB   SER  28          1HB       SER  28  15.915  -1.343  14.603
  548   2HB   SER  28          2HB       SER  28  14.650  -2.139  13.674
  549    HG   SER  28           HG       SER  28  16.815  -3.189  13.835
  550    H    ALA  29           H        ALA  29  13.101  -0.611  11.955
  551    HA   ALA  29           HA       ALA  29  12.185   1.994  12.602
  552   1HB   ALA  29          1HB       ALA  29  10.745   0.754  11.214
  553   2HB   ALA  29          2HB       ALA  29   9.884   0.763  12.753
  554   3HB   ALA  29          3HB       ALA  29  10.801  -0.663  12.261
  555    H    ASP  30           H        ASP  30  12.060   2.919  14.575
  556    HA   ASP  30           HA       ASP  30  12.531   1.595  17.024
  557   1HB   ASP  30          1HB       ASP  30  10.827   4.079  16.725
  558   2HB   ASP  30          2HB       ASP  30  11.842   3.624  18.095
  Start of MODEL    8
    1   1H    ASP  -3          1H        ASP  -3 -21.284   8.917  -8.226
    2    HA   ASP  -3           HA       ASP  -3 -23.859   7.735  -7.801
    3   1HB   ASP  -3          1HB       ASP  -3 -23.025   6.293  -9.668
    4   2HB   ASP  -3          2HB       ASP  -3 -22.881   8.017 -10.016
    5    H    SER  -2           H        SER  -2 -23.969   5.272  -7.696
    6    HA   SER  -2           HA       SER  -2 -22.882   4.338  -5.244
    7   1HB   SER  -2          1HB       SER  -2 -23.771   2.603  -7.560
    8   2HB   SER  -2          2HB       SER  -2 -23.760   2.174  -5.853
    9    HG   SER  -2           HG       SER  -2 -25.327   4.171  -7.132
   10    H    LYS  -1           H        LYS  -1 -21.661   4.135  -8.543
   11    HA   LYS  -1           HA       LYS  -1 -19.608   2.186  -7.985
   12   1HB   LYS  -1          1HB       LYS  -1 -20.564   2.985 -10.277
   13   2HB   LYS  -1          2HB       LYS  -1 -19.391   4.294 -10.140
   14   1HG   LYS  -1          1HG       LYS  -1 -17.569   2.652  -9.915
   15   2HG   LYS  -1          2HG       LYS  -1 -18.735   1.333 -10.013
   16   1HD   LYS  -1          1HD       LYS  -1 -19.400   2.098 -12.269
   17   2HD   LYS  -1          2HD       LYS  -1 -18.204   3.392 -12.175
   18   1HE   LYS  -1          1HE       LYS  -1 -16.388   1.845 -12.135
   19   2HE   LYS  -1          2HE       LYS  -1 -17.464   0.480 -11.836
   20   1HZ   LYS  -1          1HZ       LYS  -1 -16.895   1.892 -14.319
   21   2HZ   LYS  -1          2HZ       LYS  -1 -18.498   1.378 -14.088
   22   3HZ   LYS  -1          3HZ       LYS  -1 -17.227   0.250 -14.056
   23    H    LEU   1           H        LEU   1 -19.960   4.977  -6.479
   24    HA   LEU   1           HA       LEU   1 -17.508   6.390  -6.829
   25   1HB   LEU   1          1HB       LEU   1 -19.391   7.389  -5.640
   26   2HB   LEU   1          2HB       LEU   1 -19.305   6.143  -4.396
   27    HG   LEU   1           HG       LEU   1 -17.102   6.939  -3.694
   28   1HD1  LEU   1          1HD1      LEU   1 -16.016   7.712  -5.632
   29   2HD1  LEU   1          2HD1      LEU   1 -16.376   9.210  -4.779
   30   3HD1  LEU   1          3HD1      LEU   1 -17.390   8.699  -6.128
   31   1HD2  LEU   1          1HD2      LEU   1 -18.893   9.354  -4.027
   32   2HD2  LEU   1          2HD2      LEU   1 -17.789   8.999  -2.698
   33   3HD2  LEU   1          3HD2      LEU   1 -19.262   8.050  -2.899
   34    H    CYS   2           H        CYS   2 -18.370   3.657  -4.730
   35    HA   CYS   2           HA       CYS   2 -16.020   3.587  -3.150
   36   1HB   CYS   2          1HB       CYS   2 -17.900   2.158  -2.611
   37   2HB   CYS   2          2HB       CYS   2 -17.765   1.323  -4.159
   38    H    TYR   3           H        TYR   3 -16.603   2.410  -6.433
   39    HA   TYR   3           HA       TYR   3 -14.271   0.831  -6.747
   40   1HB   TYR   3          1HB       TYR   3 -16.190   1.075  -8.395
   41   2HB   TYR   3          2HB       TYR   3 -15.464   2.603  -8.892
   42    HD1  TYR   3           HD1      TYR   3 -13.947   2.554 -10.679
   43    HD2  TYR   3           HD2      TYR   3 -14.455  -0.956  -8.253
   44    HE1  TYR   3           HE1      TYR   3 -12.369   1.316 -12.138
   45    HE2  TYR   3           HE2      TYR   3 -12.877  -2.192  -9.711
   46    HH   TYR   3           HH       TYR   3 -10.770  -0.820 -11.718
   47    H    LEU   4           H        LEU   4 -14.709   4.331  -6.856
   48    HA   LEU   4           HA       LEU   4 -12.119   4.929  -7.963
   49   1HB   LEU   4          1HB       LEU   4 -14.114   6.506  -7.825
   50   2HB   LEU   4          2HB       LEU   4 -13.747   6.688  -6.112
   51    HG   LEU   4           HG       LEU   4 -11.325   7.272  -6.939
   52   1HD1  LEU   4          1HD1      LEU   4 -12.987   7.704  -9.442
   53   2HD1  LEU   4          2HD1      LEU   4 -11.529   6.727  -9.280
   54   3HD1  LEU   4          3HD1      LEU   4 -11.431   8.481  -9.166
   55   1HD2  LEU   4          1HD2      LEU   4 -11.950   9.642  -7.122
   56   2HD2  LEU   4          2HD2      LEU   4 -12.889   8.861  -5.851
   57   3HD2  LEU   4          3HD2      LEU   4 -13.629   9.190  -7.418
   58    H    LEU   5           H        LEU   5 -13.326   4.577  -4.638
   59    HA   LEU   5           HA       LEU   5 -10.940   5.437  -3.321
   60   1HB   LEU   5          1HB       LEU   5 -13.246   3.657  -2.541
   61   2HB   LEU   5          2HB       LEU   5 -11.859   3.817  -1.465
   62    HG   LEU   5           HG       LEU   5 -12.152   6.292  -1.507
   63   1HD1  LEU   5          1HD1      LEU   5 -14.549   5.537  -3.193
   64   2HD1  LEU   5          2HD1      LEU   5 -13.239   6.642  -3.613
   65   3HD1  LEU   5          3HD1      LEU   5 -14.409   7.092  -2.374
   66   1HD2  LEU   5          1HD2      LEU   5 -14.619   4.716  -0.707
   67   2HD2  LEU   5          2HD2      LEU   5 -14.197   6.323  -0.117
   68   3HD2  LEU   5          3HD2      LEU   5 -13.178   4.941   0.284
   69    H    ASP   6           H        ASP   6 -12.024   2.170  -4.282
   70    HA   ASP   6           HA       ASP   6  -9.697   0.807  -3.330
   71   1HB   ASP   6          1HB       ASP   6 -11.626   0.114  -5.565
   72   2HB   ASP   6          2HB       ASP   6 -10.397  -0.988  -4.942
   73    H    GLY   7           H        GLY   7 -10.438   2.340  -6.444
   74   1HA   GLY   7          1HA       GLY   7  -8.177   1.423  -7.891
   75   2HA   GLY   7          2HA       GLY   7  -9.008   2.947  -8.204
   76    H    ILE   8           H        ILE   8  -8.546   4.402  -5.936
   77    HA   ILE   8           HA       ILE   8  -5.841   5.278  -6.291
   78    HB   ILE   8           HB       ILE   8  -7.735   5.816  -3.981
   79   1HG1  ILE   8          1HG1      ILE   8  -7.214   7.424  -6.504
   80   2HG1  ILE   8          2HG1      ILE   8  -8.618   6.385  -6.264
   81   1HG2  ILE   8          1HG2      ILE   8  -5.429   6.417  -3.432
   82   2HG2  ILE   8          2HG2      ILE   8  -6.352   7.886  -3.736
   83   3HG2  ILE   8          3HG2      ILE   8  -5.256   7.264  -4.969
   84   1HD1  ILE   8          1HD1      ILE   8  -9.056   7.746  -4.127
   85   2HD1  ILE   8          2HD1      ILE   8  -9.359   8.561  -5.661
   86   3HD1  ILE   8          3HD1      ILE   8  -7.882   8.898  -4.759
   87    H    LEU   9           H        LEU   9  -7.352   3.641  -3.473
   88    HA   LEU   9           HA       LEU   9  -4.928   3.253  -2.045
   89   1HB   LEU   9          1HB       LEU   9  -7.363   1.447  -2.045
   90   2HB   LEU   9          2HB       LEU   9  -6.135   1.536  -0.786
   91    HG   LEU   9           HG       LEU   9  -7.751   3.954  -1.626
   92   1HD1  LEU   9          1HD1      LEU   9  -9.250   3.506   0.248
   93   2HD1  LEU   9          2HD1      LEU   9  -8.360   2.036   0.641
   94   3HD1  LEU   9          3HD1      LEU   9  -9.274   2.138  -0.864
   95   1HD2  LEU   9          1HD2      LEU   9  -6.048   3.231   0.777
   96   2HD2  LEU   9          2HD2      LEU   9  -7.157   4.600   0.777
   97   3HD2  LEU   9          3HD2      LEU   9  -5.810   4.562  -0.356
   98    H    PHE  10           H        PHE  10  -6.522   1.203  -4.481
   99    HA   PHE  10           HA       PHE  10  -4.714  -1.003  -4.268
  100   1HB   PHE  10          1HB       PHE  10  -6.867  -1.157  -5.457
  101   2HB   PHE  10          2HB       PHE  10  -6.273  -0.039  -6.685
  102    HD1  PHE  10           HD1      PHE  10  -5.456  -3.304  -5.040
  103    HD2  PHE  10           HD2      PHE  10  -5.109  -0.865  -8.560
  104    HE1  PHE  10           HE1      PHE  10  -4.405  -5.197  -6.249
  105    HE2  PHE  10           HE2      PHE  10  -4.059  -2.759  -9.768
  106    HZ   PHE  10           HZ       PHE  10  -3.705  -4.925  -8.612
  107    H    ILE  11           H        ILE  11  -4.771   1.597  -6.747
  108    HA   ILE  11           HA       ILE  11  -2.325   0.941  -7.982
  109    HB   ILE  11           HB       ILE  11  -3.563   3.672  -7.528
  110   1HG1  ILE  11          1HG1      ILE  11  -3.574   1.916  -9.997
  111   2HG1  ILE  11          2HG1      ILE  11  -4.868   1.891  -8.801
  112   1HG2  ILE  11          1HG2      ILE  11  -1.277   2.746  -9.283
  113   2HG2  ILE  11          2HG2      ILE  11  -1.264   4.040  -8.085
  114   3HG2  ILE  11          3HG2      ILE  11  -2.164   4.240  -9.588
  115   1HD1  ILE  11          1HD1      ILE  11  -3.970   4.256 -10.468
  116   2HD1  ILE  11          2HD1      ILE  11  -5.117   4.379  -9.132
  117   3HD1  ILE  11          3HD1      ILE  11  -5.521   3.419 -10.556
  118    H    TYR  12           H        TYR  12  -2.939   2.806  -5.041
  119    HA   TYR  12           HA       TYR  12  -0.298   3.794  -4.631
  120   1HB   TYR  12          1HB       TYR  12  -2.201   4.587  -3.305
  121   2HB   TYR  12          2HB       TYR  12  -2.395   2.984  -2.595
  122    HD1  TYR  12           HD1      TYR  12  -0.934   2.197  -0.845
  123    HD2  TYR  12           HD2      TYR  12  -0.187   5.954  -2.790
  124    HE1  TYR  12           HE1      TYR  12   0.728   2.770   0.903
  125    HE2  TYR  12           HE2      TYR  12   1.473   6.527  -1.041
  126    HH   TYR  12           HH       TYR  12   2.784   4.302   1.048
  127    H    GLY  13           H        GLY  13  -1.815   0.717  -3.676
  128   1HA   GLY  13          1HA       GLY  13   0.454  -0.259  -2.204
  129   2HA   GLY  13          2HA       GLY  13  -0.849  -1.256  -2.846
  130    H    VAL  14           H        VAL  14  -0.547  -0.630  -5.599
  131    HA   VAL  14           HA       VAL  14   1.507  -2.480  -6.340
  132    HB   VAL  14           HB       VAL  14   0.007  -0.419  -7.981
  133   1HG1  VAL  14          1HG1      VAL  14   1.969  -0.941  -9.231
  134   2HG1  VAL  14          2HG1      VAL  14   0.710  -1.988  -9.886
  135   3HG1  VAL  14          3HG1      VAL  14   1.904  -2.640  -8.764
  136   1HG2  VAL  14          1HG2      VAL  14  -1.308  -2.396  -8.684
  137   2HG2  VAL  14          2HG2      VAL  14  -1.397  -2.160  -6.939
  138   3HG2  VAL  14          3HG2      VAL  14  -0.348  -3.411  -7.607
  139    H    ILE  15           H        ILE  15   1.390   1.090  -6.595
  140    HA   ILE  15           HA       ILE  15   3.997   1.365  -7.731
  141    HB   ILE  15           HB       ILE  15   2.408   3.293  -6.012
  142   1HG1  ILE  15          1HG1      ILE  15   2.759   3.185  -9.022
  143   2HG1  ILE  15          2HG1      ILE  15   1.378   2.483  -8.180
  144   1HG2  ILE  15          1HG2      ILE  15   3.876   4.995  -7.201
  145   2HG2  ILE  15          2HG2      ILE  15   4.888   3.645  -7.713
  146   3HG2  ILE  15          3HG2      ILE  15   4.701   4.006  -5.998
  147   1HD1  ILE  15          1HD1      ILE  15   0.859   4.702  -7.205
  148   2HD1  ILE  15          2HD1      ILE  15   0.828   4.743  -8.967
  149   3HD1  ILE  15          3HD1      ILE  15   2.214   5.396  -8.094
  150    H    LEU  16           H        LEU  16   2.904   1.324  -4.341
  151    HA   LEU  16           HA       LEU  16   5.467   1.945  -3.224
  152   1HB   LEU  16          1HB       LEU  16   2.907   1.573  -2.226
  153   2HB   LEU  16          2HB       LEU  16   3.735   0.161  -1.598
  154    HG   LEU  16           HG       LEU  16   4.016   1.784   0.085
  155   1HD1  LEU  16          1HD1      LEU  16   6.289   1.842   0.333
  156   2HD1  LEU  16          2HD1      LEU  16   6.579   2.483  -1.281
  157   3HD1  LEU  16          3HD1      LEU  16   6.242   0.768  -1.059
  158   1HD2  LEU  16          1HD2      LEU  16   4.832   3.821  -2.013
  159   2HD2  LEU  16          2HD2      LEU  16   4.567   4.114  -0.297
  160   3HD2  LEU  16          3HD2      LEU  16   3.208   3.693  -1.337
  161    H    THR  17           H        THR  17   3.856  -1.182  -3.850
  162    HA   THR  17           HA       THR  17   5.923  -2.838  -2.820
  163    HB   THR  17           HB       THR  17   4.131  -3.473  -5.179
  164    HG1  THR  17           HG1      THR  17   3.142  -2.649  -3.151
  165   1HG2  THR  17          1HG2      THR  17   5.788  -5.171  -4.899
  166   2HG2  THR  17          2HG2      THR  17   4.326  -5.790  -4.134
  167   3HG2  THR  17          3HG2      THR  17   5.627  -5.134  -3.143
  168    H    ALA  18           H        ALA  18   5.494  -1.450  -6.073
  169    HA   ALA  18           HA       ALA  18   7.658  -2.811  -7.323
  170   1HB   ALA  18          1HB       ALA  18   5.955  -1.465  -8.544
  171   2HB   ALA  18          2HB       ALA  18   7.602  -1.015  -8.985
  172   3HB   ALA  18          3HB       ALA  18   6.675   0.004  -7.885
  173    H    LEU  19           H        LEU  19   7.604   0.383  -5.710
  174    HA   LEU  19           HA       LEU  19  10.416   0.879  -6.027
  175   1HB   LEU  19          1HB       LEU  19   8.577   1.898  -3.841
  176   2HB   LEU  19          2HB       LEU  19  10.106   2.618  -4.340
  177    HG   LEU  19           HG       LEU  19   7.767   2.259  -6.232
  178   1HD1  LEU  19          1HD1      LEU  19   8.541   4.746  -4.680
  179   2HD1  LEU  19          2HD1      LEU  19   7.162   3.716  -4.293
  180   3HD1  LEU  19          3HD1      LEU  19   7.206   4.594  -5.822
  181   1HD2  LEU  19          1HD2      LEU  19   9.792   2.598  -7.451
  182   2HD2  LEU  19          2HD2      LEU  19  10.370   3.806  -6.304
  183   3HD2  LEU  19          3HD2      LEU  19   9.029   4.184  -7.381
  184    H    PHE  20           H        PHE  20   8.550  -0.853  -3.586
  185    HA   PHE  20           HA       PHE  20  10.632  -1.063  -1.635
  186   1HB   PHE  20          1HB       PHE  20   8.284  -1.625  -1.137
  187   2HB   PHE  20          2HB       PHE  20   8.370  -2.991  -2.250
  188    HD1  PHE  20           HD1      PHE  20   9.489  -5.035  -1.651
  189    HD2  PHE  20           HD2      PHE  20   9.624  -1.625   0.958
  190    HE1  PHE  20           HE1      PHE  20  10.408  -6.458   0.161
  191    HE2  PHE  20           HE2      PHE  20  10.544  -3.047   2.770
  192    HZ   PHE  20           HZ       PHE  20  10.937  -5.463   2.371
  193    H    LEU  21           H        LEU  21   9.627  -3.389  -4.170
  194    HA   LEU  21           HA       LEU  21  11.782  -5.214  -3.693
  195   1HB   LEU  21          1HB       LEU  21  10.283  -4.702  -6.279
  196   2HB   LEU  21          2HB       LEU  21  11.224  -6.142  -5.899
  197    HG   LEU  21           HG       LEU  21   8.896  -5.238  -4.188
  198   1HD1  LEU  21          1HD1      LEU  21   7.915  -5.594  -6.336
  199   2HD1  LEU  21          2HD1      LEU  21   7.643  -7.087  -5.435
  200   3HD1  LEU  21          3HD1      LEU  21   8.926  -7.007  -6.642
  201   1HD2  LEU  21          1HD2      LEU  21  10.262  -6.834  -3.043
  202   2HD2  LEU  21          2HD2      LEU  21  10.477  -7.808  -4.496
  203   3HD2  LEU  21          3HD2      LEU  21   8.912  -7.759  -3.690
  204    H    ARG  22           H        ARG  22  11.487  -2.382  -5.814
  205    HA   ARG  22           HA       ARG  22  13.841  -2.710  -7.331
  206   1HB   ARG  22          1HB       ARG  22  12.117  -0.892  -7.627
  207   2HB   ARG  22          2HB       ARG  22  12.821  -0.077  -6.229
  208   1HG   ARG  22          1HG       ARG  22  15.026  -0.056  -7.398
  209   2HG   ARG  22          2HG       ARG  22  14.249  -0.764  -8.815
  210   1HD   ARG  22          1HD       ARG  22  14.358   1.637  -9.133
  211   2HD   ARG  22          2HD       ARG  22  12.674   1.192  -8.850
  212    HE   ARG  22           HE       ARG  22  13.614   1.805  -6.323
  213   1HH1  ARG  22          1HH1      ARG  22  13.581   3.333  -9.412
  214   2HH1  ARG  22          2HH1      ARG  22  13.511   4.938  -8.767
  215   1HH2  ARG  22          1HH2      ARG  22  13.521   3.892  -5.460
  216   2HH2  ARG  22          2HH2      ARG  22  13.475   5.256  -6.528
  217    H    VAL  23           H        VAL  23  13.435  -1.331  -4.075
  218    HA   VAL  23           HA       VAL  23  16.237  -0.642  -3.790
  219    HB   VAL  23           HB       VAL  23  14.096  -1.088  -1.686
  220   1HG1  VAL  23          1HG1      VAL  23  16.270  -1.246  -0.656
  221   2HG1  VAL  23          2HG1      VAL  23  15.652   0.370  -0.316
  222   3HG1  VAL  23          3HG1      VAL  23  16.865   0.137  -1.574
  223   1HG2  VAL  23          1HG2      VAL  23  13.669   0.724  -3.393
  224   2HG2  VAL  23          2HG2      VAL  23  15.167   1.492  -2.866
  225   3HG2  VAL  23          3HG2      VAL  23  13.822   1.319  -1.739
  226    H    LYS  24           H        LYS  24  14.299  -3.508  -3.132
  227    HA   LYS  24           HA       LYS  24  16.082  -4.892  -1.420
  228   1HB   LYS  24          1HB       LYS  24  13.759  -5.635  -2.064
  229   2HB   LYS  24          2HB       LYS  24  14.418  -6.145  -3.620
  230   1HG   LYS  24          1HG       LYS  24  15.898  -7.729  -2.553
  231   2HG   LYS  24          2HG       LYS  24  15.479  -7.116  -0.955
  232   1HD   LYS  24          1HD       LYS  24  14.241  -9.170  -1.342
  233   2HD   LYS  24          2HD       LYS  24  13.111  -7.818  -1.355
  234   1HE   LYS  24          1HE       LYS  24  12.865  -7.885  -3.698
  235   2HE   LYS  24          2HE       LYS  24  14.346  -8.817  -3.921
  236   1HZ   LYS  24          1HZ       LYS  24  11.866  -9.859  -3.849
  237   2HZ   LYS  24          2HZ       LYS  24  12.383 -10.101  -2.249
  238   3HZ   LYS  24          3HZ       LYS  24  13.288 -10.729  -3.542
  239    H    PHE  25           H        PHE  25  16.134  -4.451  -4.928
  240    HA   PHE  25           HA       PHE  25  18.483  -6.241  -5.194
  241   1HB   PHE  25          1HB       PHE  25  17.029  -4.565  -7.266
  242   2HB   PHE  25          2HB       PHE  25  18.288  -5.754  -7.601
  243    HD1  PHE  25           HD1      PHE  25  17.892  -8.178  -6.823
  244    HD2  PHE  25           HD2      PHE  25  14.769  -5.238  -7.080
  245    HE1  PHE  25           HE1      PHE  25  16.191  -9.983  -6.837
  246    HE2  PHE  25           HE2      PHE  25  13.071  -7.044  -7.095
  247    HZ   PHE  25           HZ       PHE  25  13.781  -9.416  -6.973
  248    H    SER  26           H        SER  26  20.508  -5.441  -4.958
  249    HA   SER  26           HA       SER  26  21.056  -2.691  -4.440
  250   1HB   SER  26          1HB       SER  26  23.066  -4.680  -5.510
  251   2HB   SER  26          2HB       SER  26  23.365  -3.303  -4.456
  252    HG   SER  26           HG       SER  26  22.329  -4.353  -2.808
  253    H    ARG  27           H        ARG  27  21.415  -4.627  -7.412
  254    HA   ARG  27           HA       ARG  27  22.612  -2.618  -9.020
  255   1HB   ARG  27          1HB       ARG  27  20.699  -4.845  -9.779
  256   2HB   ARG  27          2HB       ARG  27  21.603  -3.874 -10.943
  257   1HG   ARG  27          1HG       ARG  27  23.722  -4.600  -9.889
  258   2HG   ARG  27          2HG       ARG  27  22.809  -5.598  -8.758
  259   1HD   ARG  27          1HD       ARG  27  22.933  -5.906 -11.769
  260   2HD   ARG  27          2HD       ARG  27  23.559  -7.027 -10.559
  261    HE   ARG  27           HE       ARG  27  20.853  -6.819  -9.961
  262   1HH1  ARG  27          1HH1      ARG  27  22.780  -7.574 -12.717
  263   2HH1  ARG  27          2HH1      ARG  27  21.599  -8.627 -13.420
  264   1HH2  ARG  27          1HH2      ARG  27  19.297  -8.186 -10.863
  265   2HH2  ARG  27          2HH2      ARG  27  19.625  -8.973 -12.371
  266    H    SER  28           H        SER  28  19.247  -3.168  -8.112
  267    HA   SER  28           HA       SER  28  17.313  -1.904  -8.559
  268   1HB   SER  28          1HB       SER  28  18.472  -0.326  -7.104
  269   2HB   SER  28          2HB       SER  28  19.425   0.271  -8.461
  270    HG   SER  28           HG       SER  28  17.222   1.272  -7.680
  271    H    ALA  29           H        ALA  29  17.140   0.542 -10.084
  272    HA   ALA  29           HA       ALA  29  16.774  -0.505 -12.703
  273   1HB   ALA  29          1HB       ALA  29  17.027   2.320 -11.653
  274   2HB   ALA  29          2HB       ALA  29  15.563   1.467 -12.142
  275   3HB   ALA  29          3HB       ALA  29  16.732   1.981 -13.358
  276    H    ASP  30           H        ASP  30  19.492   1.271 -11.261
  277    HA   ASP  30           HA       ASP  30  20.988   1.191 -13.808
  278   1HB   ASP  30          1HB       ASP  30  21.083   3.141 -12.181
  279   2HB   ASP  30          2HB       ASP  30  21.982   2.085 -11.091
  280   1H    ASP  -3          1H        ASP  -3 -23.395  -6.722   4.667
  281    HA   ASP  -3           HA       ASP  -3 -24.490  -6.826   2.491
  282   1HB   ASP  -3          1HB       ASP  -3 -26.975  -6.682   2.484
  283   2HB   ASP  -3          2HB       ASP  -3 -26.400  -8.212   3.146
  284    H    SER  -2           H        SER  -2 -23.335  -4.980   4.440
  285    HA   SER  -2           HA       SER  -2 -24.502  -2.515   3.391
  286   1HB   SER  -2          1HB       SER  -2 -25.978  -3.026   5.342
  287   2HB   SER  -2          2HB       SER  -2 -24.559  -3.004   6.385
  288    HG   SER  -2           HG       SER  -2 -24.367  -0.810   5.072
  289    H    LYS  -1           H        LYS  -1 -23.032  -0.783   3.556
  290    HA   LYS  -1           HA       LYS  -1 -20.872   0.133   3.661
  291   1HB   LYS  -1          1HB       LYS  -1 -21.102  -1.239   6.352
  292   2HB   LYS  -1          2HB       LYS  -1 -19.775  -0.160   5.923
  293   1HG   LYS  -1          1HG       LYS  -1 -21.479   1.611   5.385
  294   2HG   LYS  -1          2HG       LYS  -1 -22.721   0.536   6.026
  295   1HD   LYS  -1          1HD       LYS  -1 -21.656   0.523   8.212
  296   2HD   LYS  -1          2HD       LYS  -1 -20.298   1.464   7.594
  297   1HE   LYS  -1          1HE       LYS  -1 -21.696   3.383   7.213
  298   2HE   LYS  -1          2HE       LYS  -1 -23.159   2.451   7.535
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.460   2.162   9.727
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.960   2.959   9.662
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.525   3.818   9.361
  302    H    LEU   1           H        LEU   1 -21.150  -2.570   2.469
  303    HA   LEU   1           HA       LEU   1 -19.011  -4.266   3.313
  304   1HB   LEU   1          1HB       LEU   1 -20.829  -5.014   1.802
  305   2HB   LEU   1          2HB       LEU   1 -20.210  -3.953   0.541
  306    HG   LEU   1           HG       LEU   1 -18.062  -5.200   0.561
  307   1HD1  LEU   1          1HD1      LEU   1 -18.299  -7.536   1.775
  308   2HD1  LEU   1          2HD1      LEU   1 -19.458  -6.674   2.786
  309   3HD1  LEU   1          3HD1      LEU   1 -17.786  -6.122   2.691
  310   1HD2  LEU   1          1HD2      LEU   1 -20.060  -5.830  -0.892
  311   2HD2  LEU   1          2HD2      LEU   1 -20.393  -7.109   0.274
  312   3HD2  LEU   1          3HD2      LEU   1 -18.879  -7.113  -0.629
  313    H    CYS   2           H        CYS   2 -19.138  -1.539   1.060
  314    HA   CYS   2           HA       CYS   2 -16.577  -1.812  -0.114
  315   1HB   CYS   2          1HB       CYS   2 -18.167  -0.150  -0.924
  316   2HB   CYS   2          2HB       CYS   2 -18.105   0.705   0.617
  317    H    TYR   3           H        TYR   3 -17.517  -0.573   3.052
  318    HA   TYR   3           HA       TYR   3 -15.068   0.694   3.754
  319   1HB   TYR   3          1HB       TYR   3 -17.217   0.786   5.074
  320   2HB   TYR   3          2HB       TYR   3 -16.881  -0.855   5.628
  321    HD1  TYR   3           HD1      TYR   3 -15.320  -1.269   7.381
  322    HD2  TYR   3           HD2      TYR   3 -15.542   2.622   5.575
  323    HE1  TYR   3           HE1      TYR   3 -13.831  -0.366   9.144
  324    HE2  TYR   3           HE2      TYR   3 -14.052   3.526   7.338
  325    HH   TYR   3           HH       TYR   3 -13.243   3.063   9.476
  326    H    LEU   4           H        LEU   4 -15.927  -2.670   3.478
  327    HA   LEU   4           HA       LEU   4 -13.722  -3.670   5.088
  328   1HB   LEU   4          1HB       LEU   4 -15.825  -4.964   4.616
  329   2HB   LEU   4          2HB       LEU   4 -15.314  -5.099   2.938
  330    HG   LEU   4           HG       LEU   4 -13.166  -6.175   3.791
  331   1HD1  LEU   4          1HD1      LEU   4 -13.041  -5.643   6.082
  332   2HD1  LEU   4          2HD1      LEU   4 -13.591  -7.314   6.104
  333   3HD1  LEU   4          3HD1      LEU   4 -14.742  -6.007   6.360
  334   1HD2  LEU   4          1HD2      LEU   4 -14.291  -8.374   4.167
  335   2HD2  LEU   4          2HD2      LEU   4 -14.953  -7.497   2.785
  336   3HD2  LEU   4          3HD2      LEU   4 -15.831  -7.525   4.314
  337    H    LEU   5           H        LEU   5 -14.296  -3.285   1.582
  338    HA   LEU   5           HA       LEU   5 -11.797  -4.372   0.738
  339   1HB   LEU   5          1HB       LEU   5 -13.737  -2.409  -0.486
  340   2HB   LEU   5          2HB       LEU   5 -12.206  -2.760  -1.286
  341    HG   LEU   5           HG       LEU   5 -12.792  -5.206  -1.191
  342   1HD1  LEU   5          1HD1      LEU   5 -14.362  -5.290   0.612
  343   2HD1  LEU   5          2HD1      LEU   5 -15.281  -5.652  -0.849
  344   3HD1  LEU   5          3HD1      LEU   5 -15.375  -4.047  -0.124
  345   1HD2  LEU   5          1HD2      LEU   5 -14.756  -3.372  -2.603
  346   2HD2  LEU   5          2HD2      LEU   5 -14.488  -5.070  -3.003
  347   3HD2  LEU   5          3HD2      LEU   5 -13.192  -3.894  -3.228
  348    H    ASP   6           H        ASP   6 -12.731  -0.996   1.455
  349    HA   ASP   6           HA       ASP   6 -10.168   0.142   0.915
  350   1HB   ASP   6          1HB       ASP   6 -12.325   1.044   2.849
  351   2HB   ASP   6          2HB       ASP   6 -10.949   2.026   2.346
  352    H    GLY   7           H        GLY   7 -11.517  -1.393   3.800
  353   1HA   GLY   7          1HA       GLY   7  -9.510  -0.632   5.660
  354   2HA   GLY   7          2HA       GLY   7 -10.467  -2.109   5.770
  355    H    ILE   8           H        ILE   8  -9.698  -3.623   3.689
  356    HA   ILE   8           HA       ILE   8  -7.123  -4.591   4.467
  357    HB   ILE   8           HB       ILE   8  -8.676  -5.094   1.910
  358   1HG1  ILE   8          1HG1      ILE   8  -8.496  -6.794   4.413
  359   2HG1  ILE   8          2HG1      ILE   8  -9.798  -5.638   4.132
  360   1HG2  ILE   8          1HG2      ILE   8  -6.383  -5.767   1.589
  361   2HG2  ILE   8          2HG2      ILE   8  -7.312  -7.228   1.924
  362   3HG2  ILE   8          3HG2      ILE   8  -6.319  -6.505   3.189
  363   1HD1  ILE   8          1HD1      ILE   8 -10.426  -7.931   3.412
  364   2HD1  ILE   8          2HD1      ILE   8  -9.078  -7.925   2.274
  365   3HD1  ILE   8          3HD1      ILE   8 -10.417  -6.795   2.063
  366    H    LEU   9           H        LEU   9  -8.111  -2.819   1.506
  367    HA   LEU   9           HA       LEU   9  -5.490  -2.611   0.410
  368   1HB   LEU   9          1HB       LEU   9  -7.779  -0.640   0.133
  369   2HB   LEU   9          2HB       LEU   9  -6.399  -0.785  -0.951
  370    HG   LEU   9           HG       LEU   9  -8.323  -3.061  -0.404
  371   1HD1  LEU   9          1HD1      LEU   9  -9.348  -2.494  -2.580
  372   2HD1  LEU   9          2HD1      LEU   9  -8.307  -1.076  -2.699
  373   3HD1  LEU   9          3HD1      LEU   9  -9.527  -1.171  -1.428
  374   1HD2  LEU   9          1HD2      LEU   9  -6.311  -3.946  -1.296
  375   2HD2  LEU   9          2HD2      LEU   9  -6.076  -2.571  -2.373
  376   3HD2  LEU   9          3HD2      LEU   9  -7.341  -3.749  -2.710
  377    H    PHE  10           H        PHE  10  -7.264  -0.440   2.613
  378    HA   PHE  10           HA       PHE  10  -5.256   1.599   2.697
  379   1HB   PHE  10          1HB       PHE  10  -7.544   1.971   3.523
  380   2HB   PHE  10          2HB       PHE  10  -7.274   0.806   4.820
  381    HD1  PHE  10           HD1      PHE  10  -6.141   4.069   3.431
  382    HD2  PHE  10           HD2      PHE  10  -6.103   1.414   6.809
  383    HE1  PHE  10           HE1      PHE  10  -5.127   5.854   4.824
  384    HE2  PHE  10           HE2      PHE  10  -5.088   3.198   8.200
  385    HZ   PHE  10           HZ       PHE  10  -4.601   5.418   7.208
  386    H    ILE  11           H        ILE  11  -5.912  -1.059   5.013
  387    HA   ILE  11           HA       ILE  11  -3.709  -0.579   6.715
  388    HB   ILE  11           HB       ILE  11  -5.032  -3.197   5.950
  389   1HG1  ILE  11          1HG1      ILE  11  -5.331  -1.543   8.467
  390   2HG1  ILE  11          2HG1      ILE  11  -6.378  -1.327   7.065
  391   1HG2  ILE  11          1HG2      ILE  11  -4.053  -3.910   8.215
  392   2HG2  ILE  11          2HG2      ILE  11  -2.989  -2.511   8.071
  393   3HG2  ILE  11          3HG2      ILE  11  -2.919  -3.800   6.870
  394   1HD1  ILE  11          1HD1      ILE  11  -5.959  -4.007   8.409
  395   2HD1  ILE  11          2HD1      ILE  11  -7.186  -3.583   7.215
  396   3HD1  ILE  11          3HD1      ILE  11  -7.270  -2.909   8.842
  397    H    TYR  12           H        TYR  12  -3.880  -2.525   3.737
  398    HA   TYR  12           HA       TYR  12  -1.224  -3.536   3.814
  399   1HB   TYR  12          1HB       TYR  12  -2.851  -4.373   2.196
  400   2HB   TYR  12          2HB       TYR  12  -2.941  -2.789   1.425
  401    HD1  TYR  12           HD1      TYR  12  -1.126  -1.958   0.022
  402    HD2  TYR  12           HD2      TYR  12  -0.851  -5.784   1.957
  403    HE1  TYR  12           HE1      TYR  12   0.818  -2.538  -1.405
  404    HE2  TYR  12           HE2      TYR  12   1.091  -6.366   0.529
  405    HH   TYR  12           HH       TYR  12   1.903  -5.554  -1.885
  406    H    GLY  13           H        GLY  13  -2.510  -0.449   2.629
  407   1HA   GLY  13          1HA       GLY  13  -0.092   0.485   1.422
  408   2HA   GLY  13          2HA       GLY  13  -1.401   1.517   1.997
  409    H    VAL  14           H        VAL  14  -1.366   0.866   4.732
  410    HA   VAL  14           HA       VAL  14   0.776   2.546   5.654
  411    HB   VAL  14           HB       VAL  14  -1.065   0.684   7.184
  412   1HG1  VAL  14          1HG1      VAL  14  -0.443   2.277   9.088
  413   2HG1  VAL  14          2HG1      VAL  14   0.893   2.814   8.069
  414   3HG1  VAL  14          3HG1      VAL  14   0.807   1.134   8.598
  415   1HG2  VAL  14          1HG2      VAL  14  -2.173   2.909   7.730
  416   2HG2  VAL  14          2HG2      VAL  14  -2.340   2.382   6.055
  417   3HG2  VAL  14          3HG2      VAL  14  -1.163   3.629   6.474
  418    H    ILE  15           H        ILE  15   0.260  -0.985   5.944
  419    HA   ILE  15           HA       ILE  15   2.688  -1.482   7.373
  420    HB   ILE  15           HB       ILE  15   1.173  -3.351   5.528
  421   1HG1  ILE  15          1HG1      ILE  15   0.929  -2.946   8.527
  422   2HG1  ILE  15          2HG1      ILE  15  -0.204  -2.294   7.345
  423   1HG2  ILE  15          1HG2      ILE  15   2.201  -5.096   7.005
  424   2HG2  ILE  15          2HG2      ILE  15   3.146  -3.828   7.783
  425   3HG2  ILE  15          3HG2      ILE  15   3.397  -4.192   6.076
  426   1HD1  ILE  15          1HD1      ILE  15  -0.690  -4.581   6.548
  427   2HD1  ILE  15          2HD1      ILE  15  -1.038  -4.422   8.270
  428   3HD1  ILE  15          3HD1      ILE  15   0.437  -5.232   7.738
  429    H    LEU  16           H        LEU  16   1.967  -1.474   3.884
  430    HA   LEU  16           HA       LEU  16   4.577  -2.408   3.105
  431   1HB   LEU  16          1HB       LEU  16   2.274  -2.160   1.766
  432   2HB   LEU  16          2HB       LEU  16   2.970  -0.614   1.305
  433    HG   LEU  16           HG       LEU  16   3.581  -2.202  -0.390
  434   1HD1  LEU  16          1HD1      LEU  16   5.921  -1.933  -0.423
  435   2HD1  LEU  16          2HD1      LEU  16   6.054  -2.051   1.329
  436   3HD1  LEU  16          3HD1      LEU  16   5.357  -0.609   0.593
  437   1HD2  LEU  16          1HD2      LEU  16   4.321  -4.372  -0.040
  438   2HD2  LEU  16          2HD2      LEU  16   3.301  -4.186   1.381
  439   3HD2  LEU  16          3HD2      LEU  16   5.049  -4.006   1.520
  440    H    THR  17           H        THR  17   3.193   0.830   3.573
  441    HA   THR  17           HA       THR  17   5.484   2.265   2.597
  442    HB   THR  17           HB       THR  17   3.501   3.193   4.692
  443    HG1  THR  17           HG1      THR  17   2.779   2.306   2.505
  444   1HG2  THR  17          1HG2      THR  17   4.021   5.417   3.747
  445   2HG2  THR  17          2HG2      THR  17   5.184   4.671   2.652
  446   3HG2  THR  17          3HG2      THR  17   5.466   4.638   4.393
  447    H    ALA  18           H        ALA  18   4.564   1.120   5.838
  448    HA   ALA  18           HA       ALA  18   6.649   2.382   7.297
  449   1HB   ALA  18          1HB       ALA  18   6.277   0.638   8.989
  450   2HB   ALA  18          2HB       ALA  18   5.388  -0.330   7.813
  451   3HB   ALA  18          3HB       ALA  18   4.736   1.216   8.357
  452    H    LEU  19           H        LEU  19   6.588  -0.865   5.792
  453    HA   LEU  19           HA       LEU  19   9.259  -1.583   6.504
  454   1HB   LEU  19          1HB       LEU  19   7.705  -2.396   4.028
  455   2HB   LEU  19          2HB       LEU  19   9.092  -3.246   4.706
  456    HG   LEU  19           HG       LEU  19   6.549  -2.751   6.274
  457   1HD1  LEU  19          1HD1      LEU  19   5.924  -5.072   5.720
  458   2HD1  LEU  19          2HD1      LEU  19   7.332  -5.200   4.665
  459   3HD1  LEU  19          3HD1      LEU  19   6.028  -4.081   4.264
  460   1HD2  LEU  19          1HD2      LEU  19   8.342  -3.302   7.747
  461   2HD2  LEU  19          2HD2      LEU  19   8.993  -4.507   6.637
  462   3HD2  LEU  19          3HD2      LEU  19   7.487  -4.821   7.497
  463    H    PHE  20           H        PHE  20   7.991   0.300   3.790
  464    HA   PHE  20           HA       PHE  20  10.430   0.372   2.287
  465   1HB   PHE  20          1HB       PHE  20   8.303   1.074   1.298
  466   2HB   PHE  20          2HB       PHE  20   8.180   2.401   2.455
  467    HD1  PHE  20           HD1      PHE  20   9.949   1.129  -0.518
  468    HD2  PHE  20           HD2      PHE  20   9.601   4.374   2.276
  469    HE1  PHE  20           HE1      PHE  20  11.303   2.567  -2.018
  470    HE2  PHE  20           HE2      PHE  20  10.955   5.811   0.775
  471    HZ   PHE  20           HZ       PHE  20  11.805   4.908  -1.371
  472    H    LEU  21           H        LEU  21   9.083   2.704   4.649
  473    HA   LEU  21           HA       LEU  21  11.336   4.464   4.602
  474   1HB   LEU  21          1HB       LEU  21   9.407   3.914   6.878
  475   2HB   LEU  21          2HB       LEU  21  10.456   5.323   6.738
  476    HG   LEU  21           HG       LEU  21   8.442   4.604   4.596
  477   1HD1  LEU  21          1HD1      LEU  21   7.091   4.887   6.539
  478   2HD1  LEU  21          2HD1      LEU  21   7.040   6.438   5.700
  479   3HD1  LEU  21          3HD1      LEU  21   8.072   6.235   7.115
  480   1HD2  LEU  21          1HD2      LEU  21  10.033   6.201   3.801
  481   2HD2  LEU  21          2HD2      LEU  21  10.025   7.087   5.325
  482   3HD2  LEU  21          3HD2      LEU  21   8.623   7.150   4.261
  483    H    ARG  22           H        ARG  22  10.577   1.661   6.666
  484    HA   ARG  22           HA       ARG  22  12.755   1.863   8.451
  485   1HB   ARG  22          1HB       ARG  22  10.863   0.194   8.574
  486   2HB   ARG  22          2HB       ARG  22  11.669  -0.723   7.302
  487   1HG   ARG  22          1HG       ARG  22  13.696  -0.883   8.734
  488   2HG   ARG  22          2HG       ARG  22  12.829  -0.035  10.017
  489   1HD   ARG  22          1HD       ARG  22  11.053  -1.870   9.828
  490   2HD   ARG  22          2HD       ARG  22  12.223  -2.759   8.853
  491    HE   ARG  22           HE       ARG  22  13.639  -2.079  11.138
  492   1HH1  ARG  22          1HH1      ARG  22  10.661  -3.653  10.399
  493   2HH1  ARG  22          2HH1      ARG  22  10.695  -4.667  11.803
  494   1HH2  ARG  22          1HH2      ARG  22  13.701  -3.394  12.975
  495   2HH2  ARG  22          2HH2      ARG  22  12.414  -4.519  13.262
  496    H    VAL  23           H        VAL  23  12.623   0.489   5.178
  497    HA   VAL  23           HA       VAL  23  15.345  -0.499   5.218
  498    HB   VAL  23           HB       VAL  23  13.481   0.182   2.925
  499   1HG1  VAL  23          1HG1      VAL  23  15.701   0.281   2.042
  500   2HG1  VAL  23          2HG1      VAL  23  15.095  -1.325   1.642
  501   3HG1  VAL  23          3HG1      VAL  23  16.213  -1.116   2.990
  502   1HG2  VAL  23          1HG2      VAL  23  13.012  -2.160   2.856
  503   2HG2  VAL  23          2HG2      VAL  23  12.904  -1.708   4.558
  504   3HG2  VAL  23          3HG2      VAL  23  14.342  -2.530   3.955
  505    H    LYS  24           H        LYS  24  13.858   2.596   4.529
  506    HA   LYS  24           HA       LYS  24  15.904   3.819   3.015
  507   1HB   LYS  24          1HB       LYS  24  13.632   4.798   3.631
  508   2HB   LYS  24          2HB       LYS  24  14.323   5.193   5.201
  509   1HG   LYS  24          1HG       LYS  24  14.682   7.178   4.009
  510   2HG   LYS  24          2HG       LYS  24  16.221   6.345   3.804
  511   1HD   LYS  24          1HD       LYS  24  15.617   5.615   1.584
  512   2HD   LYS  24          2HD       LYS  24  13.952   6.156   1.798
  513   1HE   LYS  24          1HE       LYS  24  16.316   8.035   1.943
  514   2HE   LYS  24          2HE       LYS  24  15.433   7.718   0.449
  515   1HZ   LYS  24          1HZ       LYS  24  14.157   9.400   1.159
  516   2HZ   LYS  24          2HZ       LYS  24  14.641   9.242   2.780
  517   3HZ   LYS  24          3HZ       LYS  24  13.434   8.226   2.146
  518    H    PHE  25           H        PHE  25  15.593   3.509   6.561
  519    HA   PHE  25           HA       PHE  25  18.538   3.892   6.775
  520   1HB   PHE  25          1HB       PHE  25  18.155   5.421   8.751
  521   2HB   PHE  25          2HB       PHE  25  17.711   6.123   7.194
  522    HD1  PHE  25           HD1      PHE  25  16.389   4.537  10.278
  523    HD2  PHE  25           HD2      PHE  25  15.430   6.656   6.667
  524    HE1  PHE  25           HE1      PHE  25  14.074   4.889  11.098
  525    HE2  PHE  25           HE2      PHE  25  13.117   7.008   7.486
  526    HZ   PHE  25           HZ       PHE  25  12.438   6.125   9.702
  527    H    SER  26           H        SER  26  19.439   2.747   8.502
  528    HA   SER  26           HA       SER  26  17.623   0.791   9.814
  529   1HB   SER  26          1HB       SER  26  20.647   0.944   9.671
  530   2HB   SER  26          2HB       SER  26  19.740  -0.345  10.456
  531    HG   SER  26           HG       SER  26  19.178   0.366   7.794
  532    H    ARG  27           H        ARG  27  18.090   3.755  10.590
  533    HA   ARG  27           HA       ARG  27  18.300   4.983  12.580
  534   1HB   ARG  27          1HB       ARG  27  17.612   2.299  13.820
  535   2HB   ARG  27          2HB       ARG  27  17.456   3.874  14.597
  536   1HG   ARG  27          1HG       ARG  27  15.893   4.548  12.735
  537   2HG   ARG  27          2HG       ARG  27  15.932   2.873  12.178
  538   1HD   ARG  27          1HD       ARG  27  15.191   2.185  14.498
  539   2HD   ARG  27          2HD       ARG  27  14.943   3.895  14.853
  540    HE   ARG  27           HE       ARG  27  13.514   3.482  12.511
  541   1HH1  ARG  27          1HH1      ARG  27  13.672   2.038  15.638
  542   2HH1  ARG  27          2HH1      ARG  27  12.004   1.575  15.654
  543   1HH2  ARG  27          1HH2      ARG  27  11.341   2.877  12.509
  544   2HH2  ARG  27          2HH2      ARG  27  10.683   2.047  13.879
  545    H    SER  28           H        SER  28  19.124   3.361  15.108
  546    HA   SER  28           HA       SER  28  21.159   3.160  16.275
  547   1HB   SER  28          1HB       SER  28  21.918   1.894  13.626
  548   2HB   SER  28          2HB       SER  28  22.841   1.737  15.119
  549    HG   SER  28           HG       SER  28  21.522   0.001  15.113
  550    H    ALA  29           H        ALA  29  21.556   5.480  16.311
  551    HA   ALA  29           HA       ALA  29  22.738   7.031  14.307
  552   1HB   ALA  29          1HB       ALA  29  23.199   7.107  17.302
  553   2HB   ALA  29          2HB       ALA  29  22.034   8.057  16.380
  554   3HB   ALA  29          3HB       ALA  29  23.762   8.357  16.193
  555    H    ASP  30           H        ASP  30  24.273   4.701  16.480
  556    HA   ASP  30           HA       ASP  30  26.481   3.894  16.541
  557   1HB   ASP  30          1HB       ASP  30  26.243   4.465  13.569
  558   2HB   ASP  30          2HB       ASP  30  27.428   3.396  14.321
  Start of MODEL    9
    1   1H    ASP  -3          1H        ASP  -3 -24.408   0.911  -2.822
    2    HA   ASP  -3           HA       ASP  -3 -25.901   1.121  -5.109
    3   1HB   ASP  -3          1HB       ASP  -3 -26.883   3.073  -3.927
    4   2HB   ASP  -3          2HB       ASP  -3 -26.629   1.708  -2.839
    5    H    SER  -2           H        SER  -2 -22.822   2.434  -4.680
    6    HA   SER  -2           HA       SER  -2 -23.218   4.208  -7.039
    7   1HB   SER  -2          1HB       SER  -2 -21.948   5.065  -4.422
    8   2HB   SER  -2          2HB       SER  -2 -21.843   5.981  -5.922
    9    HG   SER  -2           HG       SER  -2 -23.587   6.603  -4.485
   10    H    LYS  -1           H        LYS  -1 -21.380   4.314  -8.354
   11    HA   LYS  -1           HA       LYS  -1 -19.387   2.229  -7.908
   12   1HB   LYS  -1          1HB       LYS  -1 -20.395   3.028 -10.171
   13   2HB   LYS  -1          2HB       LYS  -1 -19.229   4.345 -10.060
   14   1HG   LYS  -1          1HG       LYS  -1 -17.382   2.751  -9.934
   15   2HG   LYS  -1          2HG       LYS  -1 -18.516   1.399  -9.918
   16   1HD   LYS  -1          1HD       LYS  -1 -19.366   2.186 -12.156
   17   2HD   LYS  -1          2HD       LYS  -1 -18.053   3.365 -12.177
   18   1HE   LYS  -1          1HE       LYS  -1 -16.391   1.606 -12.095
   19   2HE   LYS  -1          2HE       LYS  -1 -17.637   0.380 -11.863
   20   1HZ   LYS  -1          1HZ       LYS  -1 -17.215   2.067 -14.267
   21   2HZ   LYS  -1          2HZ       LYS  -1 -18.558   1.052 -14.043
   22   3HZ   LYS  -1          3HZ       LYS  -1 -16.996   0.390 -14.145
   23    H    LEU   1           H        LEU   1 -19.685   5.045  -6.407
   24    HA   LEU   1           HA       LEU   1 -17.219   6.415  -6.804
   25   1HB   LEU   1          1HB       LEU   1 -19.163   7.332  -5.529
   26   2HB   LEU   1          2HB       LEU   1 -18.825   6.182  -4.240
   27    HG   LEU   1           HG       LEU   1 -16.534   7.178  -4.014
   28   1HD1  LEU   1          1HD1      LEU   1 -16.000   8.220  -6.036
   29   2HD1  LEU   1          2HD1      LEU   1 -16.466   9.606  -5.057
   30   3HD1  LEU   1          3HD1      LEU   1 -17.605   8.928  -6.220
   31   1HD2  LEU   1          1HD2      LEU   1 -18.935   9.004  -3.702
   32   2HD2  LEU   1          2HD2      LEU   1 -17.358   9.325  -2.980
   33   3HD2  LEU   1          3HD2      LEU   1 -18.275   7.900  -2.495
   34    H    CYS   2           H        CYS   2 -18.075   3.628  -4.801
   35    HA   CYS   2           HA       CYS   2 -15.734   3.477  -3.215
   36   1HB   CYS   2          1HB       CYS   2 -17.710   2.016  -2.886
   37   2HB   CYS   2          2HB       CYS   2 -17.331   1.179  -4.391
   38    H    TYR   3           H        TYR   3 -16.318   2.438  -6.552
   39    HA   TYR   3           HA       TYR   3 -13.922   0.965  -6.950
   40   1HB   TYR   3          1HB       TYR   3 -15.873   1.185  -8.568
   41   2HB   TYR   3          2HB       TYR   3 -15.222   2.764  -9.011
   42    HD1  TYR   3           HD1      TYR   3 -13.343   2.962 -10.467
   43    HD2  TYR   3           HD2      TYR   3 -14.438  -0.872  -8.870
   44    HE1  TYR   3           HE1      TYR   3 -11.732   1.863 -12.000
   45    HE2  TYR   3           HE2      TYR   3 -12.827  -1.972 -10.402
   46    HH   TYR   3           HH       TYR   3 -10.868  -1.465 -11.678
   47    H    LEU   4           H        LEU   4 -14.515   4.392  -6.693
   48    HA   LEU   4           HA       LEU   4 -12.003   5.233  -7.867
   49   1HB   LEU   4          1HB       LEU   4 -14.036   6.703  -7.630
   50   2HB   LEU   4          2HB       LEU   4 -13.756   6.726  -5.893
   51    HG   LEU   4           HG       LEU   4 -11.442   7.631  -6.355
   52   1HD1  LEU   4          1HD1      LEU   4 -12.523   7.544  -9.166
   53   2HD1  LEU   4          2HD1      LEU   4 -10.911   7.142  -8.577
   54   3HD1  LEU   4          3HD1      LEU   4 -11.401   8.826  -8.713
   55   1HD2  LEU   4          1HD2      LEU   4 -12.353   9.931  -7.051
   56   2HD2  LEU   4          2HD2      LEU   4 -13.081   9.193  -5.625
   57   3HD2  LEU   4          3HD2      LEU   4 -13.928   9.147  -7.171
   58    H    LEU   5           H        LEU   5 -13.145   4.683  -4.530
   59    HA   LEU   5           HA       LEU   5 -10.688   5.490  -3.278
   60   1HB   LEU   5          1HB       LEU   5 -13.023   3.782  -2.410
   61   2HB   LEU   5          2HB       LEU   5 -11.600   3.939  -1.381
   62    HG   LEU   5           HG       LEU   5 -11.856   6.429  -1.486
   63   1HD1  LEU   5          1HD1      LEU   5 -14.330   5.637  -3.036
   64   2HD1  LEU   5          2HD1      LEU   5 -13.058   6.758  -3.521
   65   3HD1  LEU   5          3HD1      LEU   5 -14.180   7.201  -2.235
   66   1HD2  LEU   5          1HD2      LEU   5 -14.238   4.836  -0.484
   67   2HD2  LEU   5          2HD2      LEU   5 -13.881   6.500  -0.020
   68   3HD2  LEU   5          3HD2      LEU   5 -12.767   5.204   0.420
   69    H    ASP   6           H        ASP   6 -11.943   2.270  -4.209
   70    HA   ASP   6           HA       ASP   6  -9.661   0.798  -3.341
   71   1HB   ASP   6          1HB       ASP   6 -11.661   0.260  -5.554
   72   2HB   ASP   6          2HB       ASP   6 -10.436  -0.903  -5.047
   73    H    GLY   7           H        GLY   7 -10.371   2.478  -6.380
   74   1HA   GLY   7          1HA       GLY   7  -8.133   1.525  -7.863
   75   2HA   GLY   7          2HA       GLY   7  -8.955   3.057  -8.157
   76    H    ILE   8           H        ILE   8  -8.467   4.506  -5.899
   77    HA   ILE   8           HA       ILE   8  -5.737   5.314  -6.263
   78    HB   ILE   8           HB       ILE   8  -7.666   5.979  -4.019
   79   1HG1  ILE   8          1HG1      ILE   8  -6.972   7.528  -6.534
   80   2HG1  ILE   8          2HG1      ILE   8  -8.414   6.527  -6.364
   81   1HG2  ILE   8          1HG2      ILE   8  -5.392   6.512  -3.359
   82   2HG2  ILE   8          2HG2      ILE   8  -6.193   8.016  -3.811
   83   3HG2  ILE   8          3HG2      ILE   8  -5.064   7.248  -4.928
   84   1HD1  ILE   8          1HD1      ILE   8  -9.147   7.886  -4.449
   85   2HD1  ILE   8          2HD1      ILE   8  -8.906   8.902  -5.870
   86   3HD1  ILE   8          3HD1      ILE   8  -7.695   8.878  -4.588
   87    H    LEU   9           H        LEU   9  -7.334   3.606  -3.542
   88    HA   LEU   9           HA       LEU   9  -4.927   3.283  -2.022
   89   1HB   LEU   9          1HB       LEU   9  -7.371   1.486  -2.062
   90   2HB   LEU   9          2HB       LEU   9  -6.160   1.560  -0.786
   91    HG   LEU   9           HG       LEU   9  -7.780   3.970  -1.643
   92   1HD1  LEU   9          1HD1      LEU   9  -9.224   3.526   0.296
   93   2HD1  LEU   9          2HD1      LEU   9  -8.329   2.045   0.636
   94   3HD1  LEU   9          3HD1      LEU   9  -9.287   2.178  -0.839
   95   1HD2  LEU   9          1HD2      LEU   9  -5.976   3.312   0.699
   96   2HD2  LEU   9          2HD2      LEU   9  -7.154   4.620   0.779
   97   3HD2  LEU   9          3HD2      LEU   9  -5.866   4.671  -0.420
   98    H    PHE  10           H        PHE  10  -6.509   1.203  -4.445
   99    HA   PHE  10           HA       PHE  10  -4.673  -0.981  -4.209
  100   1HB   PHE  10          1HB       PHE  10  -6.856  -1.137  -5.385
  101   2HB   PHE  10          2HB       PHE  10  -6.229  -0.088  -6.657
  102    HD1  PHE  10           HD1      PHE  10  -5.648  -3.336  -4.911
  103    HD2  PHE  10           HD2      PHE  10  -4.914  -0.973  -8.422
  104    HE1  PHE  10           HE1      PHE  10  -4.634  -5.306  -6.023
  105    HE2  PHE  10           HE2      PHE  10  -3.901  -2.945  -9.535
  106    HZ   PHE  10           HZ       PHE  10  -3.759  -5.110  -8.335
  107    H    ILE  11           H        ILE  11  -4.765   1.694  -6.602
  108    HA   ILE  11           HA       ILE  11  -2.347   1.064  -7.922
  109    HB   ILE  11           HB       ILE  11  -3.626   3.753  -7.343
  110   1HG1  ILE  11          1HG1      ILE  11  -3.501   2.186  -9.928
  111   2HG1  ILE  11          2HG1      ILE  11  -4.814   1.990  -8.769
  112   1HG2  ILE  11          1HG2      ILE  11  -1.247   3.005  -9.054
  113   2HG2  ILE  11          2HG2      ILE  11  -1.340   4.250  -7.809
  114   3HG2  ILE  11          3HG2      ILE  11  -2.186   4.471  -9.340
  115   1HD1  ILE  11          1HD1      ILE  11  -4.010   4.691  -9.863
  116   2HD1  ILE  11          2HD1      ILE  11  -5.490   4.269  -9.000
  117   3HD1  ILE  11          3HD1      ILE  11  -5.227   3.679 -10.641
  118    H    TYR  12           H        TYR  12  -2.914   2.927  -4.957
  119    HA   TYR  12           HA       TYR  12  -0.262   3.829  -4.509
  120   1HB   TYR  12          1HB       TYR  12  -2.199   4.557  -3.146
  121   2HB   TYR  12          2HB       TYR  12  -2.307   2.940  -2.447
  122    HD1  TYR  12           HD1      TYR  12  -0.607   2.123  -0.880
  123    HD2  TYR  12           HD2      TYR  12  -0.375   6.070  -2.559
  124    HE1  TYR  12           HE1      TYR  12   1.092   2.742   0.817
  125    HE2  TYR  12           HE2      TYR  12   1.325   6.689  -0.861
  126    HH   TYR  12           HH       TYR  12   1.801   5.350   1.835
  127    H    GLY  13           H        GLY  13  -1.814   0.742  -3.635
  128   1HA   GLY  13          1HA       GLY  13   0.438  -0.327  -2.223
  129   2HA   GLY  13          2HA       GLY  13  -0.859  -1.285  -2.936
  130    H    VAL  14           H        VAL  14  -0.493  -0.432  -5.649
  131    HA   VAL  14           HA       VAL  14   1.593  -2.255  -6.436
  132    HB   VAL  14           HB       VAL  14   0.076  -0.184  -8.048
  133   1HG1  VAL  14          1HG1      VAL  14   2.068  -0.735  -9.261
  134   2HG1  VAL  14          2HG1      VAL  14   0.781  -1.717  -9.961
  135   3HG1  VAL  14          3HG1      VAL  14   1.931  -2.441  -8.838
  136   1HG2  VAL  14          1HG2      VAL  14  -1.329  -2.053  -8.700
  137   2HG2  VAL  14          2HG2      VAL  14  -1.269  -2.001  -6.938
  138   3HG2  VAL  14          3HG2      VAL  14  -0.304  -3.186  -7.820
  139    H    ILE  15           H        ILE  15   1.367   1.312  -6.509
  140    HA   ILE  15           HA       ILE  15   3.966   1.700  -7.660
  141    HB   ILE  15           HB       ILE  15   2.346   3.551  -5.884
  142   1HG1  ILE  15          1HG1      ILE  15   2.590   3.443  -8.908
  143   2HG1  ILE  15          2HG1      ILE  15   1.239   2.759  -8.004
  144   1HG2  ILE  15          1HG2      ILE  15   3.724   5.319  -7.046
  145   2HG2  ILE  15          2HG2      ILE  15   4.728   4.026  -7.702
  146   3HG2  ILE  15          3HG2      ILE  15   4.654   4.289  -5.959
  147   1HD1  ILE  15          1HD1      ILE  15   0.765   4.996  -7.043
  148   2HD1  ILE  15          2HD1      ILE  15   0.666   5.008  -8.804
  149   3HD1  ILE  15          3HD1      ILE  15   2.087   5.671  -7.997
  150    H    LEU  16           H        LEU  16   2.885   1.202  -4.338
  151    HA   LEU  16           HA       LEU  16   5.455   1.975  -3.197
  152   1HB   LEU  16          1HB       LEU  16   2.897   1.596  -2.181
  153   2HB   LEU  16          2HB       LEU  16   3.731   0.176  -1.578
  154    HG   LEU  16           HG       LEU  16   4.021   1.791   0.117
  155   1HD1  LEU  16          1HD1      LEU  16   6.291   1.801   0.358
  156   2HD1  LEU  16          2HD1      LEU  16   6.589   2.465  -1.245
  157   3HD1  LEU  16          3HD1      LEU  16   6.228   0.750  -1.052
  158   1HD2  LEU  16          1HD2      LEU  16   4.888   3.837  -1.949
  159   2HD2  LEU  16          2HD2      LEU  16   4.569   4.112  -0.240
  160   3HD2  LEU  16          3HD2      LEU  16   3.243   3.715  -1.328
  161    H    THR  17           H        THR  17   3.812  -1.118  -3.871
  162    HA   THR  17           HA       THR  17   5.888  -2.817  -2.917
  163    HB   THR  17           HB       THR  17   4.060  -3.403  -5.260
  164    HG1  THR  17           HG1      THR  17   2.475  -3.487  -3.897
  165   1HG2  THR  17          1HG2      THR  17   5.409  -5.131  -3.167
  166   2HG2  THR  17          2HG2      THR  17   5.785  -5.079  -4.890
  167   3HG2  THR  17          3HG2      THR  17   4.237  -5.722  -4.343
  168    H    ALA  18           H        ALA  18   5.412  -1.233  -6.053
  169    HA   ALA  18           HA       ALA  18   7.457  -2.580  -7.496
  170   1HB   ALA  18          1HB       ALA  18   6.828   0.355  -7.853
  171   2HB   ALA  18          2HB       ALA  18   5.702  -0.902  -8.366
  172   3HB   ALA  18          3HB       ALA  18   7.313  -0.817  -9.079
  173    H    LEU  19           H        LEU  19   7.632   0.444  -5.593
  174    HA   LEU  19           HA       LEU  19  10.478   0.770  -5.969
  175   1HB   LEU  19          1HB       LEU  19   8.717   1.816  -3.730
  176   2HB   LEU  19          2HB       LEU  19  10.320   2.414  -4.149
  177    HG   LEU  19           HG       LEU  19   8.028   2.388  -6.129
  178   1HD1  LEU  19          1HD1      LEU  19   8.904   4.656  -4.314
  179   2HD1  LEU  19          2HD1      LEU  19   7.405   3.743  -4.153
  180   3HD1  LEU  19          3HD1      LEU  19   7.671   4.754  -5.572
  181   1HD2  LEU  19          1HD2      LEU  19  10.117   2.667  -7.249
  182   2HD2  LEU  19          2HD2      LEU  19  10.743   3.732  -5.990
  183   3HD2  LEU  19          3HD2      LEU  19   9.476   4.299  -7.076
  184    H    PHE  20           H        PHE  20   8.518  -1.032  -3.683
  185    HA   PHE  20           HA       PHE  20  10.554  -1.475  -1.716
  186   1HB   PHE  20          1HB       PHE  20   8.165  -1.948  -1.299
  187   2HB   PHE  20          2HB       PHE  20   8.212  -3.242  -2.495
  188    HD1  PHE  20           HD1      PHE  20   9.548  -5.287  -2.088
  189    HD2  PHE  20           HD2      PHE  20   9.131  -2.228   0.898
  190    HE1  PHE  20           HE1      PHE  20  10.360  -6.866  -0.357
  191    HE2  PHE  20           HE2      PHE  20   9.943  -3.808   2.629
  192    HZ   PHE  20           HZ       PHE  20  10.557  -6.127   2.001
  193    H    LEU  21           H        LEU  21   9.470  -3.561  -4.428
  194    HA   LEU  21           HA       LEU  21  11.531  -5.519  -4.052
  195   1HB   LEU  21          1HB       LEU  21  10.106  -4.781  -6.625
  196   2HB   LEU  21          2HB       LEU  21  10.947  -6.293  -6.296
  197    HG   LEU  21           HG       LEU  21   8.642  -5.340  -4.582
  198   1HD1  LEU  21          1HD1      LEU  21   7.802  -5.505  -6.867
  199   2HD1  LEU  21          2HD1      LEU  21   7.222  -6.885  -5.934
  200   3HD1  LEU  21          3HD1      LEU  21   8.562  -7.084  -7.062
  201   1HD2  LEU  21          1HD2      LEU  21   9.913  -7.092  -3.535
  202   2HD2  LEU  21          2HD2      LEU  21  10.030  -7.999  -5.042
  203   3HD2  LEU  21          3HD2      LEU  21   8.482  -7.861  -4.214
  204    H    ARG  22           H        ARG  22  11.356  -2.608  -6.092
  205    HA   ARG  22           HA       ARG  22  13.730  -2.950  -7.560
  206   1HB   ARG  22          1HB       ARG  22  12.066  -1.070  -7.823
  207   2HB   ARG  22          2HB       ARG  22  12.775  -0.322  -6.391
  208   1HG   ARG  22          1HG       ARG  22  15.005  -0.363  -7.543
  209   2HG   ARG  22          2HG       ARG  22  14.194  -0.945  -8.998
  210   1HD   ARG  22          1HD       ARG  22  14.509   1.518  -9.037
  211   2HD   ARG  22          2HD       ARG  22  12.802   1.072  -9.061
  212    HE   ARG  22           HE       ARG  22  13.361   1.406  -6.368
  213   1HH1  ARG  22          1HH1      ARG  22  13.754   3.248  -9.255
  214   2HH1  ARG  22          2HH1      ARG  22  13.580   4.777  -8.460
  215   1HH2  ARG  22          1HH2      ARG  22  13.130   3.389  -5.315
  216   2HH2  ARG  22          2HH2      ARG  22  13.227   4.857  -6.230
  217    H    VAL  23           H        VAL  23  13.326  -1.613  -4.272
  218    HA   VAL  23           HA       VAL  23  16.148  -1.055  -3.940
  219    HB   VAL  23           HB       VAL  23  13.911  -1.406  -1.922
  220   1HG1  VAL  23          1HG1      VAL  23  15.932  -1.829  -0.730
  221   2HG1  VAL  23          2HG1      VAL  23  15.570  -0.127  -0.438
  222   3HG1  VAL  23          3HG1      VAL  23  16.804  -0.577  -1.615
  223   1HG2  VAL  23          1HG2      VAL  23  13.697   0.515  -3.489
  224   2HG2  VAL  23          2HG2      VAL  23  15.305   1.061  -3.012
  225   3HG2  VAL  23          3HG2      VAL  23  13.993   1.050  -1.834
  226    H    LYS  24           H        LYS  24  14.085  -3.847  -3.320
  227    HA   LYS  24           HA       LYS  24  15.841  -5.325  -1.649
  228   1HB   LYS  24          1HB       LYS  24  13.478  -5.964  -2.178
  229   2HB   LYS  24          2HB       LYS  24  14.009  -6.440  -3.790
  230   1HG   LYS  24          1HG       LYS  24  15.410  -8.172  -2.925
  231   2HG   LYS  24          2HG       LYS  24  15.253  -7.567  -1.275
  232   1HD   LYS  24          1HD       LYS  24  13.813  -9.514  -1.538
  233   2HD   LYS  24          2HD       LYS  24  12.805  -8.076  -1.368
  234   1HE   LYS  24          1HE       LYS  24  12.302  -8.021  -3.690
  235   2HE   LYS  24          2HE       LYS  24  13.612  -9.137  -4.082
  236   1HZ   LYS  24          1HZ       LYS  24  11.382  -9.936  -2.317
  237   2HZ   LYS  24          2HZ       LYS  24  12.458 -10.925  -3.184
  238   3HZ   LYS  24          3HZ       LYS  24  11.253 -10.052  -4.004
  239    H    PHE  25           H        PHE  25  15.759  -4.960  -5.176
  240    HA   PHE  25           HA       PHE  25  18.014  -6.849  -5.498
  241   1HB   PHE  25          1HB       PHE  25  16.447  -5.164  -7.472
  242   2HB   PHE  25          2HB       PHE  25  17.772  -6.237  -7.926
  243    HD1  PHE  25           HD1      PHE  25  17.608  -8.707  -7.237
  244    HD2  PHE  25           HD2      PHE  25  14.258  -6.020  -7.191
  245    HE1  PHE  25           HE1      PHE  25  16.057 -10.641  -7.248
  246    HE2  PHE  25           HE2      PHE  25  12.706  -7.955  -7.202
  247    HZ   PHE  25           HZ       PHE  25  13.605 -10.265  -7.231
  248    H    SER  26           H        SER  26  20.074  -6.145  -5.276
  249    HA   SER  26           HA       SER  26  20.719  -3.340  -5.011
  250   1HB   SER  26          1HB       SER  26  22.563  -5.710  -5.433
  251   2HB   SER  26          2HB       SER  26  23.050  -4.111  -4.878
  252    HG   SER  26           HG       SER  26  22.739  -5.234  -3.043
  253    H    ARG  27           H        ARG  27  21.031  -5.708  -7.630
  254    HA   ARG  27           HA       ARG  27  22.644  -4.186  -9.392
  255   1HB   ARG  27          1HB       ARG  27  20.364  -6.056 -10.108
  256   2HB   ARG  27          2HB       ARG  27  21.666  -5.550 -11.188
  257   1HG   ARG  27          1HG       ARG  27  23.317  -6.558  -9.620
  258   2HG   ARG  27          2HG       ARG  27  21.982  -7.134  -8.622
  259   1HD   ARG  27          1HD       ARG  27  22.593  -7.912 -11.485
  260   2HD   ARG  27          2HD       ARG  27  22.641  -8.953 -10.062
  261    HE   ARG  27           HE       ARG  27  20.031  -8.011 -10.118
  262   1HH1  ARG  27          1HH1      ARG  27  22.179  -9.591 -12.301
  263   2HH1  ARG  27          2HH1      ARG  27  20.920 -10.426 -13.146
  264   1HH2  ARG  27          1HH2      ARG  27  18.373  -9.088 -11.210
  265   2HH2  ARG  27          2HH2      ARG  27  18.764 -10.141 -12.530
  266    H    SER  28           H        SER  28  19.130  -4.105  -8.854
  267    HA   SER  28           HA       SER  28  17.508  -2.601  -9.661
  268   1HB   SER  28          1HB       SER  28  19.928  -0.789  -9.430
  269   2HB   SER  28          2HB       SER  28  18.283  -0.213  -9.687
  270    HG   SER  28           HG       SER  28  18.559  -2.025  -7.637
  271    H    ALA  29           H        ALA  29  19.182  -4.090 -11.650
  272    HA   ALA  29           HA       ALA  29  19.877  -2.437 -13.857
  273   1HB   ALA  29          1HB       ALA  29  18.973  -5.314 -13.670
  274   2HB   ALA  29          2HB       ALA  29  20.607  -4.702 -13.919
  275   3HB   ALA  29          3HB       ALA  29  19.410  -4.570 -15.208
  276    H    ASP  30           H        ASP  30  16.773  -3.838 -12.881
  277    HA   ASP  30           HA       ASP  30  15.403  -2.983 -15.302
  278   1HB   ASP  30          1HB       ASP  30  14.582  -4.881 -13.951
  279   2HB   ASP  30          2HB       ASP  30  14.286  -3.788 -12.599
  280   1H    ASP  -3          1H        ASP  -3 -22.276  -7.799   4.318
  281    HA   ASP  -3           HA       ASP  -3 -21.860  -7.814   2.033
  282   1HB   ASP  -3          1HB       ASP  -3 -23.635  -7.943   0.372
  283   2HB   ASP  -3          2HB       ASP  -3 -23.824  -9.281   1.506
  284    H    SER  -2           H        SER  -2 -24.056  -6.005   3.978
  285    HA   SER  -2           HA       SER  -2 -24.133  -3.652   2.257
  286   1HB   SER  -2          1HB       SER  -2 -25.870  -4.249   4.020
  287   2HB   SER  -2          2HB       SER  -2 -24.686  -3.768   5.232
  288    HG   SER  -2           HG       SER  -2 -26.299  -2.159   4.272
  289    H    LYS  -1           H        LYS  -1 -23.003  -1.663   2.669
  290    HA   LYS  -1           HA       LYS  -1 -21.029  -0.466   3.101
  291   1HB   LYS  -1          1HB       LYS  -1 -21.350  -1.939   5.733
  292   2HB   LYS  -1          2HB       LYS  -1 -20.264  -0.575   5.472
  293   1HG   LYS  -1          1HG       LYS  -1 -22.258   0.779   4.744
  294   2HG   LYS  -1          2HG       LYS  -1 -23.284  -0.569   5.236
  295   1HD   LYS  -1          1HD       LYS  -1 -22.334  -0.428   7.529
  296   2HD   LYS  -1          2HD       LYS  -1 -21.382   0.969   7.027
  297   1HE   LYS  -1          1HE       LYS  -1 -23.496   2.146   6.419
  298   2HE   LYS  -1          2HE       LYS  -1 -24.407   0.770   7.043
  299   1HZ   LYS  -1          1HZ       LYS  -1 -24.312   1.838   8.980
  300   2HZ   LYS  -1          2HZ       LYS  -1 -23.077   2.883   8.465
  301   3HZ   LYS  -1          3HZ       LYS  -1 -22.694   1.338   9.058
  302    H    LEU   1           H        LEU   1 -20.846  -3.277   1.989
  303    HA   LEU   1           HA       LEU   1 -18.563  -4.585   3.098
  304   1HB   LEU   1          1HB       LEU   1 -20.147  -5.624   1.458
  305   2HB   LEU   1          2HB       LEU   1 -19.473  -4.586   0.204
  306    HG   LEU   1           HG       LEU   1 -17.209  -5.576   0.684
  307   1HD1  LEU   1          1HD1      LEU   1 -17.461  -7.924   1.864
  308   2HD1  LEU   1          2HD1      LEU   1 -18.868  -7.180   2.622
  309   3HD1  LEU   1          3HD1      LEU   1 -17.267  -6.473   2.843
  310   1HD2  LEU   1          1HD2      LEU   1 -18.581  -6.384  -1.184
  311   2HD2  LEU   1          2HD2      LEU   1 -19.420  -7.500  -0.105
  312   3HD2  LEU   1          3HD2      LEU   1 -17.705  -7.728  -0.451
  313    H    CYS   2           H        CYS   2 -18.892  -2.000   0.700
  314    HA   CYS   2           HA       CYS   2 -16.288  -1.911  -0.333
  315   1HB   CYS   2          1HB       CYS   2 -17.993  -0.390  -1.151
  316   2HB   CYS   2          2HB       CYS   2 -18.120   0.383   0.430
  317    H    TYR   3           H        TYR   3 -17.469  -0.880   2.822
  318    HA   TYR   3           HA       TYR   3 -15.158   0.568   3.669
  319   1HB   TYR   3          1HB       TYR   3 -17.363   0.536   4.862
  320   2HB   TYR   3          2HB       TYR   3 -17.016  -1.112   5.382
  321    HD1  TYR   3           HD1      TYR   3 -15.859  -1.455   7.397
  322    HD2  TYR   3           HD2      TYR   3 -15.498   2.318   5.374
  323    HE1  TYR   3           HE1      TYR   3 -14.530  -0.565   9.292
  324    HE2  TYR   3           HE2      TYR   3 -14.169   3.206   7.269
  325    HH   TYR   3           HH       TYR   3 -12.915   2.529   9.111
  326    H    LEU   4           H        LEU   4 -15.828  -2.861   3.417
  327    HA   LEU   4           HA       LEU   4 -13.635  -3.724   5.102
  328   1HB   LEU   4          1HB       LEU   4 -15.591  -5.165   4.571
  329   2HB   LEU   4          2HB       LEU   4 -15.079  -5.213   2.886
  330    HG   LEU   4           HG       LEU   4 -12.916  -6.240   3.609
  331   1HD1  LEU   4          1HD1      LEU   4 -12.546  -5.630   5.837
  332   2HD1  LEU   4          2HD1      LEU   4 -13.123  -7.283   6.027
  333   3HD1  LEU   4          3HD1      LEU   4 -14.219  -5.931   6.308
  334   1HD2  LEU   4          1HD2      LEU   4 -13.836  -8.441   3.953
  335   2HD2  LEU   4          2HD2      LEU   4 -14.964  -7.563   2.920
  336   3HD2  LEU   4          3HD2      LEU   4 -15.320  -7.775   4.635
  337    H    LEU   5           H        LEU   5 -14.044  -3.291   1.584
  338    HA   LEU   5           HA       LEU   5 -11.459  -4.260   0.850
  339   1HB   LEU   5          1HB       LEU   5 -13.439  -2.386  -0.440
  340   2HB   LEU   5          2HB       LEU   5 -11.850  -2.624  -1.167
  341    HG   LEU   5           HG       LEU   5 -12.265  -5.085  -1.187
  342   1HD1  LEU   5          1HD1      LEU   5 -13.837  -5.363   0.595
  343   2HD1  LEU   5          2HD1      LEU   5 -14.712  -5.751  -0.887
  344   3HD1  LEU   5          3HD1      LEU   5 -14.947  -4.186  -0.108
  345   1HD2  LEU   5          1HD2      LEU   5 -14.291  -3.300  -2.566
  346   2HD2  LEU   5          2HD2      LEU   5 -14.045  -4.998  -2.974
  347   3HD2  LEU   5          3HD2      LEU   5 -12.738  -3.838  -3.206
  348    H    ASP   6           H        ASP   6 -12.593  -0.950   1.575
  349    HA   ASP   6           HA       ASP   6 -10.107   0.363   1.162
  350   1HB   ASP   6          1HB       ASP   6 -12.357   0.996   3.097
  351   2HB   ASP   6          2HB       ASP   6 -11.020   2.089   2.739
  352    H    GLY   7           H        GLY   7 -11.387  -1.380   3.958
  353   1HA   GLY   7          1HA       GLY   7  -9.354  -0.620   5.817
  354   2HA   GLY   7          2HA       GLY   7 -10.332  -2.085   5.930
  355    H    ILE   8           H        ILE   8  -9.606  -3.536   3.739
  356    HA   ILE   8           HA       ILE   8  -7.048  -4.577   4.509
  357    HB   ILE   8           HB       ILE   8  -8.617  -5.024   1.953
  358   1HG1  ILE   8          1HG1      ILE   8  -8.481  -6.683   4.492
  359   2HG1  ILE   8          2HG1      ILE   8  -9.794  -5.568   4.116
  360   1HG2  ILE   8          1HG2      ILE   8  -6.324  -5.730   1.644
  361   2HG2  ILE   8          2HG2      ILE   8  -7.290  -7.176   1.929
  362   3HG2  ILE   8          3HG2      ILE   8  -6.299  -6.508   3.226
  363   1HD1  ILE   8          1HD1      ILE   8  -8.963  -7.910   2.377
  364   2HD1  ILE   8          2HD1      ILE   8 -10.324  -6.827   2.085
  365   3HD1  ILE   8          3HD1      ILE   8 -10.342  -7.910   3.477
  366    H    LEU   9           H        LEU   9  -8.013  -2.736   1.587
  367    HA   LEU   9           HA       LEU   9  -5.381  -2.576   0.497
  368   1HB   LEU   9          1HB       LEU   9  -7.605  -0.537   0.203
  369   2HB   LEU   9          2HB       LEU   9  -6.243  -0.769  -0.889
  370    HG   LEU   9           HG       LEU   9  -8.230  -2.976  -0.291
  371   1HD1  LEU   9          1HD1      LEU   9  -9.373  -2.367  -2.368
  372   2HD1  LEU   9          2HD1      LEU   9  -8.268  -1.013  -2.603
  373   3HD1  LEU   9          3HD1      LEU   9  -9.401  -1.002  -1.251
  374   1HD2  LEU   9          1HD2      LEU   9  -6.217  -3.829  -1.271
  375   2HD2  LEU   9          2HD2      LEU   9  -6.121  -2.492  -2.417
  376   3HD2  LEU   9          3HD2      LEU   9  -7.377  -3.714  -2.590
  377    H    PHE  10           H        PHE  10  -7.137  -0.395   2.701
  378    HA   PHE  10           HA       PHE  10  -5.105   1.619   2.806
  379   1HB   PHE  10          1HB       PHE  10  -7.404   1.985   3.636
  380   2HB   PHE  10          2HB       PHE  10  -7.112   0.837   4.942
  381    HD1  PHE  10           HD1      PHE  10  -5.971   4.072   3.488
  382    HD2  PHE  10           HD2      PHE  10  -5.965   1.491   6.922
  383    HE1  PHE  10           HE1      PHE  10  -4.954   5.881   4.847
  384    HE2  PHE  10           HE2      PHE  10  -4.950   3.300   8.281
  385    HZ   PHE  10           HZ       PHE  10  -4.444   5.496   7.243
  386    H    ILE  11           H        ILE  11  -5.814  -1.007   5.146
  387    HA   ILE  11           HA       ILE  11  -3.578  -0.605   6.817
  388    HB   ILE  11           HB       ILE  11  -4.957  -3.193   6.036
  389   1HG1  ILE  11          1HG1      ILE  11  -5.226  -1.577   8.581
  390   2HG1  ILE  11          2HG1      ILE  11  -6.260  -1.296   7.181
  391   1HG2  ILE  11          1HG2      ILE  11  -3.983  -3.944   8.285
  392   2HG2  ILE  11          2HG2      ILE  11  -2.907  -2.553   8.166
  393   3HG2  ILE  11          3HG2      ILE  11  -2.843  -3.824   6.945
  394   1HD1  ILE  11          1HD1      ILE  11  -5.921  -4.011   8.480
  395   2HD1  ILE  11          2HD1      ILE  11  -7.108  -3.551   7.259
  396   3HD1  ILE  11          3HD1      ILE  11  -7.222  -2.894   8.892
  397    H    TYR  12           H        TYR  12  -3.833  -2.356   3.751
  398    HA   TYR  12           HA       TYR  12  -1.248  -3.555   3.750
  399   1HB   TYR  12          1HB       TYR  12  -3.027  -4.088   2.095
  400   2HB   TYR  12          2HB       TYR  12  -2.823  -2.487   1.384
  401    HD1  TYR  12           HD1      TYR  12  -0.723  -1.884   0.214
  402    HD2  TYR  12           HD2      TYR  12  -1.405  -5.845   1.732
  403    HE1  TYR  12           HE1      TYR  12   1.146  -2.735  -1.177
  404    HE2  TYR  12           HE2      TYR  12   0.464  -6.697   0.342
  405    HH   TYR  12           HH       TYR  12   2.311  -6.040  -0.858
  406    H    GLY  13           H        GLY  13  -2.335  -0.342   2.670
  407   1HA   GLY  13          1HA       GLY  13   0.171   0.511   1.600
  408   2HA   GLY  13          2HA       GLY  13  -1.100   1.589   2.174
  409    H    VAL  14           H        VAL  14  -1.180   0.738   4.888
  410    HA   VAL  14           HA       VAL  14   0.990   2.288   5.966
  411    HB   VAL  14           HB       VAL  14  -0.986   0.417   7.301
  412   1HG1  VAL  14          1HG1      VAL  14  -0.334   1.813   9.352
  413   2HG1  VAL  14          2HG1      VAL  14   1.076   2.323   8.424
  414   3HG1  VAL  14          3HG1      VAL  14   0.846   0.618   8.813
  415   1HG2  VAL  14          1HG2      VAL  14  -2.006   2.630   7.985
  416   2HG2  VAL  14          2HG2      VAL  14  -2.086   2.300   6.255
  417   3HG2  VAL  14          3HG2      VAL  14  -0.876   3.420   6.884
  418    H    ILE  15           H        ILE  15   0.349  -1.230   5.925
  419    HA   ILE  15           HA       ILE  15   2.743  -1.913   7.371
  420    HB   ILE  15           HB       ILE  15   1.095  -3.573   5.439
  421   1HG1  ILE  15          1HG1      ILE  15   1.079  -3.518   8.472
  422   2HG1  ILE  15          2HG1      ILE  15  -0.081  -2.639   7.476
  423   1HG2  ILE  15          1HG2      ILE  15   2.150  -5.477   6.745
  424   2HG2  ILE  15          2HG2      ILE  15   3.259  -4.293   7.436
  425   3HG2  ILE  15          3HG2      ILE  15   3.261  -4.596   5.699
  426   1HD1  ILE  15          1HD1      ILE  15  -0.764  -4.772   6.412
  427   2HD1  ILE  15          2HD1      ILE  15  -1.020  -4.805   8.157
  428   3HD1  ILE  15          3HD1      ILE  15   0.365  -5.639   7.453
  429    H    LEU  16           H        LEU  16   2.027  -1.496   3.924
  430    HA   LEU  16           HA       LEU  16   4.632  -2.497   3.095
  431   1HB   LEU  16          1HB       LEU  16   2.316  -2.270   1.773
  432   2HB   LEU  16          2HB       LEU  16   2.984  -0.704   1.332
  433    HG   LEU  16           HG       LEU  16   3.619  -2.265  -0.387
  434   1HD1  LEU  16          1HD1      LEU  16   5.954  -1.937  -0.425
  435   2HD1  LEU  16          2HD1      LEU  16   6.091  -2.059   1.328
  436   3HD1  LEU  16          3HD1      LEU  16   5.355  -0.633   0.598
  437   1HD2  LEU  16          1HD2      LEU  16   4.390  -4.421  -0.060
  438   2HD2  LEU  16          2HD2      LEU  16   3.412  -4.265   1.393
  439   3HD2  LEU  16          3HD2      LEU  16   5.159  -4.047   1.479
  440    H    THR  17           H        THR  17   3.175   0.725   3.525
  441    HA   THR  17           HA       THR  17   5.480   2.184   2.618
  442    HB   THR  17           HB       THR  17   3.404   3.102   4.628
  443    HG1  THR  17           HG1      THR  17   2.271   2.470   2.879
  444   1HG2  THR  17          1HG2      THR  17   5.391   4.553   4.375
  445   2HG2  THR  17          2HG2      THR  17   3.942   5.326   3.734
  446   3HG2  THR  17          3HG2      THR  17   5.119   4.609   2.634
  447    H    ALA  18           H        ALA  18   4.478   0.972   5.794
  448    HA   ALA  18           HA       ALA  18   6.457   2.289   7.357
  449   1HB   ALA  18          1HB       ALA  18   6.026   0.611   9.041
  450   2HB   ALA  18          2HB       ALA  18   5.374  -0.499   7.836
  451   3HB   ALA  18          3HB       ALA  18   4.496   0.974   8.244
  452    H    LEU  19           H        LEU  19   6.555  -0.918   5.784
  453    HA   LEU  19           HA       LEU  19   9.238  -1.527   6.594
  454   1HB   LEU  19          1HB       LEU  19   7.693  -2.481   4.163
  455   2HB   LEU  19          2HB       LEU  19   9.170  -3.216   4.778
  456    HG   LEU  19           HG       LEU  19   6.653  -2.906   6.439
  457   1HD1  LEU  19          1HD1      LEU  19   6.461  -5.426   5.987
  458   2HD1  LEU  19          2HD1      LEU  19   7.583  -5.162   4.653
  459   3HD1  LEU  19          3HD1      LEU  19   6.015  -4.353   4.660
  460   1HD2  LEU  19          1HD2      LEU  19   8.473  -3.261   7.906
  461   2HD2  LEU  19          2HD2      LEU  19   9.293  -4.343   6.783
  462   3HD2  LEU  19          3HD2      LEU  19   7.856  -4.889   7.643
  463    H    PHE  20           H        PHE  20   7.944   0.377   3.938
  464    HA   PHE  20           HA       PHE  20  10.390   0.436   2.406
  465   1HB   PHE  20          1HB       PHE  20   8.220   1.019   1.410
  466   2HB   PHE  20          2HB       PHE  20   8.093   2.415   2.482
  467    HD1  PHE  20           HD1      PHE  20  10.020   0.931  -0.324
  468    HD2  PHE  20           HD2      PHE  20   9.323   4.430   2.066
  469    HE1  PHE  20           HE1      PHE  20  11.354   2.286  -1.917
  470    HE2  PHE  20           HE2      PHE  20  10.654   5.785   0.474
  471    HZ   PHE  20           HZ       PHE  20  11.671   4.714  -1.515
  472    H    LEU  21           H        LEU  21   8.946   2.817   4.670
  473    HA   LEU  21           HA       LEU  21  11.149   4.633   4.561
  474   1HB   LEU  21          1HB       LEU  21   9.235   4.138   6.859
  475   2HB   LEU  21          2HB       LEU  21  10.234   5.572   6.644
  476    HG   LEU  21           HG       LEU  21   8.201   4.658   4.593
  477   1HD1  LEU  21          1HD1      LEU  21   6.743   6.452   5.535
  478   2HD1  LEU  21          2HD1      LEU  21   7.893   6.650   6.858
  479   3HD1  LEU  21          3HD1      LEU  21   7.018   5.132   6.671
  480   1HD2  LEU  21          1HD2      LEU  21   9.841   7.167   5.025
  481   2HD2  LEU  21          2HD2      LEU  21   8.376   7.186   4.047
  482   3HD2  LEU  21          3HD2      LEU  21   9.733   6.168   3.577
  483    H    ARG  22           H        ARG  22  10.491   1.868   6.710
  484    HA   ARG  22           HA       ARG  22  12.666   2.238   8.487
  485   1HB   ARG  22          1HB       ARG  22  10.859   0.492   8.717
  486   2HB   ARG  22          2HB       ARG  22  11.668  -0.433   7.453
  487   1HG   ARG  22          1HG       ARG  22  13.759  -0.397   8.856
  488   2HG   ARG  22          2HG       ARG  22  12.821   0.360  10.142
  489   1HD   ARG  22          1HD       ARG  22  11.981  -2.254   8.879
  490   2HD   ARG  22          2HD       ARG  22  13.077  -2.190  10.258
  491    HE   ARG  22           HE       ARG  22  10.941  -0.648  11.080
  492   1HH1  ARG  22          1HH1      ARG  22  11.354  -3.793   9.729
  493   2HH1  ARG  22          2HH1      ARG  22   9.986  -4.471  10.547
  494   1HH2  ARG  22          1HH2      ARG  22   9.149  -1.513  12.156
  495   2HH2  ARG  22          2HH2      ARG  22   8.737  -3.178  11.921
  496    H    VAL  23           H        VAL  23  12.545   0.741   5.277
  497    HA   VAL  23           HA       VAL  23  15.269  -0.194   5.300
  498    HB   VAL  23           HB       VAL  23  13.368   0.453   3.028
  499   1HG1  VAL  23          1HG1      VAL  23  15.540   0.610   2.069
  500   2HG1  VAL  23          2HG1      VAL  23  15.009  -1.037   1.725
  501   3HG1  VAL  23          3HG1      VAL  23  16.148  -0.734   3.037
  502   1HG2  VAL  23          1HG2      VAL  23  14.320  -2.260   3.966
  503   2HG2  VAL  23          2HG2      VAL  23  12.902  -1.870   2.993
  504   3HG2  VAL  23          3HG2      VAL  23  12.927  -1.474   4.709
  505    H    LYS  24           H        LYS  24  13.743   2.844   4.260
  506    HA   LYS  24           HA       LYS  24  16.091   3.958   3.041
  507   1HB   LYS  24          1HB       LYS  24  13.649   4.816   2.927
  508   2HB   LYS  24          2HB       LYS  24  13.991   5.597   4.471
  509   1HG   LYS  24          1HG       LYS  24  16.038   6.628   3.354
  510   2HG   LYS  24          2HG       LYS  24  15.383   6.051   1.822
  511   1HD   LYS  24          1HD       LYS  24  13.266   7.298   2.315
  512   2HD   LYS  24          2HD       LYS  24  14.040   7.963   3.754
  513   1HE   LYS  24          1HE       LYS  24  15.898   8.786   2.195
  514   2HE   LYS  24          2HE       LYS  24  14.808   8.400   0.863
  515   1HZ   LYS  24          1HZ       LYS  24  13.177   9.889   1.758
  516   2HZ   LYS  24          2HZ       LYS  24  14.648  10.725   1.607
  517   3HZ   LYS  24          3HZ       LYS  24  14.125  10.188   3.132
  518    H    PHE  25           H        PHE  25  14.823   4.033   6.351
  519    HA   PHE  25           HA       PHE  25  17.522   4.483   7.395
  520   1HB   PHE  25          1HB       PHE  25  17.002   6.539   8.594
  521   2HB   PHE  25          2HB       PHE  25  16.706   6.798   6.876
  522    HD1  PHE  25           HD1      PHE  25  15.072   6.072  10.135
  523    HD2  PHE  25           HD2      PHE  25  14.514   7.275   6.051
  524    HE1  PHE  25           HE1      PHE  25  12.721   6.678  10.636
  525    HE2  PHE  25           HE2      PHE  25  12.163   7.882   6.551
  526    HZ   PHE  25           HZ       PHE  25  11.265   7.584   8.844
  527    H    SER  26           H        SER  26  17.491   4.321   9.823
  528    HA   SER  26           HA       SER  26  14.993   3.270  11.009
  529   1HB   SER  26          1HB       SER  26  16.055   1.165  11.717
  530   2HB   SER  26          2HB       SER  26  16.040   1.286   9.960
  531    HG   SER  26           HG       SER  26  18.143   1.350   9.977
  532    H    ARG  27           H        ARG  27  14.993   3.455  13.267
  533    HA   ARG  27           HA       ARG  27  16.908   5.306  14.404
  534   1HB   ARG  27          1HB       ARG  27  14.758   3.605  15.709
  535   2HB   ARG  27          2HB       ARG  27  15.657   4.886  16.523
  536   1HG   ARG  27          1HG       ARG  27  14.831   6.498  14.793
  537   2HG   ARG  27          2HG       ARG  27  13.839   5.206  14.116
  538   1HD   ARG  27          1HD       ARG  27  13.667   6.213  16.972
  539   2HD   ARG  27          2HD       ARG  27  12.545   6.638  15.678
  540    HE   ARG  27           HE       ARG  27  12.482   3.878  15.694
  541   1HH1  ARG  27          1HH1      ARG  27  12.124   6.384  18.039
  542   2HH1  ARG  27          2HH1      ARG  27  11.021   5.483  19.023
  543   1HH2  ARG  27          1HH2      ARG  27  11.039   2.695  16.966
  544   2HH2  ARG  27          2HH2      ARG  27  10.405   3.397  18.417
  545    H    SER  28           H        SER  28  16.686   1.854  14.169
  546    HA   SER  28           HA       SER  28  18.266   1.105  16.424
  547   1HB   SER  28          1HB       SER  28  18.279  -0.311  13.753
  548   2HB   SER  28          2HB       SER  28  18.521  -1.013  15.350
  549    HG   SER  28           HG       SER  28  16.395  -0.750  15.790
  550    H    ALA  29           H        ALA  29  20.541   0.293  16.310
  551    HA   ALA  29           HA       ALA  29  22.260   1.330  14.177
  552   1HB   ALA  29          1HB       ALA  29  22.691   2.401  16.975
  553   2HB   ALA  29          2HB       ALA  29  21.794   3.297  15.749
  554   3HB   ALA  29          3HB       ALA  29  23.493   2.905  15.487
  555    H    ASP  30           H        ASP  30  21.516  -0.856  16.544
  556    HA   ASP  30           HA       ASP  30  22.666  -2.664  17.492
  557   1HB   ASP  30          1HB       ASP  30  24.840  -2.244  15.440
  558   2HB   ASP  30          2HB       ASP  30  24.206  -3.756  16.093
  Start of MODEL   10
    1   1H    ASP  -3          1H        ASP  -3 -20.778   6.140  -9.985
    2    HA   ASP  -3           HA       ASP  -3 -21.449   7.939  -8.218
    3   1HB   ASP  -3          1HB       ASP  -3 -23.530   8.461  -9.569
    4   2HB   ASP  -3          2HB       ASP  -3 -24.118   6.853  -9.149
    5    H    SER  -2           H        SER  -2 -23.396   5.028  -8.988
    6    HA   SER  -2           HA       SER  -2 -23.124   3.863  -6.412
    7   1HB   SER  -2          1HB       SER  -2 -24.802   3.080  -8.020
    8   2HB   SER  -2          2HB       SER  -2 -23.531   2.509  -9.097
    9    HG   SER  -2           HG       SER  -2 -24.620   1.015  -7.452
   10    H    LYS  -1           H        LYS  -1 -20.989   3.854  -9.189
   11    HA   LYS  -1           HA       LYS  -1 -19.267   1.746  -8.072
   12   1HB   LYS  -1          1HB       LYS  -1 -18.891   3.592 -10.451
   13   2HB   LYS  -1          2HB       LYS  -1 -17.827   2.250 -10.034
   14   1HG   LYS  -1          1HG       LYS  -1 -19.800   0.710 -10.198
   15   2HG   LYS  -1          2HG       LYS  -1 -20.759   2.071 -10.780
   16   1HD   LYS  -1          1HD       LYS  -1 -19.144   2.372 -12.653
   17   2HD   LYS  -1          2HD       LYS  -1 -18.271   0.944 -12.096
   18   1HE   LYS  -1          1HE       LYS  -1 -21.215   0.894 -12.796
   19   2HE   LYS  -1          2HE       LYS  -1 -19.946   0.529 -13.965
   20   1HZ   LYS  -1          1HZ       LYS  -1 -19.601  -1.463 -13.063
   21   2HZ   LYS  -1          2HZ       LYS  -1 -21.086  -1.249 -12.265
   22   3HZ   LYS  -1          3HZ       LYS  -1 -19.630  -0.866 -11.477
   23    H    LEU   1           H        LEU   1 -19.796   4.613  -6.876
   24    HA   LEU   1           HA       LEU   1 -17.429   6.122  -6.917
   25   1HB   LEU   1          1HB       LEU   1 -19.475   6.892  -5.793
   26   2HB   LEU   1          2HB       LEU   1 -19.298   5.630  -4.576
   27    HG   LEU   1           HG       LEU   1 -17.180   6.627  -3.818
   28   1HD1  LEU   1          1HD1      LEU   1 -16.182   7.638  -5.688
   29   2HD1  LEU   1          2HD1      LEU   1 -16.755   9.034  -4.783
   30   3HD1  LEU   1          3HD1      LEU   1 -17.672   8.450  -6.172
   31   1HD2  LEU   1          1HD2      LEU   1 -19.278   7.404  -2.800
   32   2HD2  LEU   1          2HD2      LEU   1 -19.450   8.629  -4.057
   33   3HD2  LEU   1          3HD2      LEU   1 -18.123   8.734  -2.902
   34    H    CYS   2           H        CYS   2 -18.240   3.295  -4.907
   35    HA   CYS   2           HA       CYS   2 -15.920   3.286  -3.279
   36   1HB   CYS   2          1HB       CYS   2 -17.845   1.767  -2.921
   37   2HB   CYS   2          2HB       CYS   2 -17.422   0.895  -4.395
   38    H    TYR   3           H        TYR   3 -16.412   2.234  -6.604
   39    HA   TYR   3           HA       TYR   3 -13.962   0.796  -6.925
   40   1HB   TYR   3          1HB       TYR   3 -15.929   0.870  -8.546
   41   2HB   TYR   3          2HB       TYR   3 -15.328   2.445  -9.066
   42    HD1  TYR   3           HD1      TYR   3 -13.444   2.634 -10.521
   43    HD2  TYR   3           HD2      TYR   3 -14.439  -1.154  -8.757
   44    HE1  TYR   3           HE1      TYR   3 -11.799   1.513 -11.999
   45    HE2  TYR   3           HE2      TYR   3 -12.795  -2.275 -10.235
   46    HH   TYR   3           HH       TYR   3 -10.822  -1.749 -11.519
   47    H    LEU   4           H        LEU   4 -14.710   4.210  -6.841
   48    HA   LEU   4           HA       LEU   4 -12.231   5.098  -8.050
   49   1HB   LEU   4          1HB       LEU   4 -14.356   6.475  -7.833
   50   2HB   LEU   4          2HB       LEU   4 -13.993   6.628  -6.118
   51    HG   LEU   4           HG       LEU   4 -11.656   7.488  -6.919
   52   1HD1  LEU   4          1HD1      LEU   4 -13.341   7.795  -9.423
   53   2HD1  LEU   4          2HD1      LEU   4 -11.773   7.003  -9.271
   54   3HD1  LEU   4          3HD1      LEU   4 -11.895   8.752  -9.113
   55   1HD2  LEU   4          1HD2      LEU   4 -12.521   9.785  -7.039
   56   2HD2  LEU   4          2HD2      LEU   4 -13.383   8.874  -5.798
   57   3HD2  LEU   4          3HD2      LEU   4 -14.142   9.171  -7.362
   58    H    LEU   5           H        LEU   5 -13.339   4.640  -4.691
   59    HA   LEU   5           HA       LEU   5 -10.882   5.583  -3.506
   60   1HB   LEU   5          1HB       LEU   5 -13.205   3.933  -2.505
   61   2HB   LEU   5          2HB       LEU   5 -11.783   4.192  -1.495
   62    HG   LEU   5           HG       LEU   5 -12.073   6.659  -1.801
   63   1HD1  LEU   5          1HD1      LEU   5 -14.530   5.707  -3.285
   64   2HD1  LEU   5          2HD1      LEU   5 -13.281   6.818  -3.849
   65   3HD1  LEU   5          3HD1      LEU   5 -14.417   7.329  -2.603
   66   1HD2  LEU   5          1HD2      LEU   5 -14.568   5.308  -0.734
   67   2HD2  LEU   5          2HD2      LEU   5 -13.892   6.854  -0.222
   68   3HD2  LEU   5          3HD2      LEU   5 -13.038   5.355   0.141
   69    H    ASP   6           H        ASP   6 -12.125   2.334  -4.291
   70    HA   ASP   6           HA       ASP   6  -9.881   0.891  -3.259
   71   1HB   ASP   6          1HB       ASP   6 -11.797   0.197  -5.506
   72   2HB   ASP   6          2HB       ASP   6 -10.666  -0.939  -4.770
   73    H    GLY   7           H        GLY   7 -10.513   2.332  -6.441
   74   1HA   GLY   7          1HA       GLY   7  -8.271   1.230  -7.802
   75   2HA   GLY   7          2HA       GLY   7  -9.050   2.755  -8.227
   76    H    ILE   8           H        ILE   8  -8.559   4.353  -6.061
   77    HA   ILE   8           HA       ILE   8  -5.836   5.121  -6.453
   78    HB   ILE   8           HB       ILE   8  -7.708   5.841  -4.179
   79   1HG1  ILE   8          1HG1      ILE   8  -7.126   7.287  -6.784
   80   2HG1  ILE   8          2HG1      ILE   8  -8.566   6.312  -6.491
   81   1HG2  ILE   8          1HG2      ILE   8  -5.171   7.133  -5.226
   82   2HG2  ILE   8          2HG2      ILE   8  -5.399   6.401  -3.637
   83   3HG2  ILE   8          3HG2      ILE   8  -6.256   7.882  -4.056
   84   1HD1  ILE   8          1HD1      ILE   8  -8.943   7.815  -4.427
   85   2HD1  ILE   8          2HD1      ILE   8  -9.254   8.527  -6.009
   86   3HD1  ILE   8          3HD1      ILE   8  -7.755   8.895  -5.155
   87    H    LEU   9           H        LEU   9  -7.385   3.588  -3.599
   88    HA   LEU   9           HA       LEU   9  -4.970   3.251  -2.123
   89   1HB   LEU   9          1HB       LEU   9  -7.425   1.470  -2.088
   90   2HB   LEU   9          2HB       LEU   9  -6.209   1.584  -0.820
   91    HG   LEU   9           HG       LEU   9  -7.786   3.995  -1.753
   92   1HD1  LEU   9          1HD1      LEU   9  -9.453   2.439  -0.997
   93   2HD1  LEU   9          2HD1      LEU   9  -9.181   3.577   0.322
   94   3HD1  LEU   9          3HD1      LEU   9  -8.468   1.965   0.388
   95   1HD2  LEU   9          1HD2      LEU   9  -6.113   3.322   0.687
   96   2HD2  LEU   9          2HD2      LEU   9  -7.215   4.696   0.646
   97   3HD2  LEU   9          3HD2      LEU   9  -5.860   4.624  -0.476
   98    H    PHE  10           H        PHE  10  -6.597   1.104  -4.455
   99    HA   PHE  10           HA       PHE  10  -4.797  -1.097  -4.165
  100   1HB   PHE  10          1HB       PHE  10  -6.983  -1.245  -5.333
  101   2HB   PHE  10          2HB       PHE  10  -6.339  -0.244  -6.636
  102    HD1  PHE  10           HD1      PHE  10  -5.017  -1.192  -8.366
  103    HD2  PHE  10           HD2      PHE  10  -5.834  -3.459  -4.811
  104    HE1  PHE  10           HE1      PHE  10  -4.037  -3.207  -9.427
  105    HE2  PHE  10           HE2      PHE  10  -4.853  -5.475  -5.872
  106    HZ   PHE  10           HZ       PHE  10  -3.954  -5.349  -8.180
  107    H    ILE  11           H        ILE  11  -4.863   1.435  -6.706
  108    HA   ILE  11           HA       ILE  11  -2.450   0.712  -7.973
  109    HB   ILE  11           HB       ILE  11  -3.665   3.461  -7.571
  110   1HG1  ILE  11          1HG1      ILE  11  -3.693   1.654 -10.003
  111   2HG1  ILE  11          2HG1      ILE  11  -4.980   1.653  -8.798
  112   1HG2  ILE  11          1HG2      ILE  11  -1.375   2.492  -9.294
  113   2HG2  ILE  11          2HG2      ILE  11  -1.384   3.838  -8.153
  114   3HG2  ILE  11          3HG2      ILE  11  -2.277   3.961  -9.670
  115   1HD1  ILE  11          1HD1      ILE  11  -5.602   3.144 -10.624
  116   2HD1  ILE  11          2HD1      ILE  11  -4.080   4.020 -10.463
  117   3HD1  ILE  11          3HD1      ILE  11  -5.285   4.103  -9.178
  118    H    TYR  12           H        TYR  12  -2.987   2.723  -5.101
  119    HA   TYR  12           HA       TYR  12  -0.324   3.654  -4.753
  120   1HB   TYR  12          1HB       TYR  12  -2.211   4.493  -3.410
  121   2HB   TYR  12          2HB       TYR  12  -2.374   2.914  -2.639
  122    HD1  TYR  12           HD1      TYR  12  -0.258   5.928  -2.948
  123    HD2  TYR  12           HD2      TYR  12  -0.777   2.146  -0.975
  124    HE1  TYR  12           HE1      TYR  12   1.465   6.560  -1.279
  125    HE2  TYR  12           HE2      TYR  12   0.946   2.778   0.693
  126    HH   TYR  12           HH       TYR  12   2.592   4.259   1.161
  127    H    GLY  13           H        GLY  13  -1.876   0.623  -3.702
  128   1HA   GLY  13          1HA       GLY  13   0.382  -0.374  -2.244
  129   2HA   GLY  13          2HA       GLY  13  -0.921  -1.365  -2.900
  130    H    VAL  14           H        VAL  14  -0.585  -0.683  -5.649
  131    HA   VAL  14           HA       VAL  14   1.493  -2.535  -6.368
  132    HB   VAL  14           HB       VAL  14  -0.050  -0.535  -8.043
  133   1HG1  VAL  14          1HG1      VAL  14   1.925  -1.091  -9.273
  134   2HG1  VAL  14          2HG1      VAL  14   0.650  -2.127  -9.914
  135   3HG1  VAL  14          3HG1      VAL  14   1.834  -2.784  -8.785
  136   1HG2  VAL  14          1HG2      VAL  14  -0.402  -3.483  -7.433
  137   2HG2  VAL  14          2HG2      VAL  14  -1.264  -2.650  -8.727
  138   3HG2  VAL  14          3HG2      VAL  14  -1.518  -2.173  -7.048
  139    H    ILE  15           H        ILE  15   1.291   1.029  -6.589
  140    HA   ILE  15           HA       ILE  15   3.913   1.320  -7.747
  141    HB   ILE  15           HB       ILE  15   2.276   3.313  -6.152
  142   1HG1  ILE  15          1HG1      ILE  15   2.540   2.948  -9.153
  143   2HG1  ILE  15          2HG1      ILE  15   1.177   2.352  -8.205
  144   1HG2  ILE  15          1HG2      ILE  15   4.665   3.626  -7.994
  145   2HG2  ILE  15          2HG2      ILE  15   4.595   4.018  -6.276
  146   3HG2  ILE  15          3HG2      ILE  15   3.672   4.972  -7.435
  147   1HD1  ILE  15          1HD1      ILE  15   0.735   4.676  -7.429
  148   2HD1  ILE  15          2HD1      ILE  15   0.609   4.522  -9.182
  149   3HD1  ILE  15          3HD1      ILE  15   2.047   5.247  -8.461
  150    H    LEU  16           H        LEU  16   2.723   1.485  -4.387
  151    HA   LEU  16           HA       LEU  16   5.265   2.192  -3.253
  152   1HB   LEU  16          1HB       LEU  16   2.782   2.134  -2.248
  153   2HB   LEU  16          2HB       LEU  16   3.291   0.548  -1.692
  154    HG   LEU  16           HG       LEU  16   3.783   2.105   0.069
  155   1HD1  LEU  16          1HD1      LEU  16   5.556   0.377  -0.659
  156   2HD1  LEU  16          2HD1      LEU  16   6.066   1.667   0.427
  157   3HD1  LEU  16          3HD1      LEU  16   6.451   1.760  -1.290
  158   1HD2  LEU  16          1HD2      LEU  16   4.717   4.212  -0.178
  159   2HD2  LEU  16          2HD2      LEU  16   3.892   4.083  -1.726
  160   3HD2  LEU  16          3HD2      LEU  16   5.624   3.776  -1.624
  161    H    THR  17           H        THR  17   3.726  -0.922  -3.963
  162    HA   THR  17           HA       THR  17   5.737  -2.526  -2.663
  163    HB   THR  17           HB       THR  17   3.973  -3.308  -5.001
  164    HG1  THR  17           HG1      THR  17   3.418  -2.700  -2.402
  165   1HG2  THR  17          1HG2      THR  17   5.353  -4.883  -2.813
  166   2HG2  THR  17          2HG2      THR  17   5.720  -4.929  -4.538
  167   3HG2  THR  17          3HG2      THR  17   4.186  -5.565  -3.945
  168    H    ALA  18           H        ALA  18   5.349  -1.339  -5.994
  169    HA   ALA  18           HA       ALA  18   7.507  -2.768  -7.165
  170   1HB   ALA  18          1HB       ALA  18   6.658   0.055  -7.865
  171   2HB   ALA  18          2HB       ALA  18   5.787  -1.385  -8.392
  172   3HB   ALA  18          3HB       ALA  18   7.446  -1.113  -8.925
  173    H    LEU  19           H        LEU  19   7.476   0.415  -5.547
  174    HA   LEU  19           HA       LEU  19  10.274   0.948  -5.931
  175   1HB   LEU  19          1HB       LEU  19   8.454   1.903  -3.701
  176   2HB   LEU  19          2HB       LEU  19   9.992   2.627  -4.160
  177    HG   LEU  19           HG       LEU  19   7.647   2.352  -6.061
  178   1HD1  LEU  19          1HD1      LEU  19   7.364   4.827  -5.634
  179   2HD1  LEU  19          2HD1      LEU  19   8.470   4.654  -4.272
  180   3HD1  LEU  19          3HD1      LEU  19   6.929   3.798  -4.270
  181   1HD2  LEU  19          1HD2      LEU  19  10.324   3.759  -6.144
  182   2HD2  LEU  19          2HD2      LEU  19   8.984   4.302  -7.152
  183   3HD2  LEU  19          3HD2      LEU  19   9.617   2.669  -7.335
  184    H    PHE  20           H        PHE  20   8.504  -0.821  -3.429
  185    HA   PHE  20           HA       PHE  20  10.687  -1.066  -1.592
  186   1HB   PHE  20          1HB       PHE  20   8.385  -1.607  -0.941
  187   2HB   PHE  20          2HB       PHE  20   8.354  -2.939  -2.096
  188    HD1  PHE  20           HD1      PHE  20   9.456  -5.028  -1.636
  189    HD2  PHE  20           HD2      PHE  20   9.867  -1.709   1.057
  190    HE1  PHE  20           HE1      PHE  20  10.466  -6.530   0.058
  191    HE2  PHE  20           HE2      PHE  20  10.877  -3.211   2.753
  192    HZ   PHE  20           HZ       PHE  20  11.176  -5.622   2.254
  193    H    LEU  21           H        LEU  21   9.560  -3.273  -4.175
  194    HA   LEU  21           HA       LEU  21  11.656  -5.194  -3.786
  195   1HB   LEU  21          1HB       LEU  21  10.122  -4.572  -6.326
  196   2HB   LEU  21          2HB       LEU  21  11.007  -6.056  -5.988
  197    HG   LEU  21           HG       LEU  21   8.746  -5.084  -4.223
  198   1HD1  LEU  21          1HD1      LEU  21   8.597  -7.025  -6.550
  199   2HD1  LEU  21          2HD1      LEU  21   7.912  -5.400  -6.533
  200   3HD1  LEU  21          3HD1      LEU  21   7.280  -6.635  -5.444
  201   1HD2  LEU  21          1HD2      LEU  21  10.062  -6.743  -3.114
  202   2HD2  LEU  21          2HD2      LEU  21  10.225  -7.707  -4.581
  203   3HD2  LEU  21          3HD2      LEU  21   8.671  -7.612  -3.757
  204    H    ARG  22           H        ARG  22  11.426  -2.286  -5.803
  205    HA   ARG  22           HA       ARG  22  13.739  -2.701  -7.387
  206   1HB   ARG  22          1HB       ARG  22  12.027  -0.850  -7.649
  207   2HB   ARG  22          2HB       ARG  22  12.824  -0.024  -6.310
  208   1HG   ARG  22          1HG       ARG  22  14.975  -0.129  -7.592
  209   2HG   ARG  22          2HG       ARG  22  14.082  -0.807  -8.955
  210   1HD   ARG  22          1HD       ARG  22  14.275   1.579  -9.309
  211   2HD   ARG  22          2HD       ARG  22  12.598   1.225  -8.899
  212    HE   ARG  22           HE       ARG  22  13.773   1.807  -6.456
  213   1HH1  ARG  22          1HH1      ARG  22  13.517   3.316  -9.544
  214   2HH1  ARG  22          2HH1      ARG  22  13.579   4.927  -8.911
  215   1HH2  ARG  22          1HH2      ARG  22  13.857   3.901  -5.610
  216   2HH2  ARG  22          2HH2      ARG  22  13.772   5.258  -6.684
  217    H    VAL  23           H        VAL  23  13.440  -1.179  -4.171
  218    HA   VAL  23           HA       VAL  23  16.262  -0.579  -3.963
  219    HB   VAL  23           HB       VAL  23  14.198  -0.941  -1.771
  220   1HG1  VAL  23          1HG1      VAL  23  16.978   0.247  -1.850
  221   2HG1  VAL  23          2HG1      VAL  23  16.371  -1.021  -0.787
  222   3HG1  VAL  23          3HG1      VAL  23  15.822   0.641  -0.578
  223   1HG2  VAL  23          1HG2      VAL  23  13.574   0.786  -3.430
  224   2HG2  VAL  23          2HG2      VAL  23  15.154   1.544  -3.230
  225   3HG2  VAL  23          3HG2      VAL  23  14.011   1.519  -1.887
  226    H    LYS  24           H        LYS  24  14.287  -3.385  -3.177
  227    HA   LYS  24           HA       LYS  24  16.122  -4.743  -1.486
  228   1HB   LYS  24          1HB       LYS  24  13.716  -5.401  -2.015
  229   2HB   LYS  24          2HB       LYS  24  14.331  -6.092  -3.518
  230   1HG   LYS  24          1HG       LYS  24  15.992  -7.393  -2.074
  231   2HG   LYS  24          2HG       LYS  24  15.023  -6.902  -0.688
  232   1HD   LYS  24          1HD       LYS  24  13.938  -8.377  -3.107
  233   2HD   LYS  24          2HD       LYS  24  14.376  -9.147  -1.584
  234   1HE   LYS  24          1HE       LYS  24  12.167  -7.141  -2.081
  235   2HE   LYS  24          2HE       LYS  24  12.021  -8.786  -1.467
  236   1HZ   LYS  24          1HZ       LYS  24  12.941  -6.365  -0.091
  237   2HZ   LYS  24          2HZ       LYS  24  13.576  -7.866   0.390
  238   3HZ   LYS  24          3HZ       LYS  24  11.901  -7.589   0.456
  239    H    PHE  25           H        PHE  25  15.930  -4.545  -5.023
  240    HA   PHE  25           HA       PHE  25  18.737  -5.411  -5.196
  241   1HB   PHE  25          1HB       PHE  25  18.289  -7.260  -6.741
  242   2HB   PHE  25          2HB       PHE  25  17.474  -7.556  -5.206
  243    HD1  PHE  25           HD1      PHE  25  16.977  -6.355  -8.691
  244    HD2  PHE  25           HD2      PHE  25  15.093  -7.680  -5.066
  245    HE1  PHE  25           HE1      PHE  25  14.801  -6.488  -9.872
  246    HE2  PHE  25           HE2      PHE  25  12.915  -7.811  -6.245
  247    HZ   PHE  25           HZ       PHE  25  12.770  -7.215  -8.649
  248    H    SER  26           H        SER  26  19.562  -5.140  -7.448
  249    HA   SER  26           HA       SER  26  17.847  -3.706  -9.353
  250   1HB   SER  26          1HB       SER  26  19.147  -1.654  -9.368
  251   2HB   SER  26          2HB       SER  26  18.579  -1.941  -7.726
  252    HG   SER  26           HG       SER  26  21.084  -1.717  -8.629
  253    H    ARG  27           H        ARG  27  19.021  -3.309 -11.407
  254    HA   ARG  27           HA       ARG  27  20.797  -5.511 -12.041
  255   1HB   ARG  27          1HB       ARG  27  19.185  -4.521 -13.671
  256   2HB   ARG  27          2HB       ARG  27  20.147  -3.043 -13.684
  257   1HG   ARG  27          1HG       ARG  27  22.090  -4.281 -14.522
  258   2HG   ARG  27          2HG       ARG  27  21.180  -5.791 -14.449
  259   1HD   ARG  27          1HD       ARG  27  19.561  -4.906 -16.083
  260   2HD   ARG  27          2HD       ARG  27  20.455  -3.388 -16.154
  261    HE   ARG  27           HE       ARG  27  22.356  -5.294 -16.794
  262   1HH1  ARG  27          1HH1      ARG  27  19.188  -4.467 -17.877
  263   2HH1  ARG  27          2HH1      ARG  27  19.470  -4.971 -19.510
  264   1HH2  ARG  27          1HH2      ARG  27  22.741  -5.957 -18.921
  265   2HH2  ARG  27          2HH2      ARG  27  21.479  -5.816 -20.100
  266    H    SER  28           H        SER  28  23.009  -5.516 -12.040
  267    HA   SER  28           HA       SER  28  24.496  -3.458 -10.756
  268   1HB   SER  28          1HB       SER  28  26.455  -4.698 -11.381
  269   2HB   SER  28          2HB       SER  28  25.188  -5.885 -11.086
  270    HG   SER  28           HG       SER  28  24.799  -5.827 -13.380
  271    H    ALA  29           H        ALA  29  26.159  -2.055 -11.737
  272    HA   ALA  29           HA       ALA  29  25.137  -0.549 -13.956
  273   1HB   ALA  29          1HB       ALA  29  27.867  -0.586 -12.639
  274   2HB   ALA  29          2HB       ALA  29  26.553   0.552 -12.336
  275   3HB   ALA  29          3HB       ALA  29  27.400   0.571 -13.884
  276    H    ASP  30           H        ASP  30  27.461  -3.185 -13.703
  277    HA   ASP  30           HA       ASP  30  28.548  -2.915 -16.357
  278   1HB   ASP  30          1HB       ASP  30  29.575  -4.268 -14.492
  279   2HB   ASP  30          2HB       ASP  30  28.294  -5.457 -14.727
  280   1H    ASP  -3          1H        ASP  -3 -25.386   0.704   6.266
  281    HA   ASP  -3           HA       ASP  -3 -25.355  -0.854   7.815
  282   1HB   ASP  -3          1HB       ASP  -3 -27.600  -1.361   6.947
  283   2HB   ASP  -3          2HB       ASP  -3 -26.901  -2.471   5.767
  284    H    SER  -2           H        SER  -2 -25.125  -2.946   4.914
  285    HA   SER  -2           HA       SER  -2 -23.200  -4.707   6.041
  286   1HB   SER  -2          1HB       SER  -2 -23.508  -4.025   3.104
  287   2HB   SER  -2          2HB       SER  -2 -22.836  -5.506   3.782
  288    HG   SER  -2           HG       SER  -2 -25.360  -4.812   4.671
  289    H    LYS  -1           H        LYS  -1 -22.783  -1.756   4.094
  290    HA   LYS  -1           HA       LYS  -1 -20.852  -0.496   3.643
  291   1HB   LYS  -1          1HB       LYS  -1 -20.084  -1.616   6.357
  292   2HB   LYS  -1          2HB       LYS  -1 -19.316  -0.239   5.566
  293   1HG   LYS  -1          1HG       LYS  -1 -21.641   0.822   5.468
  294   2HG   LYS  -1          2HG       LYS  -1 -22.158  -0.448   6.577
  295   1HD   LYS  -1          1HD       LYS  -1 -19.861   1.464   7.101
  296   2HD   LYS  -1          2HD       LYS  -1 -21.487   1.645   7.763
  297   1HE   LYS  -1          1HE       LYS  -1 -21.177  -0.749   8.686
  298   2HE   LYS  -1          2HE       LYS  -1 -19.463  -0.521   8.335
  299   1HZ   LYS  -1          1HZ       LYS  -1 -21.029   0.545  10.464
  300   2HZ   LYS  -1          2HZ       LYS  -1 -20.233   1.776   9.607
  301   3HZ   LYS  -1          3HZ       LYS  -1 -19.343   0.499  10.287
  302    H    LEU   1           H        LEU   1 -20.836  -3.022   2.414
  303    HA   LEU   1           HA       LEU   1 -18.568  -4.640   2.909
  304   1HB   LEU   1          1HB       LEU   1 -20.456  -5.141   1.301
  305   2HB   LEU   1          2HB       LEU   1 -19.726  -3.991   0.185
  306    HG   LEU   1           HG       LEU   1 -17.545  -5.438   0.539
  307   1HD1  LEU   1          1HD1      LEU   1 -19.751  -7.358   1.350
  308   2HD1  LEU   1          2HD1      LEU   1 -18.363  -6.874   2.323
  309   3HD1  LEU   1          3HD1      LEU   1 -18.127  -7.853   0.878
  310   1HD2  LEU   1          1HD2      LEU   1 -18.579  -5.307  -1.619
  311   2HD2  LEU   1          2HD2      LEU   1 -19.959  -6.269  -1.089
  312   3HD2  LEU   1          3HD2      LEU   1 -18.376  -7.024  -1.273
  313    H    CYS   2           H        CYS   2 -18.884  -1.690   0.941
  314    HA   CYS   2           HA       CYS   2 -16.289  -1.693  -0.195
  315   1HB   CYS   2          1HB       CYS   2 -18.091  -0.103  -0.836
  316   2HB   CYS   2          2HB       CYS   2 -17.898   0.713   0.715
  317    H    TYR   3           H        TYR   3 -17.400  -0.657   2.999
  318    HA   TYR   3           HA       TYR   3 -15.011   0.653   3.833
  319   1HB   TYR   3          1HB       TYR   3 -17.217   0.675   5.052
  320   2HB   TYR   3          2HB       TYR   3 -16.879  -0.972   5.583
  321    HD1  TYR   3           HD1      TYR   3 -15.541  -1.356   7.495
  322    HD2  TYR   3           HD2      TYR   3 -15.456   2.485   5.571
  323    HE1  TYR   3           HE1      TYR   3 -14.145  -0.462   9.340
  324    HE2  TYR   3           HE2      TYR   3 -14.062   3.378   7.416
  325    HH   TYR   3           HH       TYR   3 -13.733   1.921  10.342
  326    H    LEU   4           H        LEU   4 -15.837  -2.737   3.541
  327    HA   LEU   4           HA       LEU   4 -13.625  -3.695   5.159
  328   1HB   LEU   4          1HB       LEU   4 -15.592  -5.107   4.798
  329   2HB   LEU   4          2HB       LEU   4 -15.320  -5.082   3.056
  330    HG   LEU   4           HG       LEU   4 -13.198  -6.275   3.337
  331   1HD1  LEU   4          1HD1      LEU   4 -12.292  -5.581   5.391
  332   2HD1  LEU   4          2HD1      LEU   4 -12.816  -7.223   5.754
  333   3HD1  LEU   4          3HD1      LEU   4 -13.802  -5.851   6.263
  334   1HD2  LEU   4          1HD2      LEU   4 -15.449  -7.487   3.266
  335   2HD2  LEU   4          2HD2      LEU   4 -15.290  -7.683   5.011
  336   3HD2  LEU   4          3HD2      LEU   4 -14.099  -8.407   3.930
  337    H    LEU   5           H        LEU   5 -14.172  -3.207   1.673
  338    HA   LEU   5           HA       LEU   5 -11.657  -4.291   0.822
  339   1HB   LEU   5          1HB       LEU   5 -13.642  -2.372  -0.397
  340   2HB   LEU   5          2HB       LEU   5 -12.100  -2.669  -1.196
  341    HG   LEU   5           HG       LEU   5 -12.613  -5.132  -1.125
  342   1HD1  LEU   5          1HD1      LEU   5 -15.247  -4.060  -0.086
  343   2HD1  LEU   5          2HD1      LEU   5 -14.192  -5.247   0.682
  344   3HD1  LEU   5          3HD1      LEU   5 -15.074  -5.669  -0.786
  345   1HD2  LEU   5          1HD2      LEU   5 -14.622  -3.343  -2.531
  346   2HD2  LEU   5          2HD2      LEU   5 -14.303  -5.027  -2.944
  347   3HD2  LEU   5          3HD2      LEU   5 -13.040  -3.814  -3.153
  348    H    ASP   6           H        ASP   6 -12.667  -0.942   1.559
  349    HA   ASP   6           HA       ASP   6 -10.134   0.259   1.003
  350   1HB   ASP   6          1HB       ASP   6 -12.338   1.108   2.905
  351   2HB   ASP   6          2HB       ASP   6 -10.965   2.120   2.454
  352    H    GLY   7           H        GLY   7 -11.468  -1.166   3.971
  353   1HA   GLY   7          1HA       GLY   7  -9.419  -0.359   5.755
  354   2HA   GLY   7          2HA       GLY   7 -10.384  -1.823   5.945
  355    H    ILE   8           H        ILE   8  -9.650  -3.373   3.830
  356    HA   ILE   8           HA       ILE   8  -7.080  -4.359   4.630
  357    HB   ILE   8           HB       ILE   8  -8.661  -4.924   2.106
  358   1HG1  ILE   8          1HG1      ILE   8  -8.520  -6.488   4.701
  359   2HG1  ILE   8          2HG1      ILE   8  -9.818  -5.359   4.314
  360   1HG2  ILE   8          1HG2      ILE   8  -6.351  -6.359   3.445
  361   2HG2  ILE   8          2HG2      ILE   8  -6.369  -5.647   1.832
  362   3HG2  ILE   8          3HG2      ILE   8  -7.345  -7.074   2.176
  363   1HD1  ILE   8          1HD1      ILE   8  -9.081  -7.888   2.822
  364   2HD1  ILE   8          2HD1      ILE   8 -10.209  -6.686   2.193
  365   3HD1  ILE   8          3HD1      ILE   8 -10.583  -7.553   3.682
  366    H    LEU   9           H        LEU   9  -8.083  -2.731   1.594
  367    HA   LEU   9           HA       LEU   9  -5.474  -2.556   0.483
  368   1HB   LEU   9          1HB       LEU   9  -7.787  -0.625   0.148
  369   2HB   LEU   9          2HB       LEU   9  -6.397  -0.757  -0.926
  370    HG   LEU   9           HG       LEU   9  -8.267  -3.071  -0.336
  371   1HD1  LEU   9          1HD1      LEU   9  -8.271  -1.272  -2.775
  372   2HD1  LEU   9          2HD1      LEU   9  -9.421  -1.125  -1.447
  373   3HD1  LEU   9          3HD1      LEU   9  -9.386  -2.592  -2.425
  374   1HD2  LEU   9          1HD2      LEU   9  -6.243  -3.947  -1.192
  375   2HD2  LEU   9          2HD2      LEU   9  -5.999  -2.581  -2.278
  376   3HD2  LEU   9          3HD2      LEU   9  -7.243  -3.779  -2.631
  377    H    PHE  10           H        PHE  10  -7.240  -0.288   2.592
  378    HA   PHE  10           HA       PHE  10  -5.254   1.759   2.604
  379   1HB   PHE  10          1HB       PHE  10  -7.555   2.061   3.488
  380   2HB   PHE  10          2HB       PHE  10  -7.163   0.990   4.833
  381    HD1  PHE  10           HD1      PHE  10  -6.415   1.974   6.824
  382    HD2  PHE  10           HD2      PHE  10  -5.778   4.022   3.099
  383    HE1  PHE  10           HE1      PHE  10  -5.425   3.892   8.046
  384    HE2  PHE  10           HE2      PHE  10  -4.789   5.937   4.323
  385    HZ   PHE  10           HZ       PHE  10  -4.613   5.873   6.795
  386    H    ILE  11           H        ILE  11  -5.810  -0.876   4.968
  387    HA   ILE  11           HA       ILE  11  -3.539  -0.348   6.583
  388    HB   ILE  11           HB       ILE  11  -4.953  -2.954   5.954
  389   1HG1  ILE  11          1HG1      ILE  11  -5.033  -1.228   8.438
  390   2HG1  ILE  11          2HG1      ILE  11  -6.180  -1.052   7.112
  391   1HG2  ILE  11          1HG2      ILE  11  -2.807  -3.614   6.742
  392   2HG2  ILE  11          2HG2      ILE  11  -3.845  -3.657   8.166
  393   3HG2  ILE  11          3HG2      ILE  11  -2.748  -2.300   7.916
  394   1HD1  ILE  11          1HD1      ILE  11  -5.704  -3.585   8.709
  395   2HD1  ILE  11          2HD1      ILE  11  -6.845  -3.417   7.374
  396   3HD1  ILE  11          3HD1      ILE  11  -7.098  -2.517   8.869
  397    H    TYR  12           H        TYR  12  -3.873  -2.228   3.602
  398    HA   TYR  12           HA       TYR  12  -1.289  -3.408   3.556
  399   1HB   TYR  12          1HB       TYR  12  -3.073  -3.994   1.949
  400   2HB   TYR  12          2HB       TYR  12  -2.930  -2.397   1.214
  401    HD1  TYR  12           HD1      TYR  12  -1.017  -1.808  -0.173
  402    HD2  TYR  12           HD2      TYR  12  -1.271  -5.655   1.721
  403    HE1  TYR  12           HE1      TYR  12   0.842  -2.627  -1.592
  404    HE2  TYR  12           HE2      TYR  12   0.589  -6.476   0.300
  405    HH   TYR  12           HH       TYR  12   1.679  -4.819  -2.437
  406    H    GLY  13           H        GLY  13  -2.382  -0.222   2.398
  407   1HA   GLY  13          1HA       GLY  13   0.152   0.566   1.314
  408   2HA   GLY  13          2HA       GLY  13  -1.138   1.672   1.786
  409    H    VAL  14           H        VAL  14  -1.277   0.916   4.551
  410    HA   VAL  14           HA       VAL  14   0.830   2.573   5.601
  411    HB   VAL  14           HB       VAL  14  -1.098   0.701   7.009
  412   1HG1  VAL  14          1HG1      VAL  14  -0.531   2.238   8.979
  413   2HG1  VAL  14          2HG1      VAL  14   0.855   2.774   8.029
  414   3HG1  VAL  14          3HG1      VAL  14   0.717   1.083   8.511
  415   1HG2  VAL  14          1HG2      VAL  14  -2.104   2.590   5.704
  416   2HG2  VAL  14          2HG2      VAL  14  -1.139   3.717   6.658
  417   3HG2  VAL  14          3HG2      VAL  14  -2.377   2.734   7.439
  418    H    ILE  15           H        ILE  15   0.267  -0.961   5.766
  419    HA   ILE  15           HA       ILE  15   2.616  -1.531   7.289
  420    HB   ILE  15           HB       ILE  15   1.145  -3.278   5.292
  421   1HG1  ILE  15          1HG1      ILE  15   0.957  -3.152   8.320
  422   2HG1  ILE  15          2HG1      ILE  15  -0.190  -2.371   7.231
  423   1HG2  ILE  15          1HG2      ILE  15   3.202  -3.900   7.431
  424   2HG2  ILE  15          2HG2      ILE  15   3.346  -4.199   5.699
  425   3HG2  ILE  15          3HG2      ILE  15   2.198  -5.129   6.662
  426   1HD1  ILE  15          1HD1      ILE  15  -0.716  -4.565   6.218
  427   2HD1  ILE  15          2HD1      ILE  15  -1.038  -4.569   7.952
  428   3HD1  ILE  15          3HD1      ILE  15   0.417  -5.341   7.323
  429    H    LEU  16           H        LEU  16   2.079  -1.440   3.757
  430    HA   LEU  16           HA       LEU  16   4.735  -2.265   3.071
  431   1HB   LEU  16          1HB       LEU  16   2.407  -1.681   1.665
  432   2HB   LEU  16          2HB       LEU  16   3.452  -0.355   1.193
  433    HG   LEU  16           HG       LEU  16   3.849  -2.029  -0.427
  434   1HD1  LEU  16          1HD1      LEU  16   5.934  -1.150   1.058
  435   2HD1  LEU  16          2HD1      LEU  16   6.123  -2.232  -0.315
  436   3HD1  LEU  16          3HD1      LEU  16   6.114  -2.885   1.320
  437   1HD2  LEU  16          1HD2      LEU  16   4.236  -4.099   1.757
  438   2HD2  LEU  16          2HD2      LEU  16   4.120  -4.376   0.021
  439   3HD2  LEU  16          3HD2      LEU  16   2.702  -3.848   0.924
  440    H    THR  17           H        THR  17   3.286   0.947   3.558
  441    HA   THR  17           HA       THR  17   5.585   2.487   2.893
  442    HB   THR  17           HB       THR  17   3.479   3.125   4.980
  443    HG1  THR  17           HG1      THR  17   2.271   3.009   3.258
  444   1HG2  THR  17          1HG2      THR  17   5.413   4.614   5.083
  445   2HG2  THR  17          2HG2      THR  17   4.044   5.472   4.375
  446   3HG2  THR  17          3HG2      THR  17   5.339   4.869   3.340
  447    H    ALA  18           H        ALA  18   4.609   0.966   5.955
  448    HA   ALA  18           HA       ALA  18   6.645   2.114   7.587
  449   1HB   ALA  18          1HB       ALA  18   4.732   0.898   8.533
  450   2HB   ALA  18          2HB       ALA  18   6.243   0.181   9.087
  451   3HB   ALA  18          3HB       ALA  18   5.311  -0.602   7.811
  452    H    LEU  19           H        LEU  19   6.611  -0.999   5.823
  453    HA   LEU  19           HA       LEU  19   9.308  -1.714   6.521
  454   1HB   LEU  19          1HB       LEU  19   7.764  -2.524   4.040
  455   2HB   LEU  19          2HB       LEU  19   9.132  -3.375   4.749
  456    HG   LEU  19           HG       LEU  19   6.554  -2.882   6.262
  457   1HD1  LEU  19          1HD1      LEU  19   7.360  -5.177   4.467
  458   2HD1  LEU  19          2HD1      LEU  19   5.891  -4.205   4.393
  459   3HD1  LEU  19          3HD1      LEU  19   6.129  -5.342   5.720
  460   1HD2  LEU  19          1HD2      LEU  19   8.965  -4.677   6.655
  461   2HD2  LEU  19          2HD2      LEU  19   7.448  -4.929   7.513
  462   3HD2  LEU  19          3HD2      LEU  19   8.352  -3.436   7.746
  463    H    PHE  20           H        PHE  20   7.939   0.266   3.958
  464    HA   PHE  20           HA       PHE  20  10.284   0.378   2.311
  465   1HB   PHE  20          1HB       PHE  20   8.053   1.102   1.534
  466   2HB   PHE  20          2HB       PHE  20   8.086   2.438   2.683
  467    HD1  PHE  20           HD1      PHE  20   9.865   0.987  -0.262
  468    HD2  PHE  20           HD2      PHE  20   9.187   4.471   2.159
  469    HE1  PHE  20           HE1      PHE  20  11.096   2.374  -1.910
  470    HE2  PHE  20           HE2      PHE  20  10.417   5.855   0.512
  471    HZ   PHE  20           HZ       PHE  20  11.371   4.809  -1.524
  472    H    LEU  21           H        LEU  21   9.089   2.646   4.816
  473    HA   LEU  21           HA       LEU  21  11.378   4.367   4.681
  474   1HB   LEU  21          1HB       LEU  21   9.526   3.861   7.027
  475   2HB   LEU  21          2HB       LEU  21  10.595   5.248   6.840
  476    HG   LEU  21           HG       LEU  21   8.422   4.539   4.848
  477   1HD1  LEU  21          1HD1      LEU  21   7.265   5.030   6.872
  478   2HD1  LEU  21          2HD1      LEU  21   7.237   6.527   5.939
  479   3HD1  LEU  21          3HD1      LEU  21   8.373   6.341   7.275
  480   1HD2  LEU  21          1HD2      LEU  21   8.756   7.088   4.394
  481   2HD2  LEU  21          2HD2      LEU  21   9.972   5.973   3.779
  482   3HD2  LEU  21          3HD2      LEU  21  10.284   6.891   5.251
  483    H    ARG  22           H        ARG  22  10.696   1.462   6.603
  484    HA   ARG  22           HA       ARG  22  12.820   1.621   8.444
  485   1HB   ARG  22          1HB       ARG  22  11.027  -0.171   8.346
  486   2HB   ARG  22          2HB       ARG  22  11.956  -0.927   7.051
  487   1HG   ARG  22          1HG       ARG  22  13.922  -1.056   8.565
  488   2HG   ARG  22          2HG       ARG  22  12.945  -0.369   9.863
  489   1HD   ARG  22          1HD       ARG  22  11.339  -2.283   9.578
  490   2HD   ARG  22          2HD       ARG  22  12.472  -2.999   8.432
  491    HE   ARG  22           HE       ARG  22  14.018  -2.549  10.683
  492   1HH1  ARG  22          1HH1      ARG  22  11.015  -4.102   9.991
  493   2HH1  ARG  22          2HH1      ARG  22  11.190  -5.287  11.243
  494   1HH2  ARG  22          1HH2      ARG  22  14.262  -4.087  12.319
  495   2HH2  ARG  22          2HH2      ARG  22  13.028  -5.280  12.559
  496    H    VAL  23           H        VAL  23  12.862   0.496   5.074
  497    HA   VAL  23           HA       VAL  23  15.572  -0.402   5.039
  498    HB   VAL  23           HB       VAL  23  13.925   0.828   2.805
  499   1HG1  VAL  23          1HG1      VAL  23  16.513  -0.738   2.841
  500   2HG1  VAL  23          2HG1      VAL  23  16.217   0.849   2.130
  501   3HG1  VAL  23          3HG1      VAL  23  15.512  -0.592   1.396
  502   1HG2  VAL  23          1HG2      VAL  23  12.964  -1.210   3.946
  503   2HG2  VAL  23          2HG2      VAL  23  14.423  -2.085   3.483
  504   3HG2  VAL  23          3HG2      VAL  23  13.342  -1.455   2.241
  505    H    LYS  24           H        LYS  24  14.132   2.803   4.585
  506    HA   LYS  24           HA       LYS  24  16.507   4.152   3.738
  507   1HB   LYS  24          1HB       LYS  24  14.247   5.305   5.400
  508   2HB   LYS  24          2HB       LYS  24  15.357   6.198   4.361
  509   1HG   LYS  24          1HG       LYS  24  13.439   4.063   3.379
  510   2HG   LYS  24          2HG       LYS  24  13.121   5.795   3.303
  511   1HD   LYS  24          1HD       LYS  24  15.394   5.938   2.040
  512   2HD   LYS  24          2HD       LYS  24  15.209   4.198   1.820
  513   1HE   LYS  24          1HE       LYS  24  12.992   4.575   0.778
  514   2HE   LYS  24          2HE       LYS  24  13.217   6.315   0.957
  515   1HZ   LYS  24          1HZ       LYS  24  13.846   5.608  -1.248
  516   2HZ   LYS  24          2HZ       LYS  24  14.945   4.478  -0.613
  517   3HZ   LYS  24          3HZ       LYS  24  15.219   6.143  -0.409
  518    H    PHE  25           H        PHE  25  15.334   3.200   6.919
  519    HA   PHE  25           HA       PHE  25  17.577   4.660   8.231
  520   1HB   PHE  25          1HB       PHE  25  15.201   3.152   9.366
  521   2HB   PHE  25          2HB       PHE  25  16.442   3.943  10.339
  522    HD1  PHE  25           HD1      PHE  25  13.380   4.390   8.500
  523    HD2  PHE  25           HD2      PHE  25  16.846   6.455   9.978
  524    HE1  PHE  25           HE1      PHE  25  12.192   6.555   8.265
  525    HE2  PHE  25           HE2      PHE  25  15.658   8.618   9.743
  526    HZ   PHE  25           HZ       PHE  25  13.331   8.669   8.887
  527    H    SER  26           H        SER  26  19.303   3.574   9.116
  528    HA   SER  26           HA       SER  26  19.191   0.634   9.428
  529   1HB   SER  26          1HB       SER  26  19.950   1.162   7.052
  530   2HB   SER  26          2HB       SER  26  21.375   1.913   7.765
  531    HG   SER  26           HG       SER  26  21.686  -0.141   8.867
  532    H    ARG  27           H        ARG  27  21.078  -0.162  10.663
  533    HA   ARG  27           HA       ARG  27  21.789   1.611  12.808
  534   1HB   ARG  27          1HB       ARG  27  23.266  -0.920  12.053
  535   2HB   ARG  27          2HB       ARG  27  23.104  -0.200  13.654
  536   1HG   ARG  27          1HG       ARG  27  20.829  -1.353  12.009
  537   2HG   ARG  27          2HG       ARG  27  21.592  -2.139  13.390
  538   1HD   ARG  27          1HD       ARG  27  20.980  -0.006  14.712
  539   2HD   ARG  27          2HD       ARG  27  19.902   0.361  13.363
  540    HE   ARG  27           HE       ARG  27  19.238  -2.237  14.026
  541   1HH1  ARG  27          1HH1      ARG  27  19.580   0.752  15.711
  542   2HH1  ARG  27          2HH1      ARG  27  18.359   0.384  16.883
  543   1HH2  ARG  27          1HH2      ARG  27  17.642  -2.735  15.545
  544   2HH2  ARG  27          2HH2      ARG  27  17.261  -1.591  16.790
  545    H    SER  28           H        SER  28  23.571   2.909  13.075
  546    HA   SER  28           HA       SER  28  25.233   3.436  10.725
  547   1HB   SER  28          1HB       SER  28  26.094   5.287  11.966
  548   2HB   SER  28          2HB       SER  28  24.386   5.190  12.382
  549    HG   SER  28           HG       SER  28  26.242   5.285  14.083
  550    H    ALA  29           H        ALA  29  27.606   3.333  10.796
  551    HA   ALA  29           HA       ALA  29  28.557   0.844  11.906
  552   1HB   ALA  29          1HB       ALA  29  30.125   3.176  10.758
  553   2HB   ALA  29          2HB       ALA  29  29.500   1.811   9.834
  554   3HB   ALA  29          3HB       ALA  29  30.758   1.555  11.043
  555    H    ASP  30           H        ASP  30  30.036   0.538  13.637
  556    HA   ASP  30           HA       ASP  30  29.714   2.358  15.858
  557   1HB   ASP  30          1HB       ASP  30  30.122  -0.175  15.958
  558   2HB   ASP  30          2HB       ASP  30  31.817   0.196  15.643
  Start of MODEL   11
    1   1H    ASP  -3          1H        ASP  -3 -23.673   6.655  -9.793
    2    HA   ASP  -3           HA       ASP  -3 -21.968   7.787  -8.746
    3   1HB   ASP  -3          1HB       ASP  -3 -24.000   8.399  -6.578
    4   2HB   ASP  -3          2HB       ASP  -3 -22.297   8.855  -6.517
    5    H    SER  -2           H        SER  -2 -23.990   5.262  -7.864
    6    HA   SER  -2           HA       SER  -2 -22.863   4.248  -5.480
    7   1HB   SER  -2          1HB       SER  -2 -24.852   3.276  -6.615
    8   2HB   SER  -2          2HB       SER  -2 -23.801   2.656  -7.887
    9    HG   SER  -2           HG       SER  -2 -23.602   1.007  -6.600
   10    H    LYS  -1           H        LYS  -1 -21.569   4.355  -8.722
   11    HA   LYS  -1           HA       LYS  -1 -19.524   2.344  -8.289
   12   1HB   LYS  -1          1HB       LYS  -1 -20.467   3.295 -10.539
   13   2HB   LYS  -1          2HB       LYS  -1 -19.282   4.579 -10.307
   14   1HG   LYS  -1          1HG       LYS  -1 -17.497   2.853 -10.109
   15   2HG   LYS  -1          2HG       LYS  -1 -18.699   1.606 -10.434
   16   1HD   LYS  -1          1HD       LYS  -1 -19.230   2.852 -12.591
   17   2HD   LYS  -1          2HD       LYS  -1 -17.790   3.822 -12.284
   18   1HE   LYS  -1          1HE       LYS  -1 -17.763   0.795 -12.413
   19   2HE   LYS  -1          2HE       LYS  -1 -17.401   1.832 -13.791
   20   1HZ   LYS  -1          1HZ       LYS  -1 -15.717   2.920 -12.256
   21   2HZ   LYS  -1          2HZ       LYS  -1 -15.343   1.369 -12.838
   22   3HZ   LYS  -1          3HZ       LYS  -1 -15.915   1.569 -11.251
   23    H    LEU   1           H        LEU   1 -19.922   5.066  -6.640
   24    HA   LEU   1           HA       LEU   1 -17.454   6.481  -6.855
   25   1HB   LEU   1          1HB       LEU   1 -19.423   7.356  -5.637
   26   2HB   LEU   1          2HB       LEU   1 -19.229   6.095  -4.423
   27    HG   LEU   1           HG       LEU   1 -16.979   6.992  -3.867
   28   1HD1  LEU   1          1HD1      LEU   1 -16.643   9.439  -4.803
   29   2HD1  LEU   1          2HD1      LEU   1 -17.672   8.873  -6.117
   30   3HD1  LEU   1          3HD1      LEU   1 -16.146   8.058  -5.776
   31   1HD2  LEU   1          1HD2      LEU   1 -19.326   8.905  -3.777
   32   2HD2  LEU   1          2HD2      LEU   1 -17.823   9.185  -2.899
   33   3HD2  LEU   1          3HD2      LEU   1 -18.812   7.774  -2.525
   34    H    CYS   2           H        CYS   2 -18.354   3.540  -5.139
   35    HA   CYS   2           HA       CYS   2 -16.073   3.363  -3.430
   36   1HB   CYS   2          1HB       CYS   2 -17.953   1.903  -3.040
   37   2HB   CYS   2          2HB       CYS   2 -17.826   1.222  -4.662
   38    H    TYR   3           H        TYR   3 -16.580   2.341  -6.791
   39    HA   TYR   3           HA       TYR   3 -14.205   0.836  -7.128
   40   1HB   TYR   3          1HB       TYR   3 -16.138   1.174  -8.789
   41   2HB   TYR   3          2HB       TYR   3 -15.333   2.675  -9.245
   42    HD1  TYR   3           HD1      TYR   3 -14.948  -1.014  -9.068
   43    HD2  TYR   3           HD2      TYR   3 -13.345   2.671 -10.583
   44    HE1  TYR   3           HE1      TYR   3 -13.409  -2.288 -10.536
   45    HE2  TYR   3           HE2      TYR   3 -11.804   1.396 -12.051
   46    HH   TYR   3           HH       TYR   3 -12.179  -1.809 -12.769
   47    H    LEU   4           H        LEU   4 -14.707   4.304  -6.955
   48    HA   LEU   4           HA       LEU   4 -12.138   5.042  -8.051
   49   1HB   LEU   4          1HB       LEU   4 -13.921   6.681  -8.008
   50   2HB   LEU   4          2HB       LEU   4 -14.087   6.524  -6.262
   51    HG   LEU   4           HG       LEU   4 -11.903   7.512  -5.898
   52   1HD1  LEU   4          1HD1      LEU   4 -11.666   7.224  -8.896
   53   2HD1  LEU   4          2HD1      LEU   4 -10.542   6.689  -7.647
   54   3HD1  LEU   4          3HD1      LEU   4 -10.690   8.404  -8.020
   55   1HD2  LEU   4          1HD2      LEU   4 -13.244   9.152  -8.060
   56   2HD2  LEU   4          2HD2      LEU   4 -12.342   9.737  -6.663
   57   3HD2  LEU   4          3HD2      LEU   4 -13.921   8.981  -6.440
   58    H    LEU   5           H        LEU   5 -13.353   4.695  -4.702
   59    HA   LEU   5           HA       LEU   5 -10.936   5.429  -3.403
   60   1HB   LEU   5          1HB       LEU   5 -13.286   3.711  -2.635
   61   2HB   LEU   5          2HB       LEU   5 -11.882   3.768  -1.574
   62    HG   LEU   5           HG       LEU   5 -13.657   5.437  -0.980
   63   1HD1  LEU   5          1HD1      LEU   5 -12.131   7.018  -0.302
   64   2HD1  LEU   5          2HD1      LEU   5 -11.336   7.109  -1.871
   65   3HD1  LEU   5          3HD1      LEU   5 -10.995   5.763  -0.786
   66   1HD2  LEU   5          1HD2      LEU   5 -14.073   7.336  -2.420
   67   2HD2  LEU   5          2HD2      LEU   5 -14.343   5.870  -3.360
   68   3HD2  LEU   5          3HD2      LEU   5 -12.853   6.791  -3.571
   69    H    ASP   6           H        ASP   6 -12.097   2.186  -4.373
   70    HA   ASP   6           HA       ASP   6  -9.821   0.740  -3.472
   71   1HB   ASP   6          1HB       ASP   6 -11.654   0.192  -5.826
   72   2HB   ASP   6          2HB       ASP   6 -10.514  -0.971  -5.149
   73    H    GLY   7           H        GLY   7 -10.413   2.484  -6.498
   74   1HA   GLY   7          1HA       GLY   7  -8.130   1.561  -7.924
   75   2HA   GLY   7          2HA       GLY   7  -8.930   3.107  -8.206
   76    H    ILE   8           H        ILE   8  -8.505   4.502  -5.905
   77    HA   ILE   8           HA       ILE   8  -5.764   5.296  -6.155
   78    HB   ILE   8           HB       ILE   8  -7.743   5.898  -3.937
   79   1HG1  ILE   8          1HG1      ILE   8  -6.983   7.516  -6.392
   80   2HG1  ILE   8          2HG1      ILE   8  -8.445   6.537  -6.268
   81   1HG2  ILE   8          1HG2      ILE   8  -5.480   6.389  -3.207
   82   2HG2  ILE   8          2HG2      ILE   8  -6.265   7.912  -3.615
   83   3HG2  ILE   8          3HG2      ILE   8  -5.115   7.185  -4.737
   84   1HD1  ILE   8          1HD1      ILE   8  -7.707   8.995  -4.674
   85   2HD1  ILE   8          2HD1      ILE   8  -8.966   7.882  -4.138
   86   3HD1  ILE   8          3HD1      ILE   8  -9.135   8.731  -5.675
   87    H    LEU   9           H        LEU   9  -7.434   3.617  -3.457
   88    HA   LEU   9           HA       LEU   9  -5.077   3.191  -1.914
   89   1HB   LEU   9          1HB       LEU   9  -7.531   1.413  -2.035
   90   2HB   LEU   9          2HB       LEU   9  -6.371   1.510  -0.713
   91    HG   LEU   9           HG       LEU   9  -8.043   3.849  -1.674
   92   1HD1  LEU   9          1HD1      LEU   9  -9.340   3.474   0.423
   93   2HD1  LEU   9          2HD1      LEU   9  -8.437   1.982   0.683
   94   3HD1  LEU   9          3HD1      LEU   9  -9.498   2.138  -0.717
   95   1HD2  LEU   9          1HD2      LEU   9  -6.087   3.416   0.590
   96   2HD2  LEU   9          2HD2      LEU   9  -7.348   4.641   0.715
   97   3HD2  LEU   9          3HD2      LEU   9  -6.153   4.740  -0.573
   98    H    PHE  10           H        PHE  10  -6.615   1.164  -4.415
   99    HA   PHE  10           HA       PHE  10  -4.811  -1.045  -4.146
  100   1HB   PHE  10          1HB       PHE  10  -6.939  -1.190  -5.403
  101   2HB   PHE  10          2HB       PHE  10  -6.285  -0.095  -6.623
  102    HD1  PHE  10           HD1      PHE  10  -5.587  -3.348  -4.908
  103    HD2  PHE  10           HD2      PHE  10  -5.034  -0.952  -8.431
  104    HE1  PHE  10           HE1      PHE  10  -4.513  -5.271  -6.048
  105    HE2  PHE  10           HE2      PHE  10  -3.959  -2.876  -9.569
  106    HZ   PHE  10           HZ       PHE  10  -3.698  -5.035  -8.377
  107    H    ILE  11           H        ILE  11  -4.813   1.613  -6.547
  108    HA   ILE  11           HA       ILE  11  -2.352   0.990  -7.779
  109    HB   ILE  11           HB       ILE  11  -3.642   3.682  -7.248
  110   1HG1  ILE  11          1HG1      ILE  11  -3.500   2.110  -9.829
  111   2HG1  ILE  11          2HG1      ILE  11  -4.814   1.888  -8.674
  112   1HG2  ILE  11          1HG2      ILE  11  -1.355   4.162  -7.692
  113   2HG2  ILE  11          2HG2      ILE  11  -2.175   4.365  -9.240
  114   3HG2  ILE  11          3HG2      ILE  11  -1.247   2.900  -8.917
  115   1HD1  ILE  11          1HD1      ILE  11  -5.562   4.125  -8.923
  116   2HD1  ILE  11          2HD1      ILE  11  -5.199   3.595 -10.565
  117   3HD1  ILE  11          3HD1      ILE  11  -4.060   4.628  -9.701
  118    H    TYR  12           H        TYR  12  -3.019   2.859  -4.840
  119    HA   TYR  12           HA       TYR  12  -0.413   3.823  -4.313
  120   1HB   TYR  12          1HB       TYR  12  -2.427   4.452  -3.003
  121   2HB   TYR  12          2HB       TYR  12  -2.458   2.835  -2.302
  122    HD1  TYR  12           HD1      TYR  12  -0.584   6.017  -2.477
  123    HD2  TYR  12           HD2      TYR  12  -0.860   2.156  -0.616
  124    HE1  TYR  12           HE1      TYR  12   1.049   6.731  -0.752
  125    HE2  TYR  12           HE2      TYR  12   0.773   2.869   1.109
  126    HH   TYR  12           HH       TYR  12   2.805   5.180   0.869
  127    H    GLY  13           H        GLY  13  -1.880   0.679  -3.470
  128   1HA   GLY  13          1HA       GLY  13   0.422  -0.308  -2.058
  129   2HA   GLY  13          2HA       GLY  13  -0.873  -1.304  -2.718
  130    H    VAL  14           H        VAL  14  -0.561  -0.470  -5.470
  131    HA   VAL  14           HA       VAL  14   1.512  -2.302  -6.269
  132    HB   VAL  14           HB       VAL  14  -0.031  -0.238  -7.867
  133   1HG1  VAL  14          1HG1      VAL  14   1.943  -0.739  -9.121
  134   2HG1  VAL  14          2HG1      VAL  14   0.673  -1.760  -9.798
  135   3HG1  VAL  14          3HG1      VAL  14   1.864  -2.448  -8.693
  136   1HG2  VAL  14          1HG2      VAL  14  -1.465  -1.951  -6.899
  137   2HG2  VAL  14          2HG2      VAL  14  -0.368  -3.223  -7.440
  138   3HG2  VAL  14          3HG2      VAL  14  -1.276  -2.280  -8.623
  139    H    ILE  15           H        ILE  15   1.305   1.269  -6.399
  140    HA   ILE  15           HA       ILE  15   3.891   1.638  -7.565
  141    HB   ILE  15           HB       ILE  15   2.320   3.492  -5.751
  142   1HG1  ILE  15          1HG1      ILE  15   2.546   3.448  -8.775
  143   2HG1  ILE  15          2HG1      ILE  15   1.204   2.722  -7.891
  144   1HG2  ILE  15          1HG2      ILE  15   3.726   5.233  -6.984
  145   2HG2  ILE  15          2HG2      ILE  15   4.735   3.895  -7.534
  146   3HG2  ILE  15          3HG2      ILE  15   4.595   4.245  -5.812
  147   1HD1  ILE  15          1HD1      ILE  15   0.701   4.914  -6.863
  148   2HD1  ILE  15          2HD1      ILE  15   0.626   5.001  -8.623
  149   3HD1  ILE  15          3HD1      ILE  15   2.030   5.637  -7.769
  150    H    LEU  16           H        LEU  16   2.839   1.331  -4.192
  151    HA   LEU  16           HA       LEU  16   5.434   1.996  -3.100
  152   1HB   LEU  16          1HB       LEU  16   2.887   1.675  -2.062
  153   2HB   LEU  16          2HB       LEU  16   3.685   0.229  -1.469
  154    HG   LEU  16           HG       LEU  16   4.034   1.826   0.231
  155   1HD1  LEU  16          1HD1      LEU  16   6.198   0.730  -0.926
  156   2HD1  LEU  16          2HD1      LEU  16   6.313   1.817   0.451
  157   3HD1  LEU  16          3HD1      LEU  16   6.603   2.427  -1.175
  158   1HD2  LEU  16          1HD2      LEU  16   4.937   3.864  -1.827
  159   2HD2  LEU  16          2HD2      LEU  16   4.634   4.135  -0.113
  160   3HD2  LEU  16          3HD2      LEU  16   3.292   3.778  -1.197
  161    H    THR  17           H        THR  17   3.764  -1.066  -3.820
  162    HA   THR  17           HA       THR  17   5.791  -2.804  -2.829
  163    HB   THR  17           HB       THR  17   4.028  -3.355  -5.229
  164    HG1  THR  17           HG1      THR  17   2.751  -2.583  -3.547
  165   1HG2  THR  17          1HG2      THR  17   5.067  -5.178  -3.045
  166   2HG2  THR  17          2HG2      THR  17   5.837  -4.989  -4.620
  167   3HG2  THR  17          3HG2      THR  17   4.208  -5.657  -4.509
  168    H    ALA  18           H        ALA  18   5.399  -1.226  -5.988
  169    HA   ALA  18           HA       ALA  18   7.521  -2.583  -7.329
  170   1HB   ALA  18          1HB       ALA  18   7.577  -0.465  -8.756
  171   2HB   ALA  18          2HB       ALA  18   6.321   0.172  -7.695
  172   3HB   ALA  18          3HB       ALA  18   6.016  -1.278  -8.652
  173    H    LEU  19           H        LEU  19   7.554   0.584  -5.649
  174    HA   LEU  19           HA       LEU  19  10.371   1.011  -5.925
  175   1HB   LEU  19          1HB       LEU  19   8.549   1.970  -3.697
  176   2HB   LEU  19          2HB       LEU  19  10.104   2.669  -4.143
  177    HG   LEU  19           HG       LEU  19   7.787   2.465  -6.085
  178   1HD1  LEU  19          1HD1      LEU  19   7.302   4.814  -5.566
  179   2HD1  LEU  19          2HD1      LEU  19   8.570   4.820  -4.340
  180   3HD1  LEU  19          3HD1      LEU  19   7.132   3.824  -4.117
  181   1HD2  LEU  19          1HD2      LEU  19   9.837   2.836  -7.252
  182   2HD2  LEU  19          2HD2      LEU  19  10.422   3.963  -6.028
  183   3HD2  LEU  19          3HD2      LEU  19   9.106   4.432  -7.102
  184    H    PHE  20           H        PHE  20   8.482  -0.812  -3.571
  185    HA   PHE  20           HA       PHE  20  10.592  -1.162  -1.654
  186   1HB   PHE  20          1HB       PHE  20   8.242  -1.654  -1.112
  187   2HB   PHE  20          2HB       PHE  20   8.236  -2.965  -2.293
  188    HD1  PHE  20           HD1      PHE  20   9.621  -4.991  -1.933
  189    HD2  PHE  20           HD2      PHE  20   9.300  -1.910   1.041
  190    HE1  PHE  20           HE1      PHE  20  10.534  -6.544  -0.229
  191    HE2  PHE  20           HE2      PHE  20  10.213  -3.463   2.747
  192    HZ   PHE  20           HZ       PHE  20  10.830  -5.780   2.110
  193    H    LEU  21           H        LEU  21   9.457  -3.299  -4.298
  194    HA   LEU  21           HA       LEU  21  11.493  -5.274  -3.924
  195   1HB   LEU  21          1HB       LEU  21  10.016  -4.517  -6.463
  196   2HB   LEU  21          2HB       LEU  21  10.904  -6.015  -6.207
  197    HG   LEU  21           HG       LEU  21   8.621  -5.145  -4.416
  198   1HD1  LEU  21          1HD1      LEU  21   7.318  -6.892  -5.764
  199   2HD1  LEU  21          2HD1      LEU  21   8.593  -6.753  -6.975
  200   3HD1  LEU  21          3HD1      LEU  21   7.613  -5.347  -6.562
  201   1HD2  LEU  21          1HD2      LEU  21   8.569  -7.716  -4.098
  202   2HD2  LEU  21          2HD2      LEU  21   9.895  -6.842  -3.341
  203   3HD2  LEU  21          3HD2      LEU  21  10.164  -7.718  -4.847
  204    H    ARG  22           H        ARG  22  11.377  -2.370  -5.984
  205    HA   ARG  22           HA       ARG  22  13.768  -2.793  -7.424
  206   1HB   ARG  22          1HB       ARG  22  12.105  -0.903  -7.749
  207   2HB   ARG  22          2HB       ARG  22  12.850  -0.109  -6.360
  208   1HG   ARG  22          1HG       ARG  22  15.050  -0.203  -7.519
  209   2HG   ARG  22          2HG       ARG  22  14.256  -0.913  -8.925
  210   1HD   ARG  22          1HD       ARG  22  13.534   1.777  -7.728
  211   2HD   ARG  22          2HD       ARG  22  14.568   1.556  -9.139
  212    HE   ARG  22           HE       ARG  22  12.259   0.179  -9.798
  213   1HH1  ARG  22          1HH1      ARG  22  13.045   3.341  -8.667
  214   2HH1  ARG  22          2HH1      ARG  22  11.718   4.105  -9.477
  215   1HH2  ARG  22          1HH2      ARG  22  10.520   1.160 -10.862
  216   2HH2  ARG  22          2HH2      ARG  22  10.289   2.871 -10.719
  217    H    VAL  23           H        VAL  23  13.292  -1.475  -4.161
  218    HA   VAL  23           HA       VAL  23  16.104  -0.854  -3.775
  219    HB   VAL  23           HB       VAL  23  13.853  -1.247  -1.779
  220   1HG1  VAL  23          1HG1      VAL  23  15.424   0.104  -0.299
  221   2HG1  VAL  23          2HG1      VAL  23  16.688  -0.225  -1.484
  222   3HG1  VAL  23          3HG1      VAL  23  15.928  -1.557  -0.613
  223   1HG2  VAL  23          1HG2      VAL  23  15.138   1.306  -2.782
  224   2HG2  VAL  23          2HG2      VAL  23  13.689   1.155  -1.789
  225   3HG2  VAL  23          3HG2      VAL  23  13.660   0.635  -3.473
  226    H    LYS  24           H        LYS  24  14.072  -3.676  -3.273
  227    HA   LYS  24           HA       LYS  24  15.729  -5.142  -1.503
  228   1HB   LYS  24          1HB       LYS  24  13.418  -5.803  -2.238
  229   2HB   LYS  24          2HB       LYS  24  14.103  -6.285  -3.790
  230   1HG   LYS  24          1HG       LYS  24  15.608  -7.870  -2.624
  231   2HG   LYS  24          2HG       LYS  24  14.881  -7.409  -1.083
  232   1HD   LYS  24          1HD       LYS  24  12.642  -8.102  -2.038
  233   2HD   LYS  24          2HD       LYS  24  13.516  -8.771  -3.417
  234   1HE   LYS  24          1HE       LYS  24  13.050 -10.498  -1.695
  235   2HE   LYS  24          2HE       LYS  24  14.781 -10.253  -1.930
  236   1HZ   LYS  24          1HZ       LYS  24  15.010  -9.565   0.154
  237   2HZ   LYS  24          2HZ       LYS  24  13.426 -10.107   0.442
  238   3HZ   LYS  24          3HZ       LYS  24  13.711  -8.483   0.033
  239    H    PHE  25           H        PHE  25  15.875  -4.800  -5.039
  240    HA   PHE  25           HA       PHE  25  18.699  -5.666  -4.964
  241   1HB   PHE  25          1HB       PHE  25  18.363  -7.343  -6.753
  242   2HB   PHE  25          2HB       PHE  25  17.480  -7.782  -5.291
  243    HD1  PHE  25           HD1      PHE  25  17.153  -6.341  -8.692
  244    HD2  PHE  25           HD2      PHE  25  15.082  -7.842  -5.242
  245    HE1  PHE  25           HE1      PHE  25  15.032  -6.371  -9.978
  246    HE2  PHE  25           HE2      PHE  25  12.960  -7.871  -6.527
  247    HZ   PHE  25           HZ       PHE  25  12.936  -7.136  -8.895
  248    H    SER  26           H        SER  26  19.743  -5.273  -7.130
  249    HA   SER  26           HA       SER  26  18.250  -3.557  -9.003
  250   1HB   SER  26          1HB       SER  26  19.013  -1.991  -7.215
  251   2HB   SER  26          2HB       SER  26  20.673  -2.494  -7.517
  252    HG   SER  26           HG       SER  26  20.682  -1.388  -9.330
  253    H    ARG  27           H        ARG  27  19.443  -3.210 -10.988
  254    HA   ARG  27           HA       ARG  27  20.966  -5.422 -11.875
  255   1HB   ARG  27          1HB       ARG  27  19.805  -3.792 -13.369
  256   2HB   ARG  27          2HB       ARG  27  21.041  -2.597 -12.977
  257   1HG   ARG  27          1HG       ARG  27  22.783  -4.088 -13.885
  258   2HG   ARG  27          2HG       ARG  27  21.553  -5.293 -14.270
  259   1HD   ARG  27          1HD       ARG  27  20.450  -3.703 -15.788
  260   2HD   ARG  27          2HD       ARG  27  21.652  -2.475 -15.389
  261    HE   ARG  27           HE       ARG  27  23.166  -4.617 -16.284
  262   1HH1  ARG  27          1HH1      ARG  27  20.493  -2.778 -17.451
  263   2HH1  ARG  27          2HH1      ARG  27  20.915  -2.975 -19.120
  264   1HH2  ARG  27          1HH2      ARG  27  23.731  -4.887 -18.457
  265   2HH2  ARG  27          2HH2      ARG  27  22.748  -4.168 -19.688
  266    H    SER  28           H        SER  28  21.977  -2.396 -10.377
  267    HA   SER  28           HA       SER  28  24.744  -2.478 -10.962
  268   1HB   SER  28          1HB       SER  28  25.033  -1.130  -8.920
  269   2HB   SER  28          2HB       SER  28  23.639  -0.572  -9.841
  270    HG   SER  28           HG       SER  28  23.751  -2.045  -7.445
  271    H    ALA  29           H        ALA  29  22.834  -4.451  -8.814
  272    HA   ALA  29           HA       ALA  29  24.880  -5.375  -7.064
  273   1HB   ALA  29          1HB       ALA  29  23.426  -7.360  -6.745
  274   2HB   ALA  29          2HB       ALA  29  22.456  -6.858  -8.130
  275   3HB   ALA  29          3HB       ALA  29  22.501  -5.859  -6.678
  276    H    ASP  30           H        ASP  30  24.067  -6.247 -10.374
  277    HA   ASP  30           HA       ASP  30  26.642  -7.603 -10.662
  278   1HB   ASP  30          1HB       ASP  30  25.123  -9.362  -9.673
  279   2HB   ASP  30          2HB       ASP  30  24.115  -9.215 -11.113
  280   1H    ASP  -3          1H        ASP  -3 -23.122  -1.799  -3.384
  281    HA   ASP  -3           HA       ASP  -3 -22.145   0.103  -2.697
  282   1HB   ASP  -3          1HB       ASP  -3 -23.463   2.134  -2.097
  283   2HB   ASP  -3          2HB       ASP  -3 -23.820   1.563  -3.728
  284    H    SER  -2           H        SER  -2 -23.363  -2.212  -1.155
  285    HA   SER  -2           HA       SER  -2 -24.183  -1.285   1.427
  286   1HB   SER  -2          1HB       SER  -2 -22.865  -3.869   0.552
  287   2HB   SER  -2          2HB       SER  -2 -23.467  -3.587   2.183
  288    HG   SER  -2           HG       SER  -2 -24.814  -4.259  -0.048
  289    H    LYS  -1           H        LYS  -1 -22.811  -1.626   3.446
  290    HA   LYS  -1           HA       LYS  -1 -20.454  -0.022   3.317
  291   1HB   LYS  -1          1HB       LYS  -1 -20.094  -0.705   5.652
  292   2HB   LYS  -1          2HB       LYS  -1 -21.794  -0.322   5.381
  293   1HG   LYS  -1          1HG       LYS  -1 -22.186  -2.789   4.967
  294   2HG   LYS  -1          2HG       LYS  -1 -20.534  -3.071   5.518
  295   1HD   LYS  -1          1HD       LYS  -1 -21.102  -1.913   7.663
  296   2HD   LYS  -1          2HD       LYS  -1 -22.775  -1.797   7.113
  297   1HE   LYS  -1          1HE       LYS  -1 -21.300  -4.433   7.267
  298   2HE   LYS  -1          2HE       LYS  -1 -22.235  -3.791   8.617
  299   1HZ   LYS  -1          1HZ       LYS  -1 -23.515  -5.307   7.186
  300   2HZ   LYS  -1          2HZ       LYS  -1 -23.308  -4.234   5.884
  301   3HZ   LYS  -1          3HZ       LYS  -1 -24.189  -3.752   7.256
  302    H    LEU   1           H        LEU   1 -20.912  -3.161   2.269
  303    HA   LEU   1           HA       LEU   1 -18.623  -4.572   3.088
  304   1HB   LEU   1          1HB       LEU   1 -20.485  -5.444   1.609
  305   2HB   LEU   1          2HB       LEU   1 -19.749  -4.563   0.274
  306    HG   LEU   1           HG       LEU   1 -17.560  -5.857   0.953
  307   1HD1  LEU   1          1HD1      LEU   1 -19.737  -7.549   2.219
  308   2HD1  LEU   1          2HD1      LEU   1 -18.323  -6.864   3.017
  309   3HD1  LEU   1          3HD1      LEU   1 -18.128  -8.151   1.832
  310   1HD2  LEU   1          1HD2      LEU   1 -18.711  -6.207  -1.171
  311   2HD2  LEU   1          2HD2      LEU   1 -19.924  -7.214  -0.381
  312   3HD2  LEU   1          3HD2      LEU   1 -18.254  -7.769  -0.493
  313    H    CYS   2           H        CYS   2 -18.956  -2.021   0.657
  314    HA   CYS   2           HA       CYS   2 -16.410  -2.236  -0.561
  315   1HB   CYS   2          1HB       CYS   2 -18.057  -0.711  -1.468
  316   2HB   CYS   2          2HB       CYS   2 -18.100   0.211   0.036
  317    H    TYR   3           H        TYR   3 -17.380  -0.830   2.518
  318    HA   TYR   3           HA       TYR   3 -14.960   0.566   3.103
  319   1HB   TYR   3          1HB       TYR   3 -17.170   0.699   4.368
  320   2HB   TYR   3          2HB       TYR   3 -16.721  -0.823   5.136
  321    HD1  TYR   3           HD1      TYR   3 -15.227  -0.854   6.979
  322    HD2  TYR   3           HD2      TYR   3 -15.549   2.671   4.545
  323    HE1  TYR   3           HE1      TYR   3 -13.815   0.389   8.594
  324    HE2  TYR   3           HE2      TYR   3 -14.137   3.915   6.161
  325    HH   TYR   3           HH       TYR   3 -12.577   2.288   8.873
  326    H    LEU   4           H        LEU   4 -15.801  -2.828   3.226
  327    HA   LEU   4           HA       LEU   4 -13.656  -3.658   4.958
  328   1HB   LEU   4          1HB       LEU   4 -15.659  -5.060   4.425
  329   2HB   LEU   4          2HB       LEU   4 -15.054  -5.242   2.781
  330    HG   LEU   4           HG       LEU   4 -12.957  -6.255   3.719
  331   1HD1  LEU   4          1HD1      LEU   4 -14.461  -5.786   6.287
  332   2HD1  LEU   4          2HD1      LEU   4 -12.751  -5.539   5.937
  333   3HD1  LEU   4          3HD1      LEU   4 -13.374  -7.168   6.160
  334   1HD2  LEU   4          1HD2      LEU   4 -13.954  -8.420   4.118
  335   2HD2  LEU   4          2HD2      LEU   4 -14.956  -7.584   2.931
  336   3HD2  LEU   4          3HD2      LEU   4 -15.479  -7.682   4.611
  337    H    LEU   5           H        LEU   5 -13.972  -3.508   1.402
  338    HA   LEU   5           HA       LEU   5 -11.361  -4.526   0.836
  339   1HB   LEU   5          1HB       LEU   5 -13.309  -2.794  -0.686
  340   2HB   LEU   5          2HB       LEU   5 -11.705  -3.114  -1.345
  341    HG   LEU   5           HG       LEU   5 -12.151  -5.570  -1.097
  342   1HD1  LEU   5          1HD1      LEU   5 -13.812  -5.623   0.625
  343   2HD1  LEU   5          2HD1      LEU   5 -14.620  -6.162  -0.846
  344   3HD1  LEU   5          3HD1      LEU   5 -14.861  -4.516  -0.262
  345   1HD2  LEU   5          1HD2      LEU   5 -12.508  -4.501  -3.257
  346   2HD2  LEU   5          2HD2      LEU   5 -14.108  -3.953  -2.758
  347   3HD2  LEU   5          3HD2      LEU   5 -13.795  -5.675  -2.984
  348    H    ASP   6           H        ASP   6 -12.546  -1.188   1.259
  349    HA   ASP   6           HA       ASP   6 -10.058   0.108   0.755
  350   1HB   ASP   6          1HB       ASP   6 -12.384   0.919   2.526
  351   2HB   ASP   6          2HB       ASP   6 -11.042   1.985   2.107
  352    H    GLY   7           H        GLY   7 -11.412  -1.318   3.701
  353   1HA   GLY   7          1HA       GLY   7  -9.459  -0.326   5.530
  354   2HA   GLY   7          2HA       GLY   7 -10.406  -1.794   5.767
  355    H    ILE   8           H        ILE   8  -9.570  -3.458   3.787
  356    HA   ILE   8           HA       ILE   8  -7.030  -4.369   4.737
  357    HB   ILE   8           HB       ILE   8  -8.503  -5.042   2.172
  358   1HG1  ILE   8          1HG1      ILE   8  -8.326  -6.560   4.793
  359   2HG1  ILE   8          2HG1      ILE   8  -9.673  -5.502   4.368
  360   1HG2  ILE   8          1HG2      ILE   8  -7.083  -7.148   2.339
  361   2HG2  ILE   8          2HG2      ILE   8  -6.116  -6.302   3.545
  362   3HG2  ILE   8          3HG2      ILE   8  -6.205  -5.686   1.896
  363   1HD1  ILE   8          1HD1      ILE   8 -10.251  -7.803   3.797
  364   2HD1  ILE   8          2HD1      ILE   8  -8.772  -7.969   2.850
  365   3HD1  ILE   8          3HD1      ILE   8 -10.045  -6.873   2.313
  366    H    LEU   9           H        LEU   9  -7.910  -2.661   1.719
  367    HA   LEU   9           HA       LEU   9  -5.238  -2.568   0.690
  368   1HB   LEU   9          1HB       LEU   9  -7.515  -0.622   0.209
  369   2HB   LEU   9          2HB       LEU   9  -6.083  -0.808  -0.800
  370    HG   LEU   9           HG       LEU   9  -7.925  -3.137  -0.227
  371   1HD1  LEU   9          1HD1      LEU   9  -9.273  -1.329  -1.231
  372   2HD1  LEU   9          2HD1      LEU   9  -9.043  -2.656  -2.371
  373   3HD1  LEU   9          3HD1      LEU   9  -8.097  -1.177  -2.535
  374   1HD2  LEU   9          1HD2      LEU   9  -5.826  -3.827  -1.160
  375   2HD2  LEU   9          2HD2      LEU   9  -5.833  -2.508  -2.332
  376   3HD2  LEU   9          3HD2      LEU   9  -6.977  -3.837  -2.494
  377    H    PHE  10           H        PHE  10  -7.086  -0.299   2.721
  378    HA   PHE  10           HA       PHE  10  -5.096   1.755   2.783
  379   1HB   PHE  10          1HB       PHE  10  -7.432   2.081   3.557
  380   2HB   PHE  10          2HB       PHE  10  -7.111   1.021   4.929
  381    HD1  PHE  10           HD1      PHE  10  -6.054   4.200   3.297
  382    HD2  PHE  10           HD2      PHE  10  -6.014   1.829   6.877
  383    HE1  PHE  10           HE1      PHE  10  -5.109   6.117   4.555
  384    HE2  PHE  10           HE2      PHE  10  -5.068   3.746   8.136
  385    HZ   PHE  10           HZ       PHE  10  -4.614   5.889   6.975
  386    H    ILE  11           H        ILE  11  -5.795  -0.823   5.172
  387    HA   ILE  11           HA       ILE  11  -3.604  -0.296   6.882
  388    HB   ILE  11           HB       ILE  11  -4.925  -2.941   6.202
  389   1HG1  ILE  11          1HG1      ILE  11  -5.307  -1.133   8.604
  390   2HG1  ILE  11          2HG1      ILE  11  -6.339  -1.066   7.176
  391   1HG2  ILE  11          1HG2      ILE  11  -2.987  -2.144   8.385
  392   2HG2  ILE  11          2HG2      ILE  11  -2.809  -3.441   7.205
  393   3HG2  ILE  11          3HG2      ILE  11  -4.008  -3.578   8.490
  394   1HD1  ILE  11          1HD1      ILE  11  -6.987  -3.398   7.481
  395   2HD1  ILE  11          2HD1      ILE  11  -7.287  -2.512   8.976
  396   3HD1  ILE  11          3HD1      ILE  11  -5.874  -3.558   8.839
  397    H    TYR  12           H        TYR  12  -3.794  -2.150   3.881
  398    HA   TYR  12           HA       TYR  12  -1.199  -3.330   3.976
  399   1HB   TYR  12          1HB       TYR  12  -2.928  -3.966   2.320
  400   2HB   TYR  12          2HB       TYR  12  -2.762  -2.387   1.552
  401    HD1  TYR  12           HD1      TYR  12  -0.778  -1.806   0.260
  402    HD2  TYR  12           HD2      TYR  12  -1.141  -5.641   2.162
  403    HE1  TYR  12           HE1      TYR  12   1.132  -2.649  -1.078
  404    HE2  TYR  12           HE2      TYR  12   0.768  -6.485   0.824
  405    HH   TYR  12           HH       TYR  12   2.619  -5.722  -0.420
  406    H    GLY  13           H        GLY  13  -2.302  -0.179   2.729
  407   1HA   GLY  13          1HA       GLY  13   0.208   0.655   1.663
  408   2HA   GLY  13          2HA       GLY  13  -1.072   1.746   2.194
  409    H    VAL  14           H        VAL  14  -1.162   0.910   4.927
  410    HA   VAL  14           HA       VAL  14   0.989   2.514   5.986
  411    HB   VAL  14           HB       VAL  14  -0.994   0.681   7.364
  412   1HG1  VAL  14          1HG1      VAL  14   1.049   2.641   8.427
  413   2HG1  VAL  14          2HG1      VAL  14   0.825   0.952   8.880
  414   3HG1  VAL  14          3HG1      VAL  14  -0.364   2.160   9.366
  415   1HG2  VAL  14          1HG2      VAL  14  -1.999   2.942   7.978
  416   2HG2  VAL  14          2HG2      VAL  14  -2.135   2.495   6.278
  417   3HG2  VAL  14          3HG2      VAL  14  -0.909   3.655   6.789
  418    H    ILE  15           H        ILE  15   0.331  -1.005   6.070
  419    HA   ILE  15           HA       ILE  15   2.727  -1.631   7.540
  420    HB   ILE  15           HB       ILE  15   1.114  -3.404   5.680
  421   1HG1  ILE  15          1HG1      ILE  15   0.938  -3.071   8.691
  422   2HG1  ILE  15          2HG1      ILE  15  -0.181  -2.327   7.550
  423   1HG2  ILE  15          1HG2      ILE  15   3.096  -4.016   7.895
  424   2HG2  ILE  15          2HG2      ILE  15   3.310  -4.350   6.177
  425   3HG2  ILE  15          3HG2      ILE  15   2.087  -5.222   7.099
  426   1HD1  ILE  15          1HD1      ILE  15  -0.809  -4.551   6.698
  427   2HD1  ILE  15          2HD1      ILE  15  -1.088  -4.451   8.438
  428   3HD1  ILE  15          3HD1      ILE  15   0.325  -5.305   7.819
  429    H    LEU  16           H        LEU  16   2.002  -1.393   4.072
  430    HA   LEU  16           HA       LEU  16   4.582  -2.458   3.270
  431   1HB   LEU  16          1HB       LEU  16   2.280  -2.183   1.937
  432   2HB   LEU  16          2HB       LEU  16   2.993  -0.646   1.473
  433    HG   LEU  16           HG       LEU  16   3.583  -2.241  -0.223
  434   1HD1  LEU  16          1HD1      LEU  16   6.058  -2.114   1.496
  435   2HD1  LEU  16          2HD1      LEU  16   5.379  -0.669   0.745
  436   3HD1  LEU  16          3HD1      LEU  16   5.928  -2.007  -0.259
  437   1HD2  LEU  16          1HD2      LEU  16   3.284  -4.219   1.550
  438   2HD2  LEU  16          2HD2      LEU  16   5.034  -4.059   1.684
  439   3HD2  LEU  16          3HD2      LEU  16   4.299  -4.419   0.126
  440    H    THR  17           H        THR  17   3.240   0.822   3.633
  441    HA   THR  17           HA       THR  17   5.604   2.173   2.702
  442    HB   THR  17           HB       THR  17   3.529   3.203   4.659
  443    HG1  THR  17           HG1      THR  17   2.347   3.738   2.915
  444   1HG2  THR  17          1HG2      THR  17   4.173   5.397   3.672
  445   2HG2  THR  17          2HG2      THR  17   5.432   4.582   2.745
  446   3HG2  THR  17          3HG2      THR  17   5.514   4.614   4.506
  447    H    ALA  18           H        ALA  18   4.527   1.096   5.905
  448    HA   ALA  18           HA       ALA  18   6.541   2.373   7.452
  449   1HB   ALA  18          1HB       ALA  18   6.112   0.561   9.112
  450   2HB   ALA  18          2HB       ALA  18   5.158  -0.290   7.896
  451   3HB   ALA  18          3HB       ALA  18   4.622   1.279   8.499
  452    H    LEU  19           H        LEU  19   6.533  -0.867   5.942
  453    HA   LEU  19           HA       LEU  19   9.192  -1.547   6.802
  454   1HB   LEU  19          1HB       LEU  19   7.652  -2.538   4.383
  455   2HB   LEU  19          2HB       LEU  19   9.064  -3.317   5.090
  456    HG   LEU  19           HG       LEU  19   6.535  -2.779   6.668
  457   1HD1  LEU  19          1HD1      LEU  19   5.918  -5.120   6.242
  458   2HD1  LEU  19          2HD1      LEU  19   7.329  -5.314   5.202
  459   3HD1  LEU  19          3HD1      LEU  19   6.024  -4.227   4.725
  460   1HD2  LEU  19          1HD2      LEU  19   8.338  -3.227   8.151
  461   2HD2  LEU  19          2HD2      LEU  19   9.020  -4.458   7.091
  462   3HD2  LEU  19          3HD2      LEU  19   7.530  -4.782   7.973
  463    H    PHE  20           H        PHE  20   7.954   0.215   4.003
  464    HA   PHE  20           HA       PHE  20  10.391   0.181   2.487
  465   1HB   PHE  20          1HB       PHE  20   8.282   0.855   1.457
  466   2HB   PHE  20          2HB       PHE  20   8.152   2.226   2.559
  467    HD1  PHE  20           HD1      PHE  20   9.560   4.194   2.304
  468    HD2  PHE  20           HD2      PHE  20   9.952   0.836  -0.346
  469    HE1  PHE  20           HE1      PHE  20  10.927   5.572   0.761
  470    HE2  PHE  20           HE2      PHE  20  11.320   2.214  -1.889
  471    HZ   PHE  20           HZ       PHE  20  11.806   4.583  -1.336
  472    H    LEU  21           H        LEU  21   9.075   2.651   4.724
  473    HA   LEU  21           HA       LEU  21  11.318   4.400   4.592
  474   1HB   LEU  21          1HB       LEU  21   9.475   3.911   6.950
  475   2HB   LEU  21          2HB       LEU  21  10.486   5.332   6.708
  476    HG   LEU  21           HG       LEU  21   8.389   4.474   4.700
  477   1HD1  LEU  21          1HD1      LEU  21   7.015   6.343   5.759
  478   2HD1  LEU  21          2HD1      LEU  21   8.134   6.271   7.120
  479   3HD1  LEU  21          3HD1      LEU  21   7.153   4.864   6.711
  480   1HD2  LEU  21          1HD2      LEU  21   9.997   6.994   5.196
  481   2HD2  LEU  21          2HD2      LEU  21   8.534   7.003   4.216
  482   3HD2  LEU  21          3HD2      LEU  21   9.914   6.027   3.725
  483    H    ARG  22           H        ARG  22  10.677   1.584   6.658
  484    HA   ARG  22           HA       ARG  22  12.829   1.861   8.461
  485   1HB   ARG  22          1HB       ARG  22  11.021   0.088   8.530
  486   2HB   ARG  22          2HB       ARG  22  11.905  -0.765   7.263
  487   1HG   ARG  22          1HG       ARG  22  13.930  -0.743   8.759
  488   2HG   ARG  22          2HG       ARG  22  12.912  -0.081  10.039
  489   1HD   ARG  22          1HD       ARG  22  12.975  -2.461  10.368
  490   2HD   ARG  22          2HD       ARG  22  11.383  -2.080   9.712
  491    HE   ARG  22           HE       ARG  22  12.907  -2.640   7.467
  492   1HH1  ARG  22          1HH1      ARG  22  12.195  -4.184  10.463
  493   2HH1  ARG  22          2HH1      ARG  22  12.329  -5.788   9.823
  494   1HH2  ARG  22          1HH2      ARG  22  13.090  -4.725   6.610
  495   2HH2  ARG  22          2HH2      ARG  22  12.836  -6.095   7.639
  496    H    VAL  23           H        VAL  23  12.797   0.465   5.185
  497    HA   VAL  23           HA       VAL  23  15.572  -0.343   5.257
  498    HB   VAL  23           HB       VAL  23  13.755   0.235   2.898
  499   1HG1  VAL  23          1HG1      VAL  23  16.046   0.293   2.158
  500   2HG1  VAL  23          2HG1      VAL  23  15.401  -1.287   1.715
  501   3HG1  VAL  23          3HG1      VAL  23  16.452  -1.128   3.123
  502   1HG2  VAL  23          1HG2      VAL  23  13.611  -2.288   2.860
  503   2HG2  VAL  23          2HG2      VAL  23  12.845  -1.543   4.263
  504   3HG2  VAL  23          3HG2      VAL  23  14.431  -2.298   4.422
  505    H    LYS  24           H        LYS  24  13.877   2.595   4.275
  506    HA   LYS  24           HA       LYS  24  15.961   3.898   2.885
  507   1HB   LYS  24          1HB       LYS  24  13.571   4.706   3.173
  508   2HB   LYS  24          2HB       LYS  24  14.023   5.239   4.788
  509   1HG   LYS  24          1HG       LYS  24  14.357   7.193   3.545
  510   2HG   LYS  24          2HG       LYS  24  15.975   6.497   3.548
  511   1HD   LYS  24          1HD       LYS  24  15.644   5.578   1.322
  512   2HD   LYS  24          2HD       LYS  24  13.949   6.065   1.328
  513   1HE   LYS  24          1HE       LYS  24  16.174   8.079   1.670
  514   2HE   LYS  24          2HE       LYS  24  15.594   7.595   0.076
  515   1HZ   LYS  24          1HZ       LYS  24  13.559   8.302   2.026
  516   2HZ   LYS  24          2HZ       LYS  24  13.639   8.643   0.363
  517   3HZ   LYS  24          3HZ       LYS  24  14.526   9.579   1.470
  518    H    PHE  25           H        PHE  25  15.361   3.641   6.374
  519    HA   PHE  25           HA       PHE  25  17.902   5.129   6.910
  520   1HB   PHE  25          1HB       PHE  25  15.742   4.245   8.848
  521   2HB   PHE  25          2HB       PHE  25  17.093   5.323   9.196
  522    HD1  PHE  25           HD1      PHE  25  17.266   7.523   7.915
  523    HD2  PHE  25           HD2      PHE  25  13.731   5.081   7.906
  524    HE1  PHE  25           HE1      PHE  25  15.928   9.461   7.137
  525    HE2  PHE  25           HE2      PHE  25  12.393   7.019   7.129
  526    HZ   PHE  25           HZ       PHE  25  13.492   9.209   6.745
  527    H    SER  26           H        SER  26  19.679   4.001   7.536
  528    HA   SER  26           HA       SER  26  19.532   1.094   7.792
  529   1HB   SER  26          1HB       SER  26  21.907   2.880   8.376
  530   2HB   SER  26          2HB       SER  26  21.931   1.168   7.963
  531    HG   SER  26           HG       SER  26  20.662   2.166   6.008
  532    H    ARG  27           H        ARG  27  20.682   0.070   9.764
  533    HA   ARG  27           HA       ARG  27  20.624  -0.347  12.069
  534   1HB   ARG  27          1HB       ARG  27  22.158   1.664  11.991
  535   2HB   ARG  27          2HB       ARG  27  20.754   2.670  12.340
  536   1HG   ARG  27          1HG       ARG  27  20.354   1.373  14.412
  537   2HG   ARG  27          2HG       ARG  27  21.792   0.411  14.074
  538   1HD   ARG  27          1HD       ARG  27  23.186   2.437  14.164
  539   2HD   ARG  27          2HD       ARG  27  21.753   3.418  14.472
  540    HE   ARG  27           HE       ARG  27  21.702   1.534  16.499
  541   1HH1  ARG  27          1HH1      ARG  27  23.992   3.777  15.228
  542   2HH1  ARG  27          2HH1      ARG  27  24.782   4.035  16.749
  543   1HH2  ARG  27          1HH2      ARG  27  22.719   1.864  18.493
  544   2HH2  ARG  27          2HH2      ARG  27  24.060   2.954  18.596
  545    H    SER  28           H        SER  28  18.970   2.801  12.231
  546    HA   SER  28           HA       SER  28  16.883   3.314  13.192
  547   1HB   SER  28          1HB       SER  28  15.001   1.973  12.172
  548   2HB   SER  28          2HB       SER  28  16.109   2.677  10.997
  549    HG   SER  28           HG       SER  28  16.444   0.717  10.346
  550    H    ALA  29           H        ALA  29  18.589   1.474  14.732
  551    HA   ALA  29           HA       ALA  29  16.978  -0.652  15.828
  552   1HB   ALA  29          1HB       ALA  29  19.450  -0.590  16.026
  553   2HB   ALA  29          2HB       ALA  29  18.676  -0.730  17.605
  554   3HB   ALA  29          3HB       ALA  29  19.320   0.824  17.073
  555    H    ASP  30           H        ASP  30  17.440   2.755  16.657
  556    HA   ASP  30           HA       ASP  30  16.373   4.094  18.269
  557   1HB   ASP  30          1HB       ASP  30  14.182   2.157  17.479
  558   2HB   ASP  30          2HB       ASP  30  13.903   3.562  18.510
  Start of MODEL   12
    1   1H    ASP  -3          1H        ASP  -3 -20.370   8.979  -8.673
    2    HA   ASP  -3           HA       ASP  -3 -22.569  10.323  -8.728
    3   1HB   ASP  -3          1HB       ASP  -3 -22.324   9.164 -11.518
    4   2HB   ASP  -3          2HB       ASP  -3 -23.855   9.675 -10.808
    5    H    SER  -2           H        SER  -2 -21.007   7.317  -9.394
    6    HA   SER  -2           HA       SER  -2 -22.983   5.913  -7.719
    7   1HB   SER  -2          1HB       SER  -2 -23.998   5.613  -9.902
    8   2HB   SER  -2          2HB       SER  -2 -22.452   5.148 -10.606
    9    HG   SER  -2           HG       SER  -2 -23.221   3.222 -10.124
   10    H    LYS  -1           H        LYS  -1 -22.127   3.944  -6.865
   11    HA   LYS  -1           HA       LYS  -1 -20.377   2.645  -6.000
   12   1HB   LYS  -1          1HB       LYS  -1 -19.405   2.947  -8.858
   13   2HB   LYS  -1          2HB       LYS  -1 -18.810   1.754  -7.703
   14   1HG   LYS  -1          1HG       LYS  -1 -21.099   0.828  -7.494
   15   2HG   LYS  -1          2HG       LYS  -1 -21.670   1.998  -8.683
   16   1HD   LYS  -1          1HD       LYS  -1 -20.005   1.056 -10.313
   17   2HD   LYS  -1          2HD       LYS  -1 -19.631  -0.200  -9.132
   18   1HE   LYS  -1          1HE       LYS  -1 -21.285  -1.050 -10.717
   19   2HE   LYS  -1          2HE       LYS  -1 -22.036  -0.865  -9.131
   20   1HZ   LYS  -1          1HZ       LYS  -1 -23.474   0.043 -10.799
   21   2HZ   LYS  -1          2HZ       LYS  -1 -22.230   1.021 -11.416
   22   3HZ   LYS  -1          3HZ       LYS  -1 -22.860   1.320  -9.866
   23    H    LEU   1           H        LEU   1 -20.076   5.279  -5.286
   24    HA   LEU   1           HA       LEU   1 -17.626   6.519  -6.057
   25   1HB   LEU   1          1HB       LEU   1 -19.508   7.578  -4.725
   26   2HB   LEU   1          2HB       LEU   1 -18.933   6.674  -3.328
   27    HG   LEU   1           HG       LEU   1 -16.608   7.765  -3.891
   28   1HD1  LEU   1          1HD1      LEU   1 -17.136   8.785  -6.014
   29   2HD1  LEU   1          2HD1      LEU   1 -16.935  10.084  -4.842
   30   3HD1  LEU   1          3HD1      LEU   1 -18.552   9.590  -5.338
   31   1HD2  LEU   1          1HD2      LEU   1 -18.927   9.350  -2.745
   32   2HD2  LEU   1          2HD2      LEU   1 -17.225   9.759  -2.525
   33   3HD2  LEU   1          3HD2      LEU   1 -17.866   8.259  -1.855
   34    H    CYS   2           H        CYS   2 -18.367   4.155  -3.512
   35    HA   CYS   2           HA       CYS   2 -15.904   4.129  -2.154
   36   1HB   CYS   2          1HB       CYS   2 -17.765   2.807  -1.344
   37   2HB   CYS   2          2HB       CYS   2 -17.777   1.840  -2.818
   38    H    TYR   3           H        TYR   3 -16.774   2.717  -5.267
   39    HA   TYR   3           HA       TYR   3 -14.484   1.055  -5.615
   40   1HB   TYR   3          1HB       TYR   3 -16.572   1.125  -7.071
   41   2HB   TYR   3          2HB       TYR   3 -15.901   2.574  -7.818
   42    HD1  TYR   3           HD1      TYR   3 -15.198  -1.020  -7.111
   43    HD2  TYR   3           HD2      TYR   3 -14.218   2.419  -9.492
   44    HE1  TYR   3           HE1      TYR   3 -13.788  -2.436  -8.579
   45    HE2  TYR   3           HE2      TYR   3 -12.808   1.003 -10.957
   46    HH   TYR   3           HH       TYR   3 -11.515  -1.291 -10.602
   47    H    LEU   4           H        LEU   4 -14.941   4.517  -5.933
   48    HA   LEU   4           HA       LEU   4 -12.594   5.088  -7.470
   49   1HB   LEU   4          1HB       LEU   4 -14.484   6.699  -6.976
   50   2HB   LEU   4          2HB       LEU   4 -13.852   6.840  -5.338
   51    HG   LEU   4           HG       LEU   4 -11.589   7.438  -6.502
   52   1HD1  LEU   4          1HD1      LEU   4 -13.583   7.863  -8.745
   53   2HD1  LEU   4          2HD1      LEU   4 -12.094   6.919  -8.791
   54   3HD1  LEU   4          3HD1      LEU   4 -12.021   8.675  -8.681
   55   1HD2  LEU   4          1HD2      LEU   4 -14.013   9.245  -6.417
   56   2HD2  LEU   4          2HD2      LEU   4 -12.394   9.847  -6.774
   57   3HD2  LEU   4          3HD2      LEU   4 -12.732   9.096  -5.214
   58    H    LEU   5           H        LEU   5 -13.137   4.715  -3.982
   59    HA   LEU   5           HA       LEU   5 -10.482   5.509  -3.202
   60   1HB   LEU   5          1HB       LEU   5 -12.686   3.925  -1.882
   61   2HB   LEU   5          2HB       LEU   5 -11.104   4.052  -1.115
   62    HG   LEU   5           HG       LEU   5 -11.268   6.523  -1.214
   63   1HD1  LEU   5          1HD1      LEU   5 -13.942   5.870  -2.464
   64   2HD1  LEU   5          2HD1      LEU   5 -12.663   6.899  -3.110
   65   3HD1  LEU   5          3HD1      LEU   5 -13.607   7.433  -1.720
   66   1HD2  LEU   5          1HD2      LEU   5 -13.519   4.995   0.110
   67   2HD2  LEU   5          2HD2      LEU   5 -13.239   6.711   0.404
   68   3HD2  LEU   5          3HD2      LEU   5 -12.002   5.528   0.835
   69    H    ASP   6           H        ASP   6 -11.953   2.378  -4.007
   70    HA   ASP   6           HA       ASP   6  -9.709   0.751  -3.342
   71   1HB   ASP   6          1HB       ASP   6 -11.939   0.416  -5.359
   72   2HB   ASP   6          2HB       ASP   6 -10.718  -0.827  -5.083
   73    H    GLY   7           H        GLY   7 -10.561   2.473  -6.340
   74   1HA   GLY   7          1HA       GLY   7  -8.423   1.439  -7.930
   75   2HA   GLY   7          2HA       GLY   7  -9.258   2.964  -8.227
   76    H    ILE   8           H        ILE   8  -8.640   4.465  -6.026
   77    HA   ILE   8           HA       ILE   8  -5.925   5.254  -6.568
   78    HB   ILE   8           HB       ILE   8  -7.756   5.998  -4.269
   79   1HG1  ILE   8          1HG1      ILE   8  -7.095   7.510  -6.815
   80   2HG1  ILE   8          2HG1      ILE   8  -8.541   6.519  -6.618
   81   1HG2  ILE   8          1HG2      ILE   8  -5.114   7.111  -5.239
   82   2HG2  ILE   8          2HG2      ILE   8  -5.512   6.530  -3.623
   83   3HG2  ILE   8          3HG2      ILE   8  -6.213   8.035  -4.216
   84   1HD1  ILE   8          1HD1      ILE   8  -7.780   9.011  -5.081
   85   2HD1  ILE   8          2HD1      ILE   8  -9.058   7.918  -4.546
   86   3HD1  ILE   8          3HD1      ILE   8  -9.203   8.755  -6.091
   87    H    LEU   9           H        LEU   9  -7.405   3.599  -3.757
   88    HA   LEU   9           HA       LEU   9  -4.953   3.332  -2.303
   89   1HB   LEU   9          1HB       LEU   9  -7.450   1.614  -2.251
   90   2HB   LEU   9          2HB       LEU   9  -6.157   1.536  -1.058
   91    HG   LEU   9           HG       LEU   9  -7.630   4.106  -1.686
   92   1HD1  LEU   9          1HD1      LEU   9  -8.243   2.080   0.487
   93   2HD1  LEU   9          2HD1      LEU   9  -9.251   2.404  -0.923
   94   3HD1  LEU   9          3HD1      LEU   9  -9.017   3.653   0.300
   95   1HD2  LEU   9          1HD2      LEU   9  -5.770   3.163   0.509
   96   2HD2  LEU   9          2HD2      LEU   9  -6.856   4.526   0.761
   97   3HD2  LEU   9          3HD2      LEU   9  -5.634   4.599  -0.503
   98    H    PHE  10           H        PHE  10  -6.564   1.183  -4.646
   99    HA   PHE  10           HA       PHE  10  -4.729  -0.992  -4.389
  100   1HB   PHE  10          1HB       PHE  10  -6.919  -1.141  -5.568
  101   2HB   PHE  10          2HB       PHE  10  -6.264  -0.138  -6.863
  102    HD1  PHE  10           HD1      PHE  10  -4.909  -1.081  -8.575
  103    HD2  PHE  10           HD2      PHE  10  -5.775  -3.348  -5.032
  104    HE1  PHE  10           HE1      PHE  10  -3.903  -3.094  -9.618
  105    HE2  PHE  10           HE2      PHE  10  -4.770  -5.361  -6.074
  106    HZ   PHE  10           HZ       PHE  10  -3.834  -5.235  -8.367
  107    H    ILE  11           H        ILE  11  -4.815   1.609  -6.863
  108    HA   ILE  11           HA       ILE  11  -2.415   0.936  -8.177
  109    HB   ILE  11           HB       ILE  11  -3.615   3.672  -7.644
  110   1HG1  ILE  11          1HG1      ILE  11  -3.675   1.977 -10.154
  111   2HG1  ILE  11          2HG1      ILE  11  -4.954   1.934  -8.941
  112   1HG2  ILE  11          1HG2      ILE  11  -1.347   2.771  -9.429
  113   2HG2  ILE  11          2HG2      ILE  11  -1.337   4.062  -8.227
  114   3HG2  ILE  11          3HG2      ILE  11  -2.243   4.261  -9.729
  115   1HD1  ILE  11          1HD1      ILE  11  -5.493   4.236  -9.290
  116   2HD1  ILE  11          2HD1      ILE  11  -5.332   3.532 -10.899
  117   3HD1  ILE  11          3HD1      ILE  11  -4.025   4.509 -10.227
  118    H    TYR  12           H        TYR  12  -2.906   2.891  -5.249
  119    HA   TYR  12           HA       TYR  12  -0.223   3.754  -4.901
  120   1HB   TYR  12          1HB       TYR  12  -2.067   4.638  -3.544
  121   2HB   TYR  12          2HB       TYR  12  -2.292   3.057  -2.794
  122    HD1  TYR  12           HD1      TYR  12  -0.019   5.964  -3.096
  123    HD2  TYR  12           HD2      TYR  12  -0.780   2.236  -1.101
  124    HE1  TYR  12           HE1      TYR  12   1.722   6.506  -1.416
  125    HE2  TYR  12           HE2      TYR  12   0.963   2.778   0.578
  126    HH   TYR  12           HH       TYR  12   2.784   4.154   0.954
  127    H    GLY  13           H        GLY  13  -1.829   0.743  -3.872
  128   1HA   GLY  13          1HA       GLY  13   0.385  -0.301  -2.392
  129   2HA   GLY  13          2HA       GLY  13  -0.904  -1.272  -3.101
  130    H    VAL  14           H        VAL  14  -0.479  -0.515  -5.828
  131    HA   VAL  14           HA       VAL  14   1.614  -2.373  -6.516
  132    HB   VAL  14           HB       VAL  14   0.100  -0.364  -8.208
  133   1HG1  VAL  14          1HG1      VAL  14   2.109  -0.896  -9.393
  134   2HG1  VAL  14          2HG1      VAL  14   0.855  -1.929 -10.080
  135   3HG1  VAL  14          3HG1      VAL  14   2.015  -2.595  -8.929
  136   1HG2  VAL  14          1HG2      VAL  14  -1.296  -2.113  -7.152
  137   2HG2  VAL  14          2HG2      VAL  14  -0.230  -3.356  -7.805
  138   3HG2  VAL  14          3HG2      VAL  14  -1.190  -2.356  -8.895
  139    H    ILE  15           H        ILE  15   1.397   1.189  -6.696
  140    HA   ILE  15           HA       ILE  15   4.040   1.505  -7.801
  141    HB   ILE  15           HB       ILE  15   2.304   3.461  -6.266
  142   1HG1  ILE  15          1HG1      ILE  15   2.802   3.199  -9.247
  143   2HG1  ILE  15          2HG1      ILE  15   1.399   2.510  -8.431
  144   1HG2  ILE  15          1HG2      ILE  15   3.778   5.147  -7.479
  145   2HG2  ILE  15          2HG2      ILE  15   4.856   3.805  -7.862
  146   3HG2  ILE  15          3HG2      ILE  15   4.570   4.255  -6.181
  147   1HD1  ILE  15          1HD1      ILE  15   0.755   4.666  -9.322
  148   2HD1  ILE  15          2HD1      ILE  15   2.158   5.438  -8.583
  149   3HD1  ILE  15          3HD1      ILE  15   0.861   4.812  -7.567
  150    H    LEU  16           H        LEU  16   2.792   1.404  -4.482
  151    HA   LEU  16           HA       LEU  16   5.321   2.228  -3.317
  152   1HB   LEU  16          1HB       LEU  16   2.825   2.209  -2.337
  153   2HB   LEU  16          2HB       LEU  16   3.315   0.626  -1.753
  154    HG   LEU  16           HG       LEU  16   3.806   2.210  -0.011
  155   1HD1  LEU  16          1HD1      LEU  16   5.556   0.440  -0.691
  156   2HD1  LEU  16          2HD1      LEU  16   6.083   1.742   0.374
  157   3HD1  LEU  16          3HD1      LEU  16   6.479   1.794  -1.343
  158   1HD2  LEU  16          1HD2      LEU  16   4.763   4.300  -0.289
  159   2HD2  LEU  16          2HD2      LEU  16   3.973   4.150  -1.855
  160   3HD2  LEU  16          3HD2      LEU  16   5.699   3.822  -1.702
  161    H    THR  17           H        THR  17   3.727  -0.885  -3.932
  162    HA   THR  17           HA       THR  17   5.729  -2.486  -2.627
  163    HB   THR  17           HB       THR  17   3.950  -3.292  -4.945
  164    HG1  THR  17           HG1      THR  17   2.846  -2.324  -3.136
  165   1HG2  THR  17          1HG2      THR  17   4.150  -5.531  -3.925
  166   2HG2  THR  17          2HG2      THR  17   5.216  -4.869  -2.686
  167   3HG2  THR  17          3HG2      THR  17   5.732  -4.893  -4.373
  168    H    ALA  18           H        ALA  18   5.355  -1.317  -5.959
  169    HA   ALA  18           HA       ALA  18   7.470  -2.798  -7.143
  170   1HB   ALA  18          1HB       ALA  18   6.329  -0.064  -7.746
  171   2HB   ALA  18          2HB       ALA  18   6.016  -1.581  -8.591
  172   3HB   ALA  18          3HB       ALA  18   7.590  -0.799  -8.735
  173    H    LEU  19           H        LEU  19   7.552   0.459  -5.663
  174    HA   LEU  19           HA       LEU  19  10.369   0.845  -5.997
  175   1HB   LEU  19          1HB       LEU  19   8.556   1.963  -3.837
  176   2HB   LEU  19          2HB       LEU  19  10.133   2.602  -4.293
  177    HG   LEU  19           HG       LEU  19   7.841   2.338  -6.257
  178   1HD1  LEU  19          1HD1      LEU  19   7.502   4.782  -5.896
  179   2HD1  LEU  19          2HD1      LEU  19   8.643   4.714  -4.553
  180   3HD1  LEU  19          3HD1      LEU  19   7.121   3.827  -4.463
  181   1HD2  LEU  19          1HD2      LEU  19  10.524   3.744  -6.255
  182   2HD2  LEU  19          2HD2      LEU  19   9.233   4.226  -7.352
  183   3HD2  LEU  19          3HD2      LEU  19   9.893   2.596  -7.433
  184    H    PHE  20           H        PHE  20   8.501  -0.812  -3.502
  185    HA   PHE  20           HA       PHE  20  10.662  -1.051  -1.620
  186   1HB   PHE  20          1HB       PHE  20   8.371  -1.451  -0.912
  187   2HB   PHE  20          2HB       PHE  20   8.212  -2.783  -2.057
  188    HD1  PHE  20           HD1      PHE  20   9.347  -4.916  -1.682
  189    HD2  PHE  20           HD2      PHE  20   9.696  -1.690   1.129
  190    HE1  PHE  20           HE1      PHE  20  10.276  -6.485  -0.001
  191    HE2  PHE  20           HE2      PHE  20  10.626  -3.258   2.813
  192    HZ   PHE  20           HZ       PHE  20  10.915  -5.655   2.247
  193    H    LEU  21           H        LEU  21   9.413  -3.345  -4.079
  194    HA   LEU  21           HA       LEU  21  11.406  -5.338  -3.629
  195   1HB   LEU  21          1HB       LEU  21   9.990  -4.674  -6.228
  196   2HB   LEU  21          2HB       LEU  21  10.793  -6.194  -5.847
  197    HG   LEU  21           HG       LEU  21   8.527  -5.097  -4.165
  198   1HD1  LEU  21          1HD1      LEU  21   7.552  -5.360  -6.328
  199   2HD1  LEU  21          2HD1      LEU  21   7.139  -6.826  -5.441
  200   3HD1  LEU  21          3HD1      LEU  21   8.443  -6.852  -6.628
  201   1HD2  LEU  21          1HD2      LEU  21   9.880  -7.796  -4.461
  202   2HD2  LEU  21          2HD2      LEU  21   8.315  -7.608  -3.675
  203   3HD2  LEU  21          3HD2      LEU  21   9.734  -6.810  -3.006
  204    H    ARG  22           H        ARG  22  11.325  -2.561  -5.858
  205    HA   ARG  22           HA       ARG  22  13.736  -3.068  -7.235
  206   1HB   ARG  22          1HB       ARG  22  12.085  -1.208  -7.713
  207   2HB   ARG  22          2HB       ARG  22  12.782  -0.330  -6.351
  208   1HG   ARG  22          1HG       ARG  22  14.997  -0.404  -7.419
  209   2HG   ARG  22          2HG       ARG  22  14.318  -1.303  -8.776
  210   1HD   ARG  22          1HD       ARG  22  12.754   0.615  -9.188
  211   2HD   ARG  22          2HD       ARG  22  13.603   1.520  -7.934
  212    HE   ARG  22           HE       ARG  22  15.620   0.712  -9.656
  213   1HH1  ARG  22          1HH1      ARG  22  12.608   2.371  -9.923
  214   2HH1  ARG  22          2HH1      ARG  22  13.106   3.329 -11.277
  215   1HH2  ARG  22          1HH2      ARG  22  16.287   1.954 -11.420
  216   2HH2  ARG  22          2HH2      ARG  22  15.190   3.094 -12.125
  217    H    VAL  23           H        VAL  23  13.211  -1.505  -4.081
  218    HA   VAL  23           HA       VAL  23  16.038  -0.926  -3.703
  219    HB   VAL  23           HB       VAL  23  13.745  -1.035  -1.716
  220   1HG1  VAL  23          1HG1      VAL  23  15.320   0.419  -0.359
  221   2HG1  VAL  23          2HG1      VAL  23  16.593  -0.030  -1.495
  222   3HG1  VAL  23          3HG1      VAL  23  15.813  -1.267  -0.511
  223   1HG2  VAL  23          1HG2      VAL  23  13.675   0.657  -3.649
  224   2HG2  VAL  23          2HG2      VAL  23  15.093   1.398  -2.907
  225   3HG2  VAL  23          3HG2      VAL  23  13.570   1.324  -2.019
  226    H    LYS  24           H        LYS  24  13.838  -3.541  -2.812
  227    HA   LYS  24           HA       LYS  24  15.454  -4.891  -0.925
  228   1HB   LYS  24          1HB       LYS  24  13.089  -5.476  -1.495
  229   2HB   LYS  24          2HB       LYS  24  13.662  -6.163  -3.014
  230   1HG   LYS  24          1HG       LYS  24  15.095  -7.738  -1.758
  231   2HG   LYS  24          2HG       LYS  24  14.502  -7.061  -0.241
  232   1HD   LYS  24          1HD       LYS  24  12.176  -7.681  -0.932
  233   2HD   LYS  24          2HD       LYS  24  12.852  -8.480  -2.353
  234   1HE   LYS  24          1HE       LYS  24  12.583 -10.204  -0.729
  235   2HE   LYS  24          2HE       LYS  24  14.303  -9.822  -0.726
  236   1HZ   LYS  24          1HZ       LYS  24  13.270  -9.980   1.516
  237   2HZ   LYS  24          2HZ       LYS  24  12.349  -8.603   1.141
  238   3HZ   LYS  24          3HZ       LYS  24  14.043  -8.502   1.210
  239    H    PHE  25           H        PHE  25  15.450  -5.114  -4.484
  240    HA   PHE  25           HA       PHE  25  17.437  -7.179  -4.638
  241   1HB   PHE  25          1HB       PHE  25  16.629  -5.017  -6.601
  242   2HB   PHE  25          2HB       PHE  25  17.767  -6.307  -6.986
  243    HD1  PHE  25           HD1      PHE  25  14.345  -5.383  -7.003
  244    HD2  PHE  25           HD2      PHE  25  16.942  -8.753  -6.405
  245    HE1  PHE  25           HE1      PHE  25  12.462  -6.921  -7.487
  246    HE2  PHE  25           HE2      PHE  25  15.057 -10.290  -6.891
  247    HZ   PHE  25           HZ       PHE  25  12.818  -9.374  -7.431
  248    H    SER  26           H        SER  26  17.619  -3.706  -4.206
  249    HA   SER  26           HA       SER  26  20.427  -3.469  -4.865
  250   1HB   SER  26          1HB       SER  26  18.637  -1.600  -4.723
  251   2HB   SER  26          2HB       SER  26  18.944  -1.624  -2.989
  252    HG   SER  26           HG       SER  26  20.904  -0.841  -3.317
  253    H    ARG  27           H        ARG  27  18.878  -4.994  -2.318
  254    HA   ARG  27           HA       ARG  27  19.601  -5.713  -0.200
  255   1HB   ARG  27          1HB       ARG  27  22.288  -5.374  -1.573
  256   2HB   ARG  27          2HB       ARG  27  22.013  -6.283  -0.086
  257   1HG   ARG  27          1HG       ARG  27  20.469  -7.784  -1.259
  258   2HG   ARG  27          2HG       ARG  27  20.684  -6.865  -2.748
  259   1HD   ARG  27          1HD       ARG  27  23.305  -7.463  -2.053
  260   2HD   ARG  27          2HD       ARG  27  22.450  -8.914  -1.542
  261    HE   ARG  27           HE       ARG  27  23.144  -8.349  -4.194
  262   1HH1  ARG  27          1HH1      ARG  27  20.241  -9.001  -2.434
  263   2HH1  ARG  27          2HH1      ARG  27  19.376  -9.551  -3.825
  264   1HH2  ARG  27          1HH2      ARG  27  22.028  -9.081  -5.998
  265   2HH2  ARG  27          2HH2      ARG  27  20.384  -9.603  -5.838
  266    H    SER  28           H        SER  28  22.017  -4.960   1.191
  267    HA   SER  28           HA       SER  28  21.900  -2.002   1.394
  268   1HB   SER  28          1HB       SER  28  20.121  -3.003   2.915
  269   2HB   SER  28          2HB       SER  28  21.433  -3.752   3.820
  270    HG   SER  28           HG       SER  28  21.612  -1.902   4.784
  271    H    ALA  29           H        ALA  29  23.841  -1.154   2.099
  272    HA   ALA  29           HA       ALA  29  26.144  -2.900   2.172
  273   1HB   ALA  29          1HB       ALA  29  26.352  -0.613   1.340
  274   2HB   ALA  29          2HB       ALA  29  27.382  -0.810   2.759
  275   3HB   ALA  29          3HB       ALA  29  25.837   0.029   2.899
  276    H    ASP  30           H        ASP  30  24.226  -1.224   4.639
  277    HA   ASP  30           HA       ASP  30  24.307  -1.363   6.985
  278   1HB   ASP  30          1HB       ASP  30  25.168  -4.174   6.235
  279   2HB   ASP  30          2HB       ASP  30  24.634  -3.678   7.842
  280   1H    ASP  -3          1H        ASP  -3 -25.402  -0.136  -2.635
  281    HA   ASP  -3           HA       ASP  -3 -25.202   1.278  -0.712
  282   1HB   ASP  -3          1HB       ASP  -3 -27.302  -0.898  -0.479
  283   2HB   ASP  -3          2HB       ASP  -3 -27.346   0.620   0.417
  284    H    SER  -2           H        SER  -2 -24.847  -2.164  -0.029
  285    HA   SER  -2           HA       SER  -2 -24.624  -1.987   2.810
  286   1HB   SER  -2          1HB       SER  -2 -23.286  -3.923   0.896
  287   2HB   SER  -2          2HB       SER  -2 -23.410  -4.141   2.640
  288    HG   SER  -2           HG       SER  -2 -25.772  -3.556   1.327
  289    H    LYS  -1           H        LYS  -1 -22.687  -1.943   4.125
  290    HA   LYS  -1           HA       LYS  -1 -20.621  -0.160   3.027
  291   1HB   LYS  -1          1HB       LYS  -1 -21.009  -1.372   5.782
  292   2HB   LYS  -1          2HB       LYS  -1 -19.730  -0.229   5.368
  293   1HG   LYS  -1          1HG       LYS  -1 -21.479   1.403   4.651
  294   2HG   LYS  -1          2HG       LYS  -1 -22.716   0.273   5.202
  295   1HD   LYS  -1          1HD       LYS  -1 -21.749   0.340   7.481
  296   2HD   LYS  -1          2HD       LYS  -1 -20.549   1.507   6.927
  297   1HE   LYS  -1          1HE       LYS  -1 -22.536   2.946   6.167
  298   2HE   LYS  -1          2HE       LYS  -1 -23.542   1.868   7.135
  299   1HZ   LYS  -1          1HZ       LYS  -1 -23.019   3.225   8.808
  300   2HZ   LYS  -1          2HZ       LYS  -1 -21.712   3.924   7.975
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.506   2.457   8.808
  302    H    LEU   1           H        LEU   1 -21.033  -3.308   2.582
  303    HA   LEU   1           HA       LEU   1 -18.715  -4.616   3.526
  304   1HB   LEU   1          1HB       LEU   1 -20.587  -5.781   2.399
  305   2HB   LEU   1          2HB       LEU   1 -20.136  -5.022   0.875
  306    HG   LEU   1           HG       LEU   1 -17.918  -6.134   0.988
  307   1HD1  LEU   1          1HD1      LEU   1 -17.906  -8.121   2.730
  308   2HD1  LEU   1          2HD1      LEU   1 -19.035  -7.097   3.614
  309   3HD1  LEU   1          3HD1      LEU   1 -17.415  -6.508   3.240
  310   1HD2  LEU   1          1HD2      LEU   1 -18.763  -8.449   0.599
  311   2HD2  LEU   1          2HD2      LEU   1 -19.736  -7.229  -0.224
  312   3HD2  LEU   1          3HD2      LEU   1 -20.321  -7.965   1.268
  313    H    CYS   2           H        CYS   2 -19.174  -2.517   0.709
  314    HA   CYS   2           HA       CYS   2 -16.701  -2.960  -0.586
  315   1HB   CYS   2          1HB       CYS   2 -18.593  -1.537  -1.449
  316   2HB   CYS   2          2HB       CYS   2 -18.091  -0.282  -0.315
  317    H    TYR   3           H        TYR   3 -17.492  -0.879   2.178
  318    HA   TYR   3           HA       TYR   3 -15.058   0.529   2.393
  319   1HB   TYR   3          1HB       TYR   3 -17.139   0.842   3.816
  320   2HB   TYR   3          2HB       TYR   3 -16.621  -0.565   4.747
  321    HD1  TYR   3           HD1      TYR   3 -14.935  -0.378   6.411
  322    HD2  TYR   3           HD2      TYR   3 -15.562   2.830   3.627
  323    HE1  TYR   3           HE1      TYR   3 -13.396   1.061   7.721
  324    HE2  TYR   3           HE2      TYR   3 -14.024   4.268   4.936
  325    HH   TYR   3           HH       TYR   3 -12.839   3.316   8.068
  326    H    LEU   4           H        LEU   4 -15.783  -2.824   3.045
  327    HA   LEU   4           HA       LEU   4 -13.549  -3.418   4.732
  328   1HB   LEU   4          1HB       LEU   4 -15.537  -4.929   4.274
  329   2HB   LEU   4          2HB       LEU   4 -14.822  -5.272   2.701
  330    HG   LEU   4           HG       LEU   4 -12.675  -5.888   4.081
  331   1HD1  LEU   4          1HD1      LEU   4 -13.319  -6.883   6.316
  332   2HD1  LEU   4          2HD1      LEU   4 -14.857  -6.037   6.185
  333   3HD1  LEU   4          3HD1      LEU   4 -13.351  -5.124   6.270
  334   1HD2  LEU   4          1HD2      LEU   4 -15.201  -7.548   3.932
  335   2HD2  LEU   4          2HD2      LEU   4 -13.669  -8.215   4.496
  336   3HD2  LEU   4          3HD2      LEU   4 -13.807  -7.591   2.852
  337    H    LEU   5           H        LEU   5 -13.928  -3.315   1.205
  338    HA   LEU   5           HA       LEU   5 -11.366  -4.398   0.548
  339   1HB   LEU   5          1HB       LEU   5 -13.306  -2.578  -0.877
  340   2HB   LEU   5          2HB       LEU   5 -11.722  -2.899  -1.581
  341    HG   LEU   5           HG       LEU   5 -12.179  -5.337  -1.459
  342   1HD1  LEU   5          1HD1      LEU   5 -14.831  -4.359  -0.374
  343   2HD1  LEU   5          2HD1      LEU   5 -13.703  -5.482   0.386
  344   3HD1  LEU   5          3HD1      LEU   5 -14.610  -5.975  -1.044
  345   1HD2  LEU   5          1HD2      LEU   5 -12.782  -3.933  -3.473
  346   2HD2  LEU   5          2HD2      LEU   5 -14.427  -3.845  -2.843
  347   3HD2  LEU   5          3HD2      LEU   5 -13.742  -5.403  -3.306
  348    H    ASP   6           H        ASP   6 -12.439  -1.064   1.178
  349    HA   ASP   6           HA       ASP   6  -9.919   0.186   0.637
  350   1HB   ASP   6          1HB       ASP   6 -12.228   0.986   2.431
  351   2HB   ASP   6          2HB       ASP   6 -10.836   2.025   2.120
  352    H    GLY   7           H        GLY   7 -11.292  -1.266   3.569
  353   1HA   GLY   7          1HA       GLY   7  -9.285  -0.413   5.399
  354   2HA   GLY   7          2HA       GLY   7 -10.264  -1.868   5.590
  355    H    ILE   8           H        ILE   8  -9.500  -3.465   3.529
  356    HA   ILE   8           HA       ILE   8  -6.958  -4.467   4.392
  357    HB   ILE   8           HB       ILE   8  -8.395  -5.022   1.779
  358   1HG1  ILE   8          1HG1      ILE   8  -8.575  -6.477   4.438
  359   2HG1  ILE   8          2HG1      ILE   8  -9.801  -5.366   3.828
  360   1HG2  ILE   8          1HG2      ILE   8  -7.170  -7.185   1.933
  361   2HG2  ILE   8          2HG2      ILE   8  -6.339  -6.589   3.369
  362   3HG2  ILE   8          3HG2      ILE   8  -6.074  -5.810   1.810
  363   1HD1  ILE   8          1HD1      ILE   8  -8.961  -8.028   2.673
  364   2HD1  ILE   8          2HD1      ILE   8  -9.865  -6.845   1.728
  365   3HD1  ILE   8          3HD1      ILE   8 -10.569  -7.524   3.195
  366    H    LEU   9           H        LEU   9  -7.858  -2.865   1.311
  367    HA   LEU   9           HA       LEU   9  -5.235  -2.688   0.262
  368   1HB   LEU   9          1HB       LEU   9  -7.505  -0.703  -0.072
  369   2HB   LEU   9          2HB       LEU   9  -6.105  -0.849  -1.131
  370    HG   LEU   9           HG       LEU   9  -7.949  -3.188  -0.600
  371   1HD1  LEU   9          1HD1      LEU   9  -9.294  -1.316  -1.502
  372   2HD1  LEU   9          2HD1      LEU   9  -9.128  -2.618  -2.681
  373   3HD1  LEU   9          3HD1      LEU   9  -8.157  -1.154  -2.841
  374   1HD2  LEU   9          1HD2      LEU   9  -7.065  -3.806  -2.921
  375   2HD2  LEU   9          2HD2      LEU   9  -5.886  -3.865  -1.616
  376   3HD2  LEU   9          3HD2      LEU   9  -5.900  -2.498  -2.727
  377    H    PHE  10           H        PHE  10  -6.987  -0.464   2.423
  378    HA   PHE  10           HA       PHE  10  -4.978   1.565   2.491
  379   1HB   PHE  10          1HB       PHE  10  -7.251   1.938   3.352
  380   2HB   PHE  10          2HB       PHE  10  -6.966   0.764   4.638
  381    HD1  PHE  10           HD1      PHE  10  -6.121   1.514   6.698
  382    HD2  PHE  10           HD2      PHE  10  -5.493   3.884   3.171
  383    HE1  PHE  10           HE1      PHE  10  -5.087   3.295   8.078
  384    HE2  PHE  10           HE2      PHE  10  -4.458   5.665   4.552
  385    HZ   PHE  10           HZ       PHE  10  -4.256   5.372   7.006
  386    H    ILE  11           H        ILE  11  -5.630  -1.008   4.911
  387    HA   ILE  11           HA       ILE  11  -3.351  -0.560   6.506
  388    HB   ILE  11           HB       ILE  11  -4.737  -3.178   5.850
  389   1HG1  ILE  11          1HG1      ILE  11  -4.973  -1.402   8.294
  390   2HG1  ILE  11          2HG1      ILE  11  -6.079  -1.308   6.923
  391   1HG2  ILE  11          1HG2      ILE  11  -2.581  -3.729   6.739
  392   2HG2  ILE  11          2HG2      ILE  11  -3.716  -3.867   8.081
  393   3HG2  ILE  11          3HG2      ILE  11  -2.678  -2.447   7.946
  394   1HD1  ILE  11          1HD1      ILE  11  -6.968  -2.766   8.725
  395   2HD1  ILE  11          2HD1      ILE  11  -5.552  -3.803   8.563
  396   3HD1  ILE  11          3HD1      ILE  11  -6.697  -3.662   7.230
  397    H    TYR  12           H        TYR  12  -3.689  -2.526   3.565
  398    HA   TYR  12           HA       TYR  12  -1.104  -3.674   3.534
  399   1HB   TYR  12          1HB       TYR  12  -2.813  -4.345   1.924
  400   2HB   TYR  12          2HB       TYR  12  -2.819  -2.730   1.215
  401    HD1  TYR  12           HD1      TYR  12  -0.677  -5.722   1.819
  402    HD2  TYR  12           HD2      TYR  12  -1.229  -2.113  -0.445
  403    HE1  TYR  12           HE1      TYR  12   1.186  -6.376   0.318
  404    HE2  TYR  12           HE2      TYR  12   0.635  -2.765  -1.944
  405    HH   TYR  12           HH       TYR  12   2.720  -5.445  -1.221
  406    H    GLY  13           H        GLY  13  -2.211  -0.519   2.300
  407   1HA   GLY  13          1HA       GLY  13   0.340   0.273   1.246
  408   2HA   GLY  13          2HA       GLY  13  -0.978   1.373   1.653
  409    H    VAL  14           H        VAL  14  -1.199   0.749   4.421
  410    HA   VAL  14           HA       VAL  14   0.839   2.449   5.496
  411    HB   VAL  14           HB       VAL  14  -1.051   0.523   6.881
  412   1HG1  VAL  14          1HG1      VAL  14   0.728   0.961   8.412
  413   2HG1  VAL  14          2HG1      VAL  14  -0.568   2.073   8.858
  414   3HG1  VAL  14          3HG1      VAL  14   0.816   2.657   7.934
  415   1HG2  VAL  14          1HG2      VAL  14  -2.131   2.346   5.583
  416   2HG2  VAL  14          2HG2      VAL  14  -1.163   3.530   6.464
  417   3HG2  VAL  14          3HG2      VAL  14  -2.363   2.559   7.318
  418    H    ILE  15           H        ILE  15   0.402  -1.098   5.670
  419    HA   ILE  15           HA       ILE  15   2.770  -1.560   7.221
  420    HB   ILE  15           HB       ILE  15   1.313  -3.401   5.301
  421   1HG1  ILE  15          1HG1      ILE  15   1.200  -3.237   8.327
  422   2HG1  ILE  15          2HG1      ILE  15   0.017  -2.470   7.268
  423   1HG2  ILE  15          1HG2      ILE  15   3.460  -3.896   7.381
  424   2HG2  ILE  15          2HG2      ILE  15   3.526  -4.277   5.660
  425   3HG2  ILE  15          3HG2      ILE  15   2.446  -5.180   6.721
  426   1HD1  ILE  15          1HD1      ILE  15  -0.810  -4.661   7.999
  427   2HD1  ILE  15          2HD1      ILE  15   0.649  -5.435   7.381
  428   3HD1  ILE  15          3HD1      ILE  15  -0.491  -4.685   6.264
  429    H    LEU  16           H        LEU  16   2.213  -1.349   3.720
  430    HA   LEU  16           HA       LEU  16   4.866  -2.246   3.022
  431   1HB   LEU  16          1HB       LEU  16   2.535  -1.738   1.618
  432   2HB   LEU  16          2HB       LEU  16   3.534  -0.386   1.122
  433    HG   LEU  16           HG       LEU  16   3.979  -2.052  -0.481
  434   1HD1  LEU  16          1HD1      LEU  16   6.047  -1.126   0.965
  435   2HD1  LEU  16          2HD1      LEU  16   6.254  -2.261  -0.359
  436   3HD1  LEU  16          3HD1      LEU  16   6.247  -2.846   1.299
  437   1HD2  LEU  16          1HD2      LEU  16   4.340  -4.091   1.739
  438   2HD2  LEU  16          2HD2      LEU  16   4.336  -4.401   0.005
  439   3HD2  LEU  16          3HD2      LEU  16   2.855  -3.891   0.811
  440    H    THR  17           H        THR  17   3.396   0.982   3.387
  441    HA   THR  17           HA       THR  17   5.731   2.474   2.699
  442    HB   THR  17           HB       THR  17   3.547   3.250   4.657
  443    HG1  THR  17           HG1      THR  17   2.471   2.898   2.844
  444   1HG2  THR  17          1HG2      THR  17   4.151   5.554   3.888
  445   2HG2  THR  17          2HG2      THR  17   5.508   4.859   3.000
  446   3HG2  THR  17          3HG2      THR  17   5.455   4.749   4.759
  447    H    ALA  18           H        ALA  18   4.625   1.118   5.792
  448    HA   ALA  18           HA       ALA  18   6.583   2.344   7.458
  449   1HB   ALA  18          1HB       ALA  18   5.450  -0.446   7.802
  450   2HB   ALA  18          2HB       ALA  18   4.574   1.022   8.236
  451   3HB   ALA  18          3HB       ALA  18   6.076   0.615   9.064
  452    H    LEU  19           H        LEU  19   6.669  -0.811   5.769
  453    HA   LEU  19           HA       LEU  19   9.359  -1.442   6.595
  454   1HB   LEU  19          1HB       LEU  19   7.884  -2.388   4.119
  455   2HB   LEU  19          2HB       LEU  19   9.280  -3.164   4.862
  456    HG   LEU  19           HG       LEU  19   6.678  -2.714   6.347
  457   1HD1  LEU  19          1HD1      LEU  19   6.247  -4.118   4.371
  458   2HD1  LEU  19          2HD1      LEU  19   6.157  -5.077   5.848
  459   3HD1  LEU  19          3HD1      LEU  19   7.587  -5.172   4.820
  460   1HD2  LEU  19          1HD2      LEU  19   7.648  -4.704   7.657
  461   2HD2  LEU  19          2HD2      LEU  19   8.460  -3.157   7.872
  462   3HD2  LEU  19          3HD2      LEU  19   9.164  -4.382   6.818
  463    H    PHE  20           H        PHE  20   8.019   0.348   3.860
  464    HA   PHE  20           HA       PHE  20  10.429   0.480   2.322
  465   1HB   PHE  20          1HB       PHE  20   8.214   1.117   1.420
  466   2HB   PHE  20          2HB       PHE  20   8.178   2.508   2.504
  467    HD1  PHE  20           HD1      PHE  20   9.432   4.493   2.032
  468    HD2  PHE  20           HD2      PHE  20   9.955   0.977  -0.378
  469    HE1  PHE  20           HE1      PHE  20  10.738   5.815   0.389
  470    HE2  PHE  20           HE2      PHE  20  11.259   2.298  -2.022
  471    HZ   PHE  20           HZ       PHE  20  11.651   4.717  -1.638
  472    H    LEU  21           H        LEU  21   9.054   2.840   4.648
  473    HA   LEU  21           HA       LEU  21  11.313   4.598   4.566
  474   1HB   LEU  21          1HB       LEU  21   9.317   4.126   6.802
  475   2HB   LEU  21          2HB       LEU  21  10.420   5.495   6.705
  476    HG   LEU  21           HG       LEU  21   8.365   4.826   4.573
  477   1HD1  LEU  21          1HD1      LEU  21   7.280   5.408   6.718
  478   2HD1  LEU  21          2HD1      LEU  21   7.045   6.679   5.519
  479   3HD1  LEU  21          3HD1      LEU  21   8.239   6.886   6.799
  480   1HD2  LEU  21          1HD2      LEU  21  10.323   7.086   5.022
  481   2HD2  LEU  21          2HD2      LEU  21   8.835   7.376   4.122
  482   3HD2  LEU  21          3HD2      LEU  21   9.992   6.185   3.543
  483    H    ARG  22           H        ARG  22  10.579   1.752   6.543
  484    HA   ARG  22           HA       ARG  22  12.691   2.016   8.425
  485   1HB   ARG  22          1HB       ARG  22  10.829   0.310   8.511
  486   2HB   ARG  22          2HB       ARG  22  11.677  -0.589   7.252
  487   1HG   ARG  22          1HG       ARG  22  13.674  -0.730   8.713
  488   2HG   ARG  22          2HG       ARG  22  12.792   0.124   9.979
  489   1HD   ARG  22          1HD       ARG  22  12.056  -2.562   8.780
  490   2HD   ARG  22          2HD       ARG  22  12.680  -2.277  10.404
  491    HE   ARG  22           HE       ARG  22  10.393  -0.704  10.267
  492   1HH1  ARG  22          1HH1      ARG  22  11.219  -4.008   9.732
  493   2HH1  ARG  22          2HH1      ARG  22   9.659  -4.609  10.187
  494   1HH2  ARG  22          1HH2      ARG  22   8.353  -1.469  10.865
  495   2HH2  ARG  22          2HH2      ARG  22   8.036  -3.172  10.829
  496    H    VAL  23           H        VAL  23  12.666   0.598   5.163
  497    HA   VAL  23           HA       VAL  23  15.434  -0.273   5.310
  498    HB   VAL  23           HB       VAL  23  13.577   0.167   2.953
  499   1HG1  VAL  23          1HG1      VAL  23  15.298  -1.334   1.794
  500   2HG1  VAL  23          2HG1      VAL  23  16.379  -0.963   3.138
  501   3HG1  VAL  23          3HG1      VAL  23  15.800   0.331   2.089
  502   1HG2  VAL  23          1HG2      VAL  23  14.499  -2.312   4.443
  503   2HG2  VAL  23          2HG2      VAL  23  13.517  -2.329   2.978
  504   3HG2  VAL  23          3HG2      VAL  23  12.874  -1.629   4.463
  505    H    LYS  24           H        LYS  24  13.781   2.665   4.300
  506    HA   LYS  24           HA       LYS  24  15.886   3.883   2.837
  507   1HB   LYS  24          1HB       LYS  24  13.515   4.747   3.087
  508   2HB   LYS  24          2HB       LYS  24  13.976   5.333   4.685
  509   1HG   LYS  24          1HG       LYS  24  15.820   6.645   3.638
  510   2HG   LYS  24          2HG       LYS  24  15.254   6.122   2.051
  511   1HD   LYS  24          1HD       LYS  24  12.980   7.098   2.695
  512   2HD   LYS  24          2HD       LYS  24  13.805   7.859   4.056
  513   1HE   LYS  24          1HE       LYS  24  13.805   9.476   2.288
  514   2HE   LYS  24          2HE       LYS  24  15.443   8.828   2.366
  515   1HZ   LYS  24          1HZ       LYS  24  15.259   8.030   0.320
  516   2HZ   LYS  24          2HZ       LYS  24  13.796   8.879   0.168
  517   3HZ   LYS  24          3HZ       LYS  24  13.790   7.256   0.671
  518    H    PHE  25           H        PHE  25  15.244   3.801   6.336
  519    HA   PHE  25           HA       PHE  25  18.096   4.376   6.833
  520   1HB   PHE  25          1HB       PHE  25  17.606   6.254   8.360
  521   2HB   PHE  25          2HB       PHE  25  17.092   6.629   6.715
  522    HD1  PHE  25           HD1      PHE  25  15.905   5.526  10.062
  523    HD2  PHE  25           HD2      PHE  25  14.789   6.978   6.177
  524    HE1  PHE  25           HE1      PHE  25  13.590   5.901  10.867
  525    HE2  PHE  25           HE2      PHE  25  12.473   7.351   6.983
  526    HZ   PHE  25           HZ       PHE  25  11.874   6.812   9.328
  527    H    SER  26           H        SER  26  18.643   4.016   9.134
  528    HA   SER  26           HA       SER  26  16.598   2.751  10.832
  529   1HB   SER  26          1HB       SER  26  19.008   1.179   9.870
  530   2HB   SER  26          2HB       SER  26  17.813   0.628  11.042
  531    HG   SER  26           HG       SER  26  17.675   0.200   8.551
  532    H    ARG  27           H        ARG  27  19.519   4.392  10.337
  533    HA   ARG  27           HA       ARG  27  20.861   3.804  12.814
  534   1HB   ARG  27          1HB       ARG  27  21.928   4.914  10.828
  535   2HB   ARG  27          2HB       ARG  27  20.989   6.363  11.190
  536   1HG   ARG  27          1HG       ARG  27  22.027   6.502  13.414
  537   2HG   ARG  27          2HG       ARG  27  22.949   5.035  13.085
  538   1HD   ARG  27          1HD       ARG  27  24.409   6.893  12.634
  539   2HD   ARG  27          2HD       ARG  27  23.933   6.222  11.074
  540    HE   ARG  27           HE       ARG  27  22.048   8.197  11.546
  541   1HH1  ARG  27          1HH1      ARG  27  25.487   7.974  11.501
  542   2HH1  ARG  27          2HH1      ARG  27  25.720   9.611  10.987
  543   1HH2  ARG  27          1HH2      ARG  27  22.330  10.338  10.878
  544   2HH2  ARG  27          2HH2      ARG  27  23.932  10.951  10.634
  545    H    SER  28           H        SER  28  20.556   4.684  14.839
  546    HA   SER  28           HA       SER  28  19.366   5.753  16.563
  547   1HB   SER  28          1HB       SER  28  20.622   7.671  15.531
  548   2HB   SER  28          2HB       SER  28  19.214   7.992  14.522
  549    HG   SER  28           HG       SER  28  19.546   9.057  16.750
  550    H    ALA  29           H        ALA  29  17.592   4.138  16.016
  551    HA   ALA  29           HA       ALA  29  15.376   4.806  14.363
  552   1HB   ALA  29          1HB       ALA  29  15.537   3.102  16.865
  553   2HB   ALA  29          2HB       ALA  29  15.623   2.548  15.193
  554   3HB   ALA  29          3HB       ALA  29  14.111   3.191  15.832
  555    H    ASP  30           H        ASP  30  16.266   5.857  17.577
  556    HA   ASP  30           HA       ASP  30  13.670   6.867  18.335
  557   1HB   ASP  30          1HB       ASP  30  16.470   7.570  19.262
  558   2HB   ASP  30          2HB       ASP  30  15.005   8.222  19.997
  Start of MODEL   13
    1   1H    ASP  -3          1H        ASP  -3 -23.335  -0.467  -4.425
    2    HA   ASP  -3           HA       ASP  -3 -23.003  -1.944  -6.934
    3   1HB   ASP  -3          1HB       ASP  -3 -25.171  -0.181  -5.751
    4   2HB   ASP  -3          2HB       ASP  -3 -25.293  -1.047  -7.283
    5    H    SER  -2           H        SER  -2 -23.165   1.390  -5.673
    6    HA   SER  -2           HA       SER  -2 -23.043   2.662  -8.246
    7   1HB   SER  -2          1HB       SER  -2 -22.115   3.695  -5.548
    8   2HB   SER  -2          2HB       SER  -2 -22.383   4.679  -6.983
    9    HG   SER  -2           HG       SER  -2 -24.260   3.211  -5.453
   10    H    LYS  -1           H        LYS  -1 -21.180   3.671  -9.253
   11    HA   LYS  -1           HA       LYS  -1 -18.757   2.049  -8.992
   12   1HB   LYS  -1          1HB       LYS  -1 -19.314   4.478 -10.726
   13   2HB   LYS  -1          2HB       LYS  -1 -17.927   3.398 -10.880
   14   1HG   LYS  -1          1HG       LYS  -1 -19.546   1.498 -11.233
   15   2HG   LYS  -1          2HG       LYS  -1 -20.844   2.690 -11.288
   16   1HD   LYS  -1          1HD       LYS  -1 -19.614   3.848 -13.148
   17   2HD   LYS  -1          2HD       LYS  -1 -18.465   2.509 -13.157
   18   1HE   LYS  -1          1HE       LYS  -1 -20.060   1.965 -14.838
   19   2HE   LYS  -1          2HE       LYS  -1 -20.501   0.973 -13.449
   20   1HZ   LYS  -1          1HZ       LYS  -1 -22.165   2.589 -12.840
   21   2HZ   LYS  -1          2HZ       LYS  -1 -22.420   2.085 -14.442
   22   3HZ   LYS  -1          3HZ       LYS  -1 -21.714   3.598 -14.126
   23    H    LEU   1           H        LEU   1 -19.841   4.362  -7.043
   24    HA   LEU   1           HA       LEU   1 -17.690   6.267  -6.943
   25   1HB   LEU   1          1HB       LEU   1 -19.937   6.620  -5.907
   26   2HB   LEU   1          2HB       LEU   1 -19.548   5.385  -4.714
   27    HG   LEU   1           HG       LEU   1 -17.551   6.760  -4.030
   28   1HD1  LEU   1          1HD1      LEU   1 -17.041   8.181  -5.825
   29   2HD1  LEU   1          2HD1      LEU   1 -17.874   9.278  -4.729
   30   3HD1  LEU   1          3HD1      LEU   1 -18.731   8.598  -6.111
   31   1HD2  LEU   1          1HD2      LEU   1 -20.292   8.049  -3.852
   32   2HD2  LEU   1          2HD2      LEU   1 -18.920   8.472  -2.829
   33   3HD2  LEU   1          3HD2      LEU   1 -19.621   6.856  -2.739
   34    H    CYS   2           H        CYS   2 -18.314   3.234  -5.182
   35    HA   CYS   2           HA       CYS   2 -16.046   3.366  -3.460
   36   1HB   CYS   2          1HB       CYS   2 -17.861   1.741  -3.125
   37   2HB   CYS   2          2HB       CYS   2 -17.428   0.932  -4.630
   38    H    TYR   3           H        TYR   3 -16.393   2.261  -6.793
   39    HA   TYR   3           HA       TYR   3 -13.893   0.949  -7.077
   40   1HB   TYR   3          1HB       TYR   3 -15.776   1.003  -8.772
   41   2HB   TYR   3          2HB       TYR   3 -15.251   2.631  -9.201
   42    HD1  TYR   3           HD1      TYR   3 -13.244   3.010 -10.477
   43    HD2  TYR   3           HD2      TYR   3 -14.265  -0.940  -9.136
   44    HE1  TYR   3           HE1      TYR   3 -11.497   2.055 -11.958
   45    HE2  TYR   3           HE2      TYR   3 -12.519  -1.896 -10.615
   46    HH   TYR   3           HH       TYR   3 -10.972  -0.063 -13.053
   47    H    LEU   4           H        LEU   4 -14.669   4.317  -6.760
   48    HA   LEU   4           HA       LEU   4 -12.192   5.303  -7.923
   49   1HB   LEU   4          1HB       LEU   4 -14.225   6.705  -7.809
   50   2HB   LEU   4          2HB       LEU   4 -14.164   6.652  -6.050
   51    HG   LEU   4           HG       LEU   4 -11.938   7.765  -6.112
   52   1HD1  LEU   4          1HD1      LEU   4 -10.949   7.237  -8.169
   53   2HD1  LEU   4          2HD1      LEU   4 -11.473   8.895  -8.447
   54   3HD1  LEU   4          3HD1      LEU   4 -12.427   7.551  -9.079
   55   1HD2  LEU   4          1HD2      LEU   4 -13.936   9.340  -7.749
   56   2HD2  LEU   4          2HD2      LEU   4 -12.788   9.950  -6.557
   57   3HD2  LEU   4          3HD2      LEU   4 -14.181   9.003  -6.035
   58    H    LEU   5           H        LEU   5 -13.378   4.796  -4.589
   59    HA   LEU   5           HA       LEU   5 -10.963   5.700  -3.323
   60   1HB   LEU   5          1HB       LEU   5 -13.281   3.977  -2.445
   61   2HB   LEU   5          2HB       LEU   5 -11.885   4.196  -1.392
   62    HG   LEU   5           HG       LEU   5 -12.180   6.669  -1.572
   63   1HD1  LEU   5          1HD1      LEU   5 -14.579   5.804  -3.198
   64   2HD1  LEU   5          2HD1      LEU   5 -13.302   6.930  -3.659
   65   3HD1  LEU   5          3HD1      LEU   5 -14.483   7.390  -2.434
   66   1HD2  LEU   5          1HD2      LEU   5 -13.209   5.294   0.269
   67   2HD2  LEU   5          2HD2      LEU   5 -14.701   5.243  -0.671
   68   3HD2  LEU   5          3HD2      LEU   5 -14.085   6.785  -0.075
   69    H    ASP   6           H        ASP   6 -12.111   2.432  -4.208
   70    HA   ASP   6           HA       ASP   6  -9.826   1.034  -3.215
   71   1HB   ASP   6          1HB       ASP   6 -11.753   0.378  -5.462
   72   2HB   ASP   6          2HB       ASP   6 -10.518  -0.741  -4.881
   73    H    GLY   7           H        GLY   7 -10.478   2.594  -6.330
   74   1HA   GLY   7          1HA       GLY   7  -8.215   1.637  -7.747
   75   2HA   GLY   7          2HA       GLY   7  -9.006   3.182  -8.060
   76    H    ILE   8           H        ILE   8  -8.544   4.685  -5.882
   77    HA   ILE   8           HA       ILE   8  -5.816   5.459  -6.136
   78    HB   ILE   8           HB       ILE   8  -7.762   6.048  -3.885
   79   1HG1  ILE   8          1HG1      ILE   8  -7.054   7.680  -6.345
   80   2HG1  ILE   8          2HG1      ILE   8  -8.501   6.680  -6.210
   81   1HG2  ILE   8          1HG2      ILE   8  -6.290   8.076  -3.598
   82   2HG2  ILE   8          2HG2      ILE   8  -5.153   7.342  -4.728
   83   3HG2  ILE   8          3HG2      ILE   8  -5.497   6.556  -3.188
   84   1HD1  ILE   8          1HD1      ILE   8  -9.039   8.002  -4.084
   85   2HD1  ILE   8          2HD1      ILE   8  -9.192   8.880  -5.605
   86   3HD1  ILE   8          3HD1      ILE   8  -7.774   9.123  -4.585
   87    H    LEU   9           H        LEU   9  -7.440   3.812  -3.394
   88    HA   LEU   9           HA       LEU   9  -5.072   3.354  -1.888
   89   1HB   LEU   9          1HB       LEU   9  -7.565   1.630  -2.025
   90   2HB   LEU   9          2HB       LEU   9  -6.366   1.604  -0.736
   91    HG   LEU   9           HG       LEU   9  -7.929   4.085  -1.506
   92   1HD1  LEU   9          1HD1      LEU   9  -9.517   2.428  -0.728
   93   2HD1  LEU   9          2HD1      LEU   9  -9.252   3.589   0.574
   94   3HD1  LEU   9          3HD1      LEU   9  -8.476   2.005   0.632
   95   1HD2  LEU   9          1HD2      LEU   9  -7.239   4.630   0.949
   96   2HD2  LEU   9          2HD2      LEU   9  -6.005   4.755  -0.299
   97   3HD2  LEU   9          3HD2      LEU   9  -6.054   3.340   0.750
   98    H    PHE  10           H        PHE  10  -6.668   1.349  -4.363
   99    HA   PHE  10           HA       PHE  10  -4.884  -0.874  -4.160
  100   1HB   PHE  10          1HB       PHE  10  -7.035  -0.980  -5.366
  101   2HB   PHE  10          2HB       PHE  10  -6.405   0.127  -6.586
  102    HD1  PHE  10           HD1      PHE  10  -5.503  -3.096  -4.884
  103    HD2  PHE  10           HD2      PHE  10  -5.404  -0.781  -8.503
  104    HE1  PHE  10           HE1      PHE  10  -4.481  -5.011  -6.081
  105    HE2  PHE  10           HE2      PHE  10  -4.381  -2.697  -9.699
  106    HZ   PHE  10           HZ       PHE  10  -3.919  -4.812  -8.489
  107    H    ILE  11           H        ILE  11  -4.873   1.839  -6.507
  108    HA   ILE  11           HA       ILE  11  -2.447   1.152  -7.791
  109    HB   ILE  11           HB       ILE  11  -3.680   3.872  -7.271
  110   1HG1  ILE  11          1HG1      ILE  11  -3.617   2.203  -9.798
  111   2HG1  ILE  11          2HG1      ILE  11  -4.944   2.136  -8.639
  112   1HG2  ILE  11          1HG2      ILE  11  -2.231   4.499  -9.295
  113   2HG2  ILE  11          2HG2      ILE  11  -1.326   3.022  -8.964
  114   3HG2  ILE  11          3HG2      ILE  11  -1.391   4.304  -7.756
  115   1HD1  ILE  11          1HD1      ILE  11  -5.198   4.628  -8.893
  116   2HD1  ILE  11          2HD1      ILE  11  -5.544   3.723 -10.366
  117   3HD1  ILE  11          3HD1      ILE  11  -4.004   4.563 -10.190
  118    H    TYR  12           H        TYR  12  -3.023   3.036  -4.841
  119    HA   TYR  12           HA       TYR  12  -0.364   3.935  -4.407
  120   1HB   TYR  12          1HB       TYR  12  -2.268   4.732  -3.069
  121   2HB   TYR  12          2HB       TYR  12  -2.452   3.127  -2.360
  122    HD1  TYR  12           HD1      TYR  12  -0.989   2.344  -0.625
  123    HD2  TYR  12           HD2      TYR  12  -0.218   6.080  -2.602
  124    HE1  TYR  12           HE1      TYR  12   0.707   2.906   1.096
  125    HE2  TYR  12           HE2      TYR  12   1.477   6.641  -0.880
  126    HH   TYR  12           HH       TYR  12   1.781   5.823   1.730
  127    H    GLY  13           H        GLY  13  -1.936   0.878  -3.475
  128   1HA   GLY  13          1HA       GLY  13   0.338  -0.154  -2.049
  129   2HA   GLY  13          2HA       GLY  13  -1.000  -1.119  -2.671
  130    H    VAL  14           H        VAL  14  -0.733  -0.466  -5.430
  131    HA   VAL  14           HA       VAL  14   1.280  -2.352  -6.212
  132    HB   VAL  14           HB       VAL  14  -0.159  -0.258  -7.869
  133   1HG1  VAL  14          1HG1      VAL  14   0.390  -1.881  -9.737
  134   2HG1  VAL  14          2HG1      VAL  14   1.474  -2.700  -8.613
  135   3HG1  VAL  14          3HG1      VAL  14   1.782  -1.026  -9.074
  136   1HG2  VAL  14          1HG2      VAL  14  -1.597  -1.932  -6.642
  137   2HG2  VAL  14          2HG2      VAL  14  -0.751  -3.213  -7.510
  138   3HG2  VAL  14          3HG2      VAL  14  -1.719  -2.036  -8.399
  139    H    ILE  15           H        ILE  15   1.196   1.220  -6.464
  140    HA   ILE  15           HA       ILE  15   3.774   1.478  -7.659
  141    HB   ILE  15           HB       ILE  15   2.310   3.415  -5.841
  142   1HG1  ILE  15          1HG1      ILE  15   2.453   3.286  -8.869
  143   2HG1  ILE  15          2HG1      ILE  15   1.102   2.666  -7.921
  144   1HG2  ILE  15          1HG2      ILE  15   4.652   3.764  -7.737
  145   2HG2  ILE  15          2HG2      ILE  15   4.647   4.039  -5.996
  146   3HG2  ILE  15          3HG2      ILE  15   3.735   5.108  -7.059
  147   1HD1  ILE  15          1HD1      ILE  15   0.638   4.952  -8.731
  148   2HD1  ILE  15          2HD1      ILE  15   2.087   5.535  -7.912
  149   3HD1  ILE  15          3HD1      ILE  15   0.732   4.912  -6.971
  150    H    LEU  16           H        LEU  16   2.792   1.501  -4.226
  151    HA   LEU  16           HA       LEU  16   5.408   2.000  -3.191
  152   1HB   LEU  16          1HB       LEU  16   2.857   1.672  -2.119
  153   2HB   LEU  16          2HB       LEU  16   3.692   0.254  -1.513
  154    HG   LEU  16           HG       LEU  16   4.037   1.886   0.153
  155   1HD1  LEU  16          1HD1      LEU  16   6.217   0.838  -1.075
  156   2HD1  LEU  16          2HD1      LEU  16   6.311   1.881   0.337
  157   3HD1  LEU  16          3HD1      LEU  16   6.572   2.554  -1.269
  158   1HD2  LEU  16          1HD2      LEU  16   4.625   4.206  -0.273
  159   2HD2  LEU  16          2HD2      LEU  16   3.216   3.798  -1.248
  160   3HD2  LEU  16          3HD2      LEU  16   4.809   3.890  -1.996
  161    H    THR  17           H        THR  17   3.689  -1.033  -3.902
  162    HA   THR  17           HA       THR  17   5.683  -2.816  -2.931
  163    HB   THR  17           HB       THR  17   3.820  -3.238  -5.287
  164    HG1  THR  17           HG1      THR  17   3.395  -2.952  -2.626
  165   1HG2  THR  17          1HG2      THR  17   5.459  -4.981  -5.217
  166   2HG2  THR  17          2HG2      THR  17   4.004  -5.640  -4.471
  167   3HG2  THR  17          3HG2      THR  17   5.347  -5.103  -3.461
  168    H    ALA  18           H        ALA  18   5.302  -1.275  -6.120
  169    HA   ALA  18           HA       ALA  18   7.395  -2.662  -7.452
  170   1HB   ALA  18          1HB       ALA  18   5.866  -1.270  -8.712
  171   2HB   ALA  18          2HB       ALA  18   7.492  -0.622  -8.925
  172   3HB   ALA  18          3HB       ALA  18   6.366   0.166  -7.819
  173    H    LEU  19           H        LEU  19   7.513   0.460  -5.709
  174    HA   LEU  19           HA       LEU  19  10.351   0.804  -6.014
  175   1HB   LEU  19          1HB       LEU  19   8.560   1.865  -3.809
  176   2HB   LEU  19          2HB       LEU  19  10.135   2.504  -4.267
  177    HG   LEU  19           HG       LEU  19   7.803   2.345  -6.197
  178   1HD1  LEU  19          1HD1      LEU  19   8.698   4.703  -4.510
  179   2HD1  LEU  19          2HD1      LEU  19   7.219   3.776  -4.259
  180   3HD1  LEU  19          3HD1      LEU  19   7.424   4.727  -5.730
  181   1HD2  LEU  19          1HD2      LEU  19  10.505   3.717  -6.195
  182   2HD2  LEU  19          2HD2      LEU  19   9.202   4.238  -7.261
  183   3HD2  LEU  19          3HD2      LEU  19   9.847   2.604  -7.394
  184    H    PHE  20           H        PHE  20   8.385  -0.900  -3.627
  185    HA   PHE  20           HA       PHE  20  10.420  -1.271  -1.662
  186   1HB   PHE  20          1HB       PHE  20   8.049  -1.781  -1.226
  187   2HB   PHE  20          2HB       PHE  20   8.114  -3.103  -2.393
  188    HD1  PHE  20           HD1      PHE  20   9.018  -5.229  -1.809
  189    HD2  PHE  20           HD2      PHE  20   9.501  -1.882   0.838
  190    HE1  PHE  20           HE1      PHE  20   9.875  -6.748  -0.045
  191    HE2  PHE  20           HE2      PHE  20  10.356  -3.401   2.603
  192    HZ   PHE  20           HZ       PHE  20  10.542  -5.833   2.161
  193    H    LEU  21           H        LEU  21   9.391  -3.467  -4.303
  194    HA   LEU  21           HA       LEU  21  11.472  -5.380  -3.864
  195   1HB   LEU  21          1HB       LEU  21  10.036  -4.692  -6.446
  196   2HB   LEU  21          2HB       LEU  21  10.948  -6.169  -6.144
  197    HG   LEU  21           HG       LEU  21   8.598  -5.313  -4.432
  198   1HD1  LEU  21          1HD1      LEU  21   7.206  -6.821  -5.737
  199   2HD1  LEU  21          2HD1      LEU  21   8.579  -7.270  -6.749
  200   3HD1  LEU  21          3HD1      LEU  21   7.927  -5.633  -6.823
  201   1HD2  LEU  21          1HD2      LEU  21  10.230  -7.845  -4.742
  202   2HD2  LEU  21          2HD2      LEU  21   8.609  -7.881  -4.052
  203   3HD2  LEU  21          3HD2      LEU  21   9.875  -6.941  -3.271
  204    H    ARG  22           H        ARG  22  11.316  -2.465  -5.884
  205    HA   ARG  22           HA       ARG  22  13.690  -2.793  -7.354
  206   1HB   ARG  22          1HB       ARG  22  12.037  -0.892  -7.577
  207   2HB   ARG  22          2HB       ARG  22  12.761  -0.177  -6.137
  208   1HG   ARG  22          1HG       ARG  22  14.974  -0.184  -7.279
  209   2HG   ARG  22          2HG       ARG  22  14.195  -0.811  -8.732
  210   1HD   ARG  22          1HD       ARG  22  13.543   1.821  -7.374
  211   2HD   ARG  22          2HD       ARG  22  14.448   1.635  -8.876
  212    HE   ARG  22           HE       ARG  22  12.055   0.330  -9.379
  213   1HH1  ARG  22          1HH1      ARG  22  13.025   3.432  -8.233
  214   2HH1  ARG  22          2HH1      ARG  22  11.651   4.254  -8.893
  215   1HH2  ARG  22          1HH2      ARG  22  10.249   1.385 -10.246
  216   2HH2  ARG  22          2HH2      ARG  22  10.078   3.094 -10.031
  217    H    VAL  23           H        VAL  23  13.276  -1.544  -4.042
  218    HA   VAL  23           HA       VAL  23  16.122  -1.045  -3.701
  219    HB   VAL  23           HB       VAL  23  13.888  -1.312  -1.666
  220   1HG1  VAL  23          1HG1      VAL  23  16.776  -0.437  -1.436
  221   2HG1  VAL  23          2HG1      VAL  23  15.955  -1.703  -0.524
  222   3HG1  VAL  23          3HG1      VAL  23  15.555  -0.010  -0.238
  223   1HG2  VAL  23          1HG2      VAL  23  13.809   1.085  -1.706
  224   2HG2  VAL  23          2HG2      VAL  23  13.771   0.564  -3.390
  225   3HG2  VAL  23          3HG2      VAL  23  15.267   1.182  -2.691
  226    H    LYS  24           H        LYS  24  13.945  -3.743  -3.105
  227    HA   LYS  24           HA       LYS  24  15.570  -5.281  -1.363
  228   1HB   LYS  24          1HB       LYS  24  13.176  -5.765  -2.068
  229   2HB   LYS  24          2HB       LYS  24  13.835  -6.415  -3.568
  230   1HG   LYS  24          1HG       LYS  24  15.243  -7.982  -2.212
  231   2HG   LYS  24          2HG       LYS  24  14.428  -7.395  -0.761
  232   1HD   LYS  24          1HD       LYS  24  12.231  -8.024  -1.919
  233   2HD   LYS  24          2HD       LYS  24  13.220  -8.897  -3.090
  234   1HE   LYS  24          1HE       LYS  24  12.593 -10.497  -1.418
  235   2HE   LYS  24          2HE       LYS  24  14.285 -10.100  -1.114
  236   1HZ   LYS  24          1HZ       LYS  24  13.720  -8.744   0.677
  237   2HZ   LYS  24          2HZ       LYS  24  12.711 -10.098   0.860
  238   3HZ   LYS  24          3HZ       LYS  24  12.087  -8.649   0.228
  239    H    PHE  25           H        PHE  25  15.635  -4.987  -4.906
  240    HA   PHE  25           HA       PHE  25  17.818  -6.971  -5.094
  241   1HB   PHE  25          1HB       PHE  25  16.362  -5.290  -7.151
  242   2HB   PHE  25          2HB       PHE  25  17.720  -6.341  -7.553
  243    HD1  PHE  25           HD1      PHE  25  14.184  -6.181  -6.765
  244    HD2  PHE  25           HD2      PHE  25  17.564  -8.814  -7.067
  245    HE1  PHE  25           HE1      PHE  25  12.656  -8.133  -6.830
  246    HE2  PHE  25           HE2      PHE  25  16.036 -10.766  -7.134
  247    HZ   PHE  25           HZ       PHE  25  13.582 -10.425  -7.016
  248    H    SER  26           H        SER  26  19.959  -6.430  -5.251
  249    HA   SER  26           HA       SER  26  20.727  -3.667  -4.738
  250   1HB   SER  26          1HB       SER  26  22.495  -6.027  -5.442
  251   2HB   SER  26          2HB       SER  26  23.005  -4.520  -4.689
  252    HG   SER  26           HG       SER  26  21.583  -6.682  -3.636
  253    H    ARG  27           H        ARG  27  22.162  -2.429  -6.159
  254    HA   ARG  27           HA       ARG  27  22.171  -3.259  -9.026
  255   1HB   ARG  27          1HB       ARG  27  21.072  -0.658  -7.924
  256   2HB   ARG  27          2HB       ARG  27  21.485  -0.896  -9.622
  257   1HG   ARG  27          1HG       ARG  27  19.918  -2.826  -9.705
  258   2HG   ARG  27          2HG       ARG  27  19.460  -2.501  -8.032
  259   1HD   ARG  27          1HD       ARG  27  17.833  -1.479  -9.554
  260   2HD   ARG  27          2HD       ARG  27  18.728  -0.221  -8.700
  261    HE   ARG  27           HE       ARG  27  20.175  -0.571 -11.029
  262   1HH1  ARG  27          1HH1      ARG  27  16.873  -0.003 -10.216
  263   2HH1  ARG  27          2HH1      ARG  27  16.535   0.896 -11.657
  264   1HH2  ARG  27          1HH2      ARG  27  19.750   0.598 -12.917
  265   2HH2  ARG  27          2HH2      ARG  27  18.162   1.236 -13.186
  266    H    SER  28           H        SER  28  23.671  -1.844 -10.307
  267    HA   SER  28           HA       SER  28  25.699  -0.388  -8.691
  268   1HB   SER  28          1HB       SER  28  26.401  -2.819  -8.903
  269   2HB   SER  28          2HB       SER  28  26.477  -2.571 -10.645
  270    HG   SER  28           HG       SER  28  28.398  -1.824 -10.260
  271    H    ALA  29           H        ALA  29  26.689   1.255  -9.877
  272    HA   ALA  29           HA       ALA  29  26.781   2.866 -11.588
  273   1HB   ALA  29          1HB       ALA  29  27.232   1.886 -13.854
  274   2HB   ALA  29          2HB       ALA  29  26.880   0.293 -13.187
  275   3HB   ALA  29          3HB       ALA  29  28.258   1.214 -12.587
  276    H    ASP  30           H        ASP  30  25.690   3.223 -13.988
  277    HA   ASP  30           HA       ASP  30  23.649   3.895 -14.950
  278   1HB   ASP  30          1HB       ASP  30  23.758   1.424 -15.462
  279   2HB   ASP  30          2HB       ASP  30  22.759   1.146 -14.037
  280   1H    ASP  -3          1H        ASP  -3 -24.266  -6.078   4.310
  281    HA   ASP  -3           HA       ASP  -3 -22.654  -6.550   2.888
  282   1HB   ASP  -3          1HB       ASP  -3 -24.411  -7.971   1.744
  283   2HB   ASP  -3          2HB       ASP  -3 -24.709  -6.610   0.662
  284    H    SER  -2           H        SER  -2 -24.756  -3.905   2.387
  285    HA   SER  -2           HA       SER  -2 -23.467  -2.572   0.218
  286   1HB   SER  -2          1HB       SER  -2 -24.827  -1.334   2.629
  287   2HB   SER  -2          2HB       SER  -2 -24.515  -0.535   1.092
  288    HG   SER  -2           HG       SER  -2 -26.646  -1.811   1.685
  289    H    LYS  -1           H        LYS  -1 -22.586  -2.963   3.573
  290    HA   LYS  -1           HA       LYS  -1 -20.592  -0.818   3.526
  291   1HB   LYS  -1          1HB       LYS  -1 -21.910  -1.770   5.576
  292   2HB   LYS  -1          2HB       LYS  -1 -20.693  -3.042   5.566
  293   1HG   LYS  -1          1HG       LYS  -1 -19.697  -1.498   7.004
  294   2HG   LYS  -1          2HG       LYS  -1 -18.992  -1.011   5.466
  295   1HD   LYS  -1          1HD       LYS  -1 -20.663   0.762   5.223
  296   2HD   LYS  -1          2HD       LYS  -1 -21.473   0.231   6.696
  297   1HE   LYS  -1          1HE       LYS  -1 -19.263   0.634   7.903
  298   2HE   LYS  -1          2HE       LYS  -1 -18.715   1.446   6.436
  299   1HZ   LYS  -1          1HZ       LYS  -1 -20.423   3.041   6.624
  300   2HZ   LYS  -1          2HZ       LYS  -1 -19.732   2.914   8.171
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.223   2.170   7.839
  302    H    LEU   1           H        LEU   1 -20.611  -3.511   1.820
  303    HA   LEU   1           HA       LEU   1 -18.245  -4.933   2.519
  304   1HB   LEU   1          1HB       LEU   1 -19.961  -5.710   0.862
  305   2HB   LEU   1          2HB       LEU   1 -19.368  -4.494  -0.264
  306    HG   LEU   1           HG       LEU   1 -17.088  -5.545  -0.108
  307   1HD1  LEU   1          1HD1      LEU   1 -18.615  -7.418   1.689
  308   2HD1  LEU   1          2HD1      LEU   1 -16.990  -6.760   1.885
  309   3HD1  LEU   1          3HD1      LEU   1 -17.282  -8.046   0.720
  310   1HD2  LEU   1          1HD2      LEU   1 -17.708  -7.531  -1.491
  311   2HD2  LEU   1          2HD2      LEU   1 -18.560  -6.067  -1.981
  312   3HD2  LEU   1          3HD2      LEU   1 -19.392  -7.292  -1.023
  313    H    CYS   2           H        CYS   2 -18.728  -2.028   0.539
  314    HA   CYS   2           HA       CYS   2 -16.149  -1.829  -0.594
  315   1HB   CYS   2          1HB       CYS   2 -18.015  -0.318  -1.183
  316   2HB   CYS   2          2HB       CYS   2 -17.911   0.429   0.412
  317    H    TYR   3           H        TYR   3 -17.270  -0.911   2.645
  318    HA   TYR   3           HA       TYR   3 -14.872   0.439   3.441
  319   1HB   TYR   3          1HB       TYR   3 -17.150   0.414   4.634
  320   2HB   TYR   3          2HB       TYR   3 -16.655  -1.140   5.305
  321    HD1  TYR   3           HD1      TYR   3 -14.997  -1.287   7.036
  322    HD2  TYR   3           HD2      TYR   3 -15.811   2.470   5.120
  323    HE1  TYR   3           HE1      TYR   3 -13.662  -0.116   8.766
  324    HE2  TYR   3           HE2      TYR   3 -14.475   3.643   6.850
  325    HH   TYR   3           HH       TYR   3 -12.330   2.533   8.579
  326    H    LEU   4           H        LEU   4 -15.726  -2.951   3.233
  327    HA   LEU   4           HA       LEU   4 -13.601  -3.932   4.920
  328   1HB   LEU   4          1HB       LEU   4 -15.602  -5.283   4.311
  329   2HB   LEU   4          2HB       LEU   4 -15.042  -5.327   2.642
  330    HG   LEU   4           HG       LEU   4 -12.940  -6.447   3.421
  331   1HD1  LEU   4          1HD1      LEU   4 -13.268  -7.526   5.805
  332   2HD1  LEU   4          2HD1      LEU   4 -14.332  -6.147   6.077
  333   3HD1  LEU   4          3HD1      LEU   4 -12.635  -5.889   5.673
  334   1HD2  LEU   4          1HD2      LEU   4 -15.595  -7.748   4.091
  335   2HD2  LEU   4          2HD2      LEU   4 -14.072  -8.632   3.990
  336   3HD2  LEU   4          3HD2      LEU   4 -14.723  -7.831   2.560
  337    H    LEU   5           H        LEU   5 -13.894  -3.430   1.401
  338    HA   LEU   5           HA       LEU   5 -11.289  -4.469   0.772
  339   1HB   LEU   5          1HB       LEU   5 -13.204  -2.615  -0.649
  340   2HB   LEU   5          2HB       LEU   5 -11.608  -2.944  -1.319
  341    HG   LEU   5           HG       LEU   5 -12.124  -5.398  -1.199
  342   1HD1  LEU   5          1HD1      LEU   5 -14.638  -5.900  -1.024
  343   2HD1  LEU   5          2HD1      LEU   5 -14.797  -4.298  -0.305
  344   3HD1  LEU   5          3HD1      LEU   5 -13.806  -5.526   0.484
  345   1HD2  LEU   5          1HD2      LEU   5 -12.477  -3.987  -3.256
  346   2HD2  LEU   5          2HD2      LEU   5 -14.165  -3.803  -2.777
  347   3HD2  LEU   5          3HD2      LEU   5 -13.530  -5.399  -3.174
  348    H    ASP   6           H        ASP   6 -12.467  -1.156   1.391
  349    HA   ASP   6           HA       ASP   6  -9.972   0.158   0.985
  350   1HB   ASP   6          1HB       ASP   6 -12.289   0.866   2.810
  351   2HB   ASP   6          2HB       ASP   6 -10.946   1.950   2.442
  352    H    GLY   7           H        GLY   7 -11.368  -1.405   3.849
  353   1HA   GLY   7          1HA       GLY   7  -9.418  -0.577   5.742
  354   2HA   GLY   7          2HA       GLY   7 -10.352  -2.069   5.857
  355    H    ILE   8           H        ILE   8  -9.514  -3.576   3.778
  356    HA   ILE   8           HA       ILE   8  -6.940  -4.498   4.630
  357    HB   ILE   8           HB       ILE   8  -8.358  -5.066   2.008
  358   1HG1  ILE   8          1HG1      ILE   8  -8.473  -6.553   4.654
  359   2HG1  ILE   8          2HG1      ILE   8  -9.751  -5.502   4.040
  360   1HG2  ILE   8          1HG2      ILE   8  -5.991  -5.757   2.042
  361   2HG2  ILE   8          2HG2      ILE   8  -7.046  -7.168   2.092
  362   3HG2  ILE   8          3HG2      ILE   8  -6.254  -6.607   3.564
  363   1HD1  ILE   8          1HD1      ILE   8  -9.843  -6.954   1.979
  364   2HD1  ILE   8          2HD1      ILE   8 -10.333  -7.774   3.460
  365   3HD1  ILE   8          3HD1      ILE   8  -8.730  -8.062   2.781
  366    H    LEU   9           H        LEU   9  -7.906  -2.772   1.639
  367    HA   LEU   9           HA       LEU   9  -5.265  -2.523   0.600
  368   1HB   LEU   9          1HB       LEU   9  -7.604  -0.625   0.240
  369   2HB   LEU   9          2HB       LEU   9  -6.183  -0.724  -0.799
  370    HG   LEU   9           HG       LEU   9  -7.946  -3.131  -0.302
  371   1HD1  LEU   9          1HD1      LEU   9  -9.052  -2.569  -2.475
  372   2HD1  LEU   9          2HD1      LEU   9  -8.236  -1.005  -2.443
  373   3HD1  LEU   9          3HD1      LEU   9  -9.416  -1.410  -1.196
  374   1HD2  LEU   9          1HD2      LEU   9  -5.841  -3.705  -1.303
  375   2HD2  LEU   9          2HD2      LEU   9  -5.917  -2.339  -2.415
  376   3HD2  LEU   9          3HD2      LEU   9  -7.017  -3.700  -2.613
  377    H    PHE  10           H        PHE  10  -7.159  -0.364   2.714
  378    HA   PHE  10           HA       PHE  10  -5.220   1.729   2.847
  379   1HB   PHE  10          1HB       PHE  10  -7.557   1.966   3.644
  380   2HB   PHE  10          2HB       PHE  10  -7.201   0.867   4.977
  381    HD1  PHE  10           HD1      PHE  10  -6.118   1.638   6.947
  382    HD2  PHE  10           HD2      PHE  10  -6.242   4.130   3.452
  383    HE1  PHE  10           HE1      PHE  10  -5.230   3.537   8.271
  384    HE2  PHE  10           HE2      PHE  10  -5.353   6.031   4.775
  385    HZ   PHE  10           HZ       PHE  10  -4.847   5.734   7.184
  386    H    ILE  11           H        ILE  11  -5.846  -0.903   5.205
  387    HA   ILE  11           HA       ILE  11  -3.625  -0.393   6.877
  388    HB   ILE  11           HB       ILE  11  -4.933  -3.034   6.148
  389   1HG1  ILE  11          1HG1      ILE  11  -5.223  -1.339   8.645
  390   2HG1  ILE  11          2HG1      ILE  11  -6.315  -1.212   7.264
  391   1HG2  ILE  11          1HG2      ILE  11  -3.912  -3.737   8.387
  392   2HG2  ILE  11          2HG2      ILE  11  -2.885  -2.311   8.254
  393   3HG2  ILE  11          3HG2      ILE  11  -2.786  -3.584   7.039
  394   1HD1  ILE  11          1HD1      ILE  11  -6.999  -3.512   7.497
  395   2HD1  ILE  11          2HD1      ILE  11  -7.116  -2.768   9.093
  396   3HD1  ILE  11          3HD1      ILE  11  -5.751  -3.816   8.706
  397    H    TYR  12           H        TYR  12  -3.838  -2.282   3.878
  398    HA   TYR  12           HA       TYR  12  -1.225  -3.376   3.880
  399   1HB   TYR  12          1HB       TYR  12  -2.938  -4.033   2.242
  400   2HB   TYR  12          2HB       TYR  12  -2.885  -2.422   1.526
  401    HD1  TYR  12           HD1      TYR  12  -1.078  -1.743   0.081
  402    HD2  TYR  12           HD2      TYR  12  -0.981  -5.557   2.056
  403    HE1  TYR  12           HE1      TYR  12   0.816  -2.442  -1.360
  404    HE2  TYR  12           HE2      TYR  12   0.912  -6.255   0.616
  405    HH   TYR  12           HH       TYR  12   2.027  -5.743  -1.328
  406    H    GLY  13           H        GLY  13  -2.380  -0.192   2.788
  407   1HA   GLY  13          1HA       GLY  13   0.084   0.688   1.650
  408   2HA   GLY  13          2HA       GLY  13  -1.175   1.755   2.272
  409    H    VAL  14           H        VAL  14  -1.169   0.915   4.979
  410    HA   VAL  14           HA       VAL  14   1.049   2.453   5.978
  411    HB   VAL  14           HB       VAL  14  -0.868   0.608   7.430
  412   1HG1  VAL  14          1HG1      VAL  14   1.150   2.645   8.403
  413   2HG1  VAL  14          2HG1      VAL  14   1.060   0.934   8.825
  414   3HG1  VAL  14          3HG1      VAL  14  -0.173   2.053   9.406
  415   1HG2  VAL  14          1HG2      VAL  14  -0.846   3.607   6.963
  416   2HG2  VAL  14          2HG2      VAL  14  -1.969   2.769   8.034
  417   3HG2  VAL  14          3HG2      VAL  14  -2.004   2.454   6.299
  418    H    ILE  15           H        ILE  15   0.384  -1.056   5.929
  419    HA   ILE  15           HA       ILE  15   2.809  -1.741   7.341
  420    HB   ILE  15           HB       ILE  15   1.137  -3.445   5.467
  421   1HG1  ILE  15          1HG1      ILE  15   1.037  -3.185   8.492
  422   2HG1  ILE  15          2HG1      ILE  15  -0.114  -2.425   7.394
  423   1HG2  ILE  15          1HG2      ILE  15   3.350  -4.407   5.889
  424   2HG2  ILE  15          2HG2      ILE  15   2.137  -5.317   6.788
  425   3HG2  ILE  15          3HG2      ILE  15   3.158  -4.146   7.622
  426   1HD1  ILE  15          1HD1      ILE  15  -1.008  -4.554   8.251
  427   2HD1  ILE  15          2HD1      ILE  15   0.404  -5.405   7.621
  428   3HD1  ILE  15          3HD1      ILE  15  -0.737  -4.647   6.510
  429    H    LEU  16           H        LEU  16   1.976  -1.447   3.898
  430    HA   LEU  16           HA       LEU  16   4.532  -2.448   2.979
  431   1HB   LEU  16          1HB       LEU  16   2.192  -2.119   1.729
  432   2HB   LEU  16          2HB       LEU  16   2.877  -0.552   1.327
  433    HG   LEU  16           HG       LEU  16   3.428  -2.042  -0.473
  434   1HD1  LEU  16          1HD1      LEU  16   5.951  -2.001   1.179
  435   2HD1  LEU  16          2HD1      LEU  16   5.246  -0.521   0.531
  436   3HD1  LEU  16          3HD1      LEU  16   5.771  -1.797  -0.563
  437   1HD2  LEU  16          1HD2      LEU  16   3.180  -4.123   1.177
  438   2HD2  LEU  16          2HD2      LEU  16   4.931  -3.961   1.291
  439   3HD2  LEU  16          3HD2      LEU  16   4.171  -4.230  -0.274
  440    H    THR  17           H        THR  17   3.189   0.790   3.562
  441    HA   THR  17           HA       THR  17   5.492   2.228   2.624
  442    HB   THR  17           HB       THR  17   3.484   3.099   4.725
  443    HG1  THR  17           HG1      THR  17   2.235   3.739   3.056
  444   1HG2  THR  17          1HG2      THR  17   5.413   4.555   2.909
  445   2HG2  THR  17          2HG2      THR  17   5.319   4.622   4.669
  446   3HG2  THR  17          3HG2      THR  17   4.054   5.363   3.689
  447    H    ALA  18           H        ALA  18   4.577   0.952   5.810
  448    HA   ALA  18           HA       ALA  18   6.646   2.183   7.324
  449   1HB   ALA  18          1HB       ALA  18   6.321   0.273   8.907
  450   2HB   ALA  18          2HB       ALA  18   5.295  -0.504   7.700
  451   3HB   ALA  18          3HB       ALA  18   4.804   1.029   8.420
  452    H    LEU  19           H        LEU  19   6.610  -1.037   5.751
  453    HA   LEU  19           HA       LEU  19   9.293  -1.729   6.441
  454   1HB   LEU  19          1HB       LEU  19   7.733  -2.538   3.967
  455   2HB   LEU  19          2HB       LEU  19   9.141  -3.371   4.619
  456    HG   LEU  19           HG       LEU  19   6.595  -2.947   6.208
  457   1HD1  LEU  19          1HD1      LEU  19   5.955  -4.288   4.325
  458   2HD1  LEU  19          2HD1      LEU  19   6.199  -5.403   5.671
  459   3HD1  LEU  19          3HD1      LEU  19   7.435  -5.243   4.421
  460   1HD2  LEU  19          1HD2      LEU  19   9.095  -4.621   6.560
  461   2HD2  LEU  19          2HD2      LEU  19   7.600  -5.009   7.408
  462   3HD2  LEU  19          3HD2      LEU  19   8.391  -3.460   7.684
  463    H    PHE  20           H        PHE  20   7.975   0.159   3.756
  464    HA   PHE  20           HA       PHE  20  10.397   0.294   2.230
  465   1HB   PHE  20          1HB       PHE  20   8.234   0.924   1.272
  466   2HB   PHE  20          2HB       PHE  20   8.093   2.258   2.416
  467    HD1  PHE  20           HD1      PHE  20   9.484   4.255   2.209
  468    HD2  PHE  20           HD2      PHE  20   9.822   1.015  -0.588
  469    HE1  PHE  20           HE1      PHE  20  10.780   5.713   0.679
  470    HE2  PHE  20           HE2      PHE  20  11.117   2.472  -2.120
  471    HZ   PHE  20           HZ       PHE  20  11.597   4.822  -1.486
  472    H    LEU  21           H        LEU  21   9.012   2.619   4.584
  473    HA   LEU  21           HA       LEU  21  11.244   4.410   4.513
  474   1HB   LEU  21          1HB       LEU  21   9.243   3.884   6.730
  475   2HB   LEU  21          2HB       LEU  21  10.343   5.258   6.678
  476    HG   LEU  21           HG       LEU  21   8.337   4.644   4.487
  477   1HD1  LEU  21          1HD1      LEU  21   8.119   6.469   6.897
  478   2HD1  LEU  21          2HD1      LEU  21   7.086   5.094   6.509
  479   3HD1  LEU  21          3HD1      LEU  21   7.037   6.545   5.508
  480   1HD2  LEU  21          1HD2      LEU  21   9.974   6.084   3.578
  481   2HD2  LEU  21          2HD2      LEU  21  10.210   6.936   5.102
  482   3HD2  LEU  21          3HD2      LEU  21   8.751   7.211   4.155
  483    H    ARG  22           H        ARG  22  10.594   1.528   6.468
  484    HA   ARG  22           HA       ARG  22  12.645   1.840   8.392
  485   1HB   ARG  22          1HB       ARG  22  10.880   0.026   8.349
  486   2HB   ARG  22          2HB       ARG  22  11.842  -0.788   7.114
  487   1HG   ARG  22          1HG       ARG  22  13.795  -0.720   8.723
  488   2HG   ARG  22          2HG       ARG  22  12.672  -0.147   9.956
  489   1HD   ARG  22          1HD       ARG  22  12.892  -2.562  10.157
  490   2HD   ARG  22          2HD       ARG  22  11.275  -2.184   9.562
  491    HE   ARG  22           HE       ARG  22  12.734  -2.571   7.249
  492   1HH1  ARG  22          1HH1      ARG  22  12.227  -4.312  10.181
  493   2HH1  ARG  22          2HH1      ARG  22  12.376  -5.868   9.438
  494   1HH2  ARG  22          1HH2      ARG  22  12.935  -4.594   6.262
  495   2HH2  ARG  22          2HH2      ARG  22  12.778  -6.028   7.219
  496    H    VAL  23           H        VAL  23  12.814   0.418   5.125
  497    HA   VAL  23           HA       VAL  23  15.606  -0.284   5.327
  498    HB   VAL  23           HB       VAL  23  13.918   0.246   2.865
  499   1HG1  VAL  23          1HG1      VAL  23  15.637  -1.255   1.793
  500   2HG1  VAL  23          2HG1      VAL  23  16.585  -1.137   3.275
  501   3HG1  VAL  23          3HG1      VAL  23  16.276   0.305   2.309
  502   1HG2  VAL  23          1HG2      VAL  23  14.559  -2.313   4.368
  503   2HG2  VAL  23          2HG2      VAL  23  13.682  -2.226   2.840
  504   3HG2  VAL  23          3HG2      VAL  23  12.985  -1.521   4.299
  505    H    LYS  24           H        LYS  24  13.893   2.650   4.446
  506    HA   LYS  24           HA       LYS  24  16.007   3.984   3.085
  507   1HB   LYS  24          1HB       LYS  24  13.586   4.740   3.275
  508   2HB   LYS  24          2HB       LYS  24  13.969   5.295   4.900
  509   1HG   LYS  24          1HG       LYS  24  14.315   7.243   3.649
  510   2HG   LYS  24          2HG       LYS  24  15.942   6.576   3.725
  511   1HD   LYS  24          1HD       LYS  24  15.728   5.637   1.496
  512   2HD   LYS  24          2HD       LYS  24  14.021   6.074   1.428
  513   1HE   LYS  24          1HE       LYS  24  14.665   8.473   1.632
  514   2HE   LYS  24          2HE       LYS  24  16.361   7.992   1.580
  515   1HZ   LYS  24          1HZ       LYS  24  16.076   8.293  -0.614
  516   2HZ   LYS  24          2HZ       LYS  24  14.391   8.081  -0.549
  517   3HZ   LYS  24          3HZ       LYS  24  15.421   6.729  -0.561
  518    H    PHE  25           H        PHE  25  15.074   4.201   6.541
  519    HA   PHE  25           HA       PHE  25  17.431   5.727   7.236
  520   1HB   PHE  25          1HB       PHE  25  15.443   4.171   8.910
  521   2HB   PHE  25          2HB       PHE  25  16.757   5.123   9.600
  522    HD1  PHE  25           HD1      PHE  25  13.402   5.222   8.362
  523    HD2  PHE  25           HD2      PHE  25  16.945   7.601   8.844
  524    HE1  PHE  25           HE1      PHE  25  12.046   7.287   8.134
  525    HE2  PHE  25           HE2      PHE  25  15.589   9.666   8.616
  526    HZ   PHE  25           HZ       PHE  25  13.140   9.509   8.263
  527    H    SER  26           H        SER  26  16.608   2.283   7.284
  528    HA   SER  26           HA       SER  26  18.868   1.372   8.761
  529   1HB   SER  26          1HB       SER  26  16.797   0.040   7.978
  530   2HB   SER  26          2HB       SER  26  17.652  -0.152   6.451
  531    HG   SER  26           HG       SER  26  18.148  -1.253   8.943
  532    H    ARG  27           H        ARG  27  18.424   1.727   5.227
  533    HA   ARG  27           HA       ARG  27  20.029   1.734   3.504
  534   1HB   ARG  27          1HB       ARG  27  20.349   3.962   4.598
  535   2HB   ARG  27          2HB       ARG  27  21.607   3.245   5.606
  536   1HG   ARG  27          1HG       ARG  27  22.916   2.669   3.622
  537   2HG   ARG  27          2HG       ARG  27  21.640   3.291   2.575
  538   1HD   ARG  27          1HD       ARG  27  23.333   5.009   2.778
  539   2HD   ARG  27          2HD       ARG  27  21.917   5.532   3.689
  540    HE   ARG  27           HE       ARG  27  23.474   4.210   5.567
  541   1HH1  ARG  27          1HH1      ARG  27  23.913   6.757   3.285
  542   2HH1  ARG  27          2HH1      ARG  27  25.098   7.585   4.237
  543   1HH2  ARG  27          1HH2      ARG  27  25.020   5.276   6.823
  544   2HH2  ARG  27          2HH2      ARG  27  25.727   6.746   6.240
  545    H    SER  28           H        SER  28  20.629  -0.461   3.365
  546    HA   SER  28           HA       SER  28  23.305  -1.091   4.500
  547   1HB   SER  28          1HB       SER  28  21.019  -3.061   4.706
  548   2HB   SER  28          2HB       SER  28  22.618  -3.179   5.434
  549    HG   SER  28           HG       SER  28  20.411  -1.611   6.153
  550    H    ALA  29           H        ALA  29  24.315  -2.921   3.362
  551    HA   ALA  29           HA       ALA  29  23.821  -2.842   0.527
  552   1HB   ALA  29          1HB       ALA  29  25.585  -4.495   0.359
  553   2HB   ALA  29          2HB       ALA  29  25.415  -4.913   2.064
  554   3HB   ALA  29          3HB       ALA  29  26.046  -3.332   1.602
  555    H    ASP  30           H        ASP  30  22.841  -4.393  -0.803
  556    HA   ASP  30           HA       ASP  30  21.075  -5.875  -1.291
  557   1HB   ASP  30          1HB       ASP  30  21.580  -8.149  -0.676
  558   2HB   ASP  30          2HB       ASP  30  23.113  -7.328  -0.962
  Start of MODEL   14
    1   1H    ASP  -3          1H        ASP  -3 -24.298   7.582  -8.606
    2    HA   ASP  -3           HA       ASP  -3 -22.023   7.761  -7.387
    3   1HB   ASP  -3          1HB       ASP  -3 -24.727   7.453  -6.050
    4   2HB   ASP  -3          2HB       ASP  -3 -23.308   8.128  -5.250
    5    H    SER  -2           H        SER  -2 -24.038   4.892  -7.047
    6    HA   SER  -2           HA       SER  -2 -22.758   3.731  -4.785
    7   1HB   SER  -2          1HB       SER  -2 -24.093   2.466  -7.189
    8   2HB   SER  -2          2HB       SER  -2 -23.525   1.539  -5.803
    9    HG   SER  -2           HG       SER  -2 -25.571   3.470  -5.969
   10    H    LYS  -1           H        LYS  -1 -21.815   3.895  -8.170
   11    HA   LYS  -1           HA       LYS  -1 -19.653   1.951  -7.869
   12   1HB   LYS  -1          1HB       LYS  -1 -20.013   4.006 -10.070
   13   2HB   LYS  -1          2HB       LYS  -1 -19.091   2.505 -10.148
   14   1HG   LYS  -1          1HG       LYS  -1 -21.206   1.232  -9.774
   15   2HG   LYS  -1          2HG       LYS  -1 -22.095   2.753  -9.835
   16   1HD   LYS  -1          1HD       LYS  -1 -21.192   3.157 -12.122
   17   2HD   LYS  -1          2HD       LYS  -1 -20.404   1.580 -12.060
   18   1HE   LYS  -1          1HE       LYS  -1 -22.458   1.202 -13.204
   19   2HE   LYS  -1          2HE       LYS  -1 -22.727   0.610 -11.565
   20   1HZ   LYS  -1          1HZ       LYS  -1 -23.422   3.359 -12.426
   21   2HZ   LYS  -1          2HZ       LYS  -1 -23.889   2.566 -10.998
   22   3HZ   LYS  -1          3HZ       LYS  -1 -24.519   2.066 -12.495
   23    H    LEU   1           H        LEU   1 -19.993   4.809  -6.447
   24    HA   LEU   1           HA       LEU   1 -17.566   6.201  -7.159
   25   1HB   LEU   1          1HB       LEU   1 -19.504   7.296  -6.038
   26   2HB   LEU   1          2HB       LEU   1 -19.174   6.349  -4.590
   27    HG   LEU   1           HG       LEU   1 -16.903   7.373  -4.470
   28   1HD1  LEU   1          1HD1      LEU   1 -16.296   8.051  -6.621
   29   2HD1  LEU   1          2HD1      LEU   1 -16.781   9.588  -5.915
   30   3HD1  LEU   1          3HD1      LEU   1 -17.889   8.719  -6.977
   31   1HD2  LEU   1          1HD2      LEU   1 -19.340   9.167  -4.501
   32   2HD2  LEU   1          2HD2      LEU   1 -17.767   9.726  -3.932
   33   3HD2  LEU   1          3HD2      LEU   1 -18.579   8.393  -3.110
   34    H    CYS   2           H        CYS   2 -18.401   3.796  -4.693
   35    HA   CYS   2           HA       CYS   2 -16.033   3.902  -3.151
   36   1HB   CYS   2          1HB       CYS   2 -17.831   2.535  -2.361
   37   2HB   CYS   2          2HB       CYS   2 -17.867   1.600  -3.854
   38    H    TYR   3           H        TYR   3 -16.650   2.430  -6.292
   39    HA   TYR   3           HA       TYR   3 -14.329   0.799  -6.464
   40   1HB   TYR   3          1HB       TYR   3 -16.280   0.889  -8.105
   41   2HB   TYR   3          2HB       TYR   3 -15.528   2.334  -8.781
   42    HD1  TYR   3           HD1      TYR   3 -13.596   2.191 -10.191
   43    HD2  TYR   3           HD2      TYR   3 -15.019  -1.288  -8.110
   44    HE1  TYR   3           HE1      TYR   3 -12.058   0.766 -11.517
   45    HE2  TYR   3           HE2      TYR   3 -13.481  -2.710  -9.437
   46    HH   TYR   3           HH       TYR   3 -12.309  -2.223 -12.036
   47    H    LEU   4           H        LEU   4 -14.741   4.264  -6.733
   48    HA   LEU   4           HA       LEU   4 -12.204   4.782  -8.018
   49   1HB   LEU   4          1HB       LEU   4 -13.984   6.459  -8.068
   50   2HB   LEU   4          2HB       LEU   4 -13.982   6.552  -6.308
   51    HG   LEU   4           HG       LEU   4 -11.717   7.462  -6.314
   52   1HD1  LEU   4          1HD1      LEU   4 -10.805   8.102  -8.686
   53   2HD1  LEU   4          2HD1      LEU   4 -11.874   6.820  -9.258
   54   3HD1  LEU   4          3HD1      LEU   4 -10.587   6.450  -8.110
   55   1HD2  LEU   4          1HD2      LEU   4 -12.173   9.603  -7.437
   56   2HD2  LEU   4          2HD2      LEU   4 -13.623   9.019  -6.620
   57   3HD2  LEU   4          3HD2      LEU   4 -13.467   8.850  -8.369
   58    H    LEU   5           H        LEU   5 -13.293   4.702  -4.628
   59    HA   LEU   5           HA       LEU   5 -10.830   5.556  -3.462
   60   1HB   LEU   5          1HB       LEU   5 -13.161   3.916  -2.470
   61   2HB   LEU   5          2HB       LEU   5 -11.731   4.120  -1.459
   62    HG   LEU   5           HG       LEU   5 -11.965   6.601  -1.714
   63   1HD1  LEU   5          1HD1      LEU   5 -14.477   5.749  -3.172
   64   2HD1  LEU   5          2HD1      LEU   5 -13.184   6.790  -3.768
   65   3HD1  LEU   5          3HD1      LEU   5 -14.266   7.366  -2.500
   66   1HD2  LEU   5          1HD2      LEU   5 -14.376   5.123  -0.616
   67   2HD2  LEU   5          2HD2      LEU   5 -13.941   6.786  -0.222
   68   3HD2  LEU   5          3HD2      LEU   5 -12.882   5.460   0.258
   69    H    ASP   6           H        ASP   6 -12.052   2.292  -4.231
   70    HA   ASP   6           HA       ASP   6  -9.774   0.878  -3.229
   71   1HB   ASP   6          1HB       ASP   6 -11.697   0.143  -5.459
   72   2HB   ASP   6          2HB       ASP   6 -10.556  -0.970  -4.704
   73    H    GLY   7           H        GLY   7 -10.472   2.340  -6.380
   74   1HA   GLY   7          1HA       GLY   7  -8.261   1.266  -7.809
   75   2HA   GLY   7          2HA       GLY   7  -9.049   2.798  -8.188
   76    H    ILE   8           H        ILE   8  -8.514   4.384  -6.054
   77    HA   ILE   8           HA       ILE   8  -5.800   5.157  -6.456
   78    HB   ILE   8           HB       ILE   8  -7.591   5.808  -4.095
   79   1HG1  ILE   8          1HG1      ILE   8  -7.213   7.277  -6.726
   80   2HG1  ILE   8          2HG1      ILE   8  -8.618   6.291  -6.322
   81   1HG2  ILE   8          1HG2      ILE   8  -5.217   6.391  -3.753
   82   2HG2  ILE   8          2HG2      ILE   8  -6.196   7.843  -3.952
   83   3HG2  ILE   8          3HG2      ILE   8  -5.206   7.257  -5.290
   84   1HD1  ILE   8          1HD1      ILE   8  -9.303   8.483  -5.776
   85   2HD1  ILE   8          2HD1      ILE   8  -7.736   8.897  -5.086
   86   3HD1  ILE   8          3HD1      ILE   8  -8.817   7.805  -4.222
   87    H    LEU   9           H        LEU   9  -7.309   3.549  -3.628
   88    HA   LEU   9           HA       LEU   9  -4.861   3.154  -2.213
   89   1HB   LEU   9          1HB       LEU   9  -7.342   1.411  -2.144
   90   2HB   LEU   9          2HB       LEU   9  -6.095   1.497  -0.904
   91    HG   LEU   9           HG       LEU   9  -7.687   3.920  -1.773
   92   1HD1  LEU   9          1HD1      LEU   9  -8.272   1.917   0.423
   93   2HD1  LEU   9          2HD1      LEU   9  -9.307   2.335  -0.942
   94   3HD1  LEU   9          3HD1      LEU   9  -9.012   3.515   0.335
   95   1HD2  LEU   9          1HD2      LEU   9  -5.899   3.246   0.581
   96   2HD2  LEU   9          2HD2      LEU   9  -7.010   4.614   0.607
   97   3HD2  LEU   9          3HD2      LEU   9  -5.715   4.559  -0.584
   98    H    PHE  10           H        PHE  10  -6.586   1.097  -4.552
   99    HA   PHE  10           HA       PHE  10  -4.818  -1.141  -4.368
  100   1HB   PHE  10          1HB       PHE  10  -7.015  -1.277  -5.472
  101   2HB   PHE  10          2HB       PHE  10  -6.455  -0.182  -6.736
  102    HD1  PHE  10           HD1      PHE  10  -5.828  -3.500  -5.159
  103    HD2  PHE  10           HD2      PHE  10  -5.174  -0.980  -8.574
  104    HE1  PHE  10           HE1      PHE  10  -4.861  -5.423  -6.392
  105    HE2  PHE  10           HE2      PHE  10  -4.205  -2.902  -9.808
  106    HZ   PHE  10           HZ       PHE  10  -4.048  -5.124  -8.716
  107    H    ILE  11           H        ILE  11  -4.895   1.502  -6.793
  108    HA   ILE  11           HA       ILE  11  -2.533   0.755  -8.160
  109    HB   ILE  11           HB       ILE  11  -3.703   3.508  -7.660
  110   1HG1  ILE  11          1HG1      ILE  11  -3.795   1.782 -10.146
  111   2HG1  ILE  11          2HG1      ILE  11  -5.056   1.741  -8.913
  112   1HG2  ILE  11          1HG2      ILE  11  -1.470   2.568  -9.472
  113   2HG2  ILE  11          2HG2      ILE  11  -1.417   3.858  -8.271
  114   3HG2  ILE  11          3HG2      ILE  11  -2.350   4.070  -9.754
  115   1HD1  ILE  11          1HD1      ILE  11  -5.485   3.317 -10.870
  116   2HD1  ILE  11          2HD1      ILE  11  -4.163   4.304 -10.248
  117   3HD1  ILE  11          3HD1      ILE  11  -5.605   4.043  -9.267
  118    H    TYR  12           H        TYR  12  -2.963   2.728  -5.241
  119    HA   TYR  12           HA       TYR  12  -0.282   3.600  -4.925
  120   1HB   TYR  12          1HB       TYR  12  -2.146   4.418  -3.524
  121   2HB   TYR  12          2HB       TYR  12  -2.275   2.828  -2.771
  122    HD1  TYR  12           HD1      TYR  12  -0.259   5.896  -3.040
  123    HD2  TYR  12           HD2      TYR  12  -0.553   2.009  -1.234
  124    HE1  TYR  12           HE1      TYR  12   1.510   6.516  -1.414
  125    HE2  TYR  12           HE2      TYR  12   1.215   2.630   0.391
  126    HH   TYR  12           HH       TYR  12   3.207   5.308   0.006
  127    H    GLY  13           H        GLY  13  -1.841   0.553  -3.964
  128   1HA   GLY  13          1HA       GLY  13   0.372  -0.520  -2.518
  129   2HA   GLY  13          2HA       GLY  13  -0.894  -1.481  -3.281
  130    H    VAL  14           H        VAL  14  -0.499  -0.767  -5.973
  131    HA   VAL  14           HA       VAL  14   1.675  -2.500  -6.677
  132    HB   VAL  14           HB       VAL  14   0.112  -0.504  -8.342
  133   1HG1  VAL  14          1HG1      VAL  14   2.141  -2.620  -9.088
  134   2HG1  VAL  14          2HG1      VAL  14   2.142  -0.913  -9.531
  135   3HG1  VAL  14          3HG1      VAL  14   0.954  -2.007 -10.239
  136   1HG2  VAL  14          1HG2      VAL  14  -0.100  -3.508  -7.963
  137   2HG2  VAL  14          2HG2      VAL  14  -1.044  -2.571  -9.119
  138   3HG2  VAL  14          3HG2      VAL  14  -1.252  -2.303  -7.388
  139    H    ILE  15           H        ILE  15   1.359   1.057  -6.724
  140    HA   ILE  15           HA       ILE  15   3.995   1.493  -7.807
  141    HB   ILE  15           HB       ILE  15   2.236   3.338  -6.160
  142   1HG1  ILE  15          1HG1      ILE  15   2.636   3.141  -9.163
  143   2HG1  ILE  15          2HG1      ILE  15   1.248   2.480  -8.301
  144   1HG2  ILE  15          1HG2      ILE  15   3.624   5.124  -7.262
  145   2HG2  ILE  15          2HG2      ILE  15   4.682   3.858  -7.881
  146   3HG2  ILE  15          3HG2      ILE  15   4.543   4.120  -6.143
  147   1HD1  ILE  15          1HD1      ILE  15   2.065   5.391  -8.486
  148   2HD1  ILE  15          2HD1      ILE  15   0.805   4.798  -7.404
  149   3HD1  ILE  15          3HD1      ILE  15   0.611   4.649  -9.151
  150    H    LEU  16           H        LEU  16   2.718   1.417  -4.478
  151    HA   LEU  16           HA       LEU  16   5.226   2.135  -3.264
  152   1HB   LEU  16          1HB       LEU  16   2.713   2.002  -2.317
  153   2HB   LEU  16          2HB       LEU  16   3.255   0.419  -1.785
  154    HG   LEU  16           HG       LEU  16   3.675   1.941   0.020
  155   1HD1  LEU  16          1HD1      LEU  16   6.380   1.735  -1.295
  156   2HD1  LEU  16          2HD1      LEU  16   5.524   0.299  -0.737
  157   3HD1  LEU  16          3HD1      LEU  16   5.961   1.564   0.408
  158   1HD2  LEU  16          1HD2      LEU  16   5.471   3.717  -1.615
  159   2HD2  LEU  16          2HD2      LEU  16   4.558   4.081  -0.155
  160   3HD2  LEU  16          3HD2      LEU  16   3.728   3.972  -1.703
  161    H    THR  17           H        THR  17   3.693  -0.984  -4.020
  162    HA   THR  17           HA       THR  17   5.770  -2.574  -2.792
  163    HB   THR  17           HB       THR  17   3.894  -3.371  -5.039
  164    HG1  THR  17           HG1      THR  17   3.133  -2.472  -2.836
  165   1HG2  THR  17          1HG2      THR  17   5.765  -4.926  -4.610
  166   2HG2  THR  17          2HG2      THR  17   4.223  -5.633  -4.127
  167   3HG2  THR  17          3HG2      THR  17   5.317  -4.987  -2.904
  168    H    ALA  18           H        ALA  18   5.254  -1.297  -6.057
  169    HA   ALA  18           HA       ALA  18   7.319  -2.746  -7.373
  170   1HB   ALA  18          1HB       ALA  18   6.129  -0.012  -7.879
  171   2HB   ALA  18          2HB       ALA  18   5.774  -1.520  -8.721
  172   3HB   ALA  18          3HB       ALA  18   7.336  -0.733  -8.943
  173    H    LEU  19           H        LEU  19   7.433   0.459  -5.787
  174    HA   LEU  19           HA       LEU  19  10.248   0.854  -6.245
  175   1HB   LEU  19          1HB       LEU  19   8.506   1.983  -4.033
  176   2HB   LEU  19          2HB       LEU  19  10.068   2.616  -4.541
  177    HG   LEU  19           HG       LEU  19   7.664   2.391  -6.376
  178   1HD1  LEU  19          1HD1      LEU  19   7.341   4.778  -6.032
  179   2HD1  LEU  19          2HD1      LEU  19   8.740   4.847  -4.960
  180   3HD1  LEU  19          3HD1      LEU  19   7.295   3.967  -4.465
  181   1HD2  LEU  19          1HD2      LEU  19   9.600   2.508  -7.731
  182   2HD2  LEU  19          2HD2      LEU  19  10.433   3.586  -6.612
  183   3HD2  LEU  19          3HD2      LEU  19   9.106   4.194  -7.601
  184    H    PHE  20           H        PHE  20   8.424  -0.780  -3.708
  185    HA   PHE  20           HA       PHE  20  10.574  -1.032  -1.834
  186   1HB   PHE  20          1HB       PHE  20   8.226  -1.511  -1.242
  187   2HB   PHE  20          2HB       PHE  20   8.234  -2.901  -2.327
  188    HD1  PHE  20           HD1      PHE  20   9.438  -1.553   0.878
  189    HD2  PHE  20           HD2      PHE  20   9.528  -4.910  -1.797
  190    HE1  PHE  20           HE1      PHE  20  10.397  -2.963   2.679
  191    HE2  PHE  20           HE2      PHE  20  10.485  -6.321   0.002
  192    HZ   PHE  20           HZ       PHE  20  10.921  -5.348   2.241
  193    H    LEU  21           H        LEU  21   9.409  -3.327  -4.332
  194    HA   LEU  21           HA       LEU  21  11.490  -5.246  -3.893
  195   1HB   LEU  21          1HB       LEU  21   9.877  -4.652  -6.391
  196   2HB   LEU  21          2HB       LEU  21  10.880  -6.083  -6.165
  197    HG   LEU  21           HG       LEU  21   8.603  -5.315  -4.314
  198   1HD1  LEU  21          1HD1      LEU  21   8.615  -7.367  -6.548
  199   2HD1  LEU  21          2HD1      LEU  21   7.821  -5.793  -6.633
  200   3HD1  LEU  21          3HD1      LEU  21   7.269  -6.999  -5.470
  201   1HD2  LEU  21          1HD2      LEU  21   8.850  -7.907  -3.886
  202   2HD2  LEU  21          2HD2      LEU  21   9.971  -6.797  -3.107
  203   3HD2  LEU  21          3HD2      LEU  21  10.467  -7.680  -4.549
  204    H    ARG  22           H        ARG  22  11.281  -2.411  -6.017
  205    HA   ARG  22           HA       ARG  22  13.630  -2.879  -7.535
  206   1HB   ARG  22          1HB       ARG  22  11.911  -1.036  -7.890
  207   2HB   ARG  22          2HB       ARG  22  12.706  -0.158  -6.583
  208   1HG   ARG  22          1HG       ARG  22  14.826  -0.194  -7.805
  209   2HG   ARG  22          2HG       ARG  22  14.089  -1.145  -9.096
  210   1HD   ARG  22          1HD       ARG  22  13.228   1.643  -8.265
  211   2HD   ARG  22          2HD       ARG  22  14.189   1.255  -9.691
  212    HE   ARG  22           HE       ARG  22  11.915  -0.311  -9.969
  213   1HH1  ARG  22          1HH1      ARG  22  12.625   3.020  -9.437
  214   2HH1  ARG  22          2HH1      ARG  22  11.214   3.592 -10.262
  215   1HH2  ARG  22          1HH2      ARG  22  10.067   0.415 -11.052
  216   2HH2  ARG  22          2HH2      ARG  22   9.765   2.115 -11.177
  217    H    VAL  23           H        VAL  23  13.216  -1.395  -4.333
  218    HA   VAL  23           HA       VAL  23  16.032  -0.719  -4.067
  219    HB   VAL  23           HB       VAL  23  13.814  -0.964  -2.013
  220   1HG1  VAL  23          1HG1      VAL  23  16.678  -0.014  -1.810
  221   2HG1  VAL  23          2HG1      VAL  23  15.864  -1.225  -0.821
  222   3HG1  VAL  23          3HG1      VAL  23  15.439   0.479  -0.656
  223   1HG2  VAL  23          1HG2      VAL  23  13.628   0.812  -3.814
  224   2HG2  VAL  23          2HG2      VAL  23  15.129   1.499  -3.193
  225   3HG2  VAL  23          3HG2      VAL  23  13.696   1.441  -2.167
  226    H    LYS  24           H        LYS  24  14.051  -3.524  -3.354
  227    HA   LYS  24           HA       LYS  24  15.639  -4.877  -1.479
  228   1HB   LYS  24          1HB       LYS  24  13.442  -5.680  -2.408
  229   2HB   LYS  24          2HB       LYS  24  14.294  -6.163  -3.875
  230   1HG   LYS  24          1HG       LYS  24  15.787  -7.609  -2.475
  231   2HG   LYS  24          2HG       LYS  24  14.802  -7.198  -1.070
  232   1HD   LYS  24          1HD       LYS  24  12.817  -8.151  -2.161
  233   2HD   LYS  24          2HD       LYS  24  13.775  -8.535  -3.591
  234   1HE   LYS  24          1HE       LYS  24  15.239  -9.981  -2.181
  235   2HE   LYS  24          2HE       LYS  24  14.189  -9.654  -0.803
  236   1HZ   LYS  24          1HZ       LYS  24  12.367 -10.674  -1.914
  237   2HZ   LYS  24          2HZ       LYS  24  13.681 -11.749  -1.999
  238   3HZ   LYS  24          3HZ       LYS  24  13.243 -10.828  -3.358
  239    H    PHE  25           H        PHE  25  16.073  -4.654  -5.003
  240    HA   PHE  25           HA       PHE  25  18.572  -6.249  -4.822
  241   1HB   PHE  25          1HB       PHE  25  17.214  -4.990  -7.228
  242   2HB   PHE  25          2HB       PHE  25  18.563  -6.128  -7.270
  243    HD1  PHE  25           HD1      PHE  25  14.966  -5.740  -6.909
  244    HD2  PHE  25           HD2      PHE  25  18.245  -8.471  -6.417
  245    HE1  PHE  25           HE1      PHE  25  13.371  -7.637  -6.806
  246    HE2  PHE  25           HE2      PHE  25  16.649 -10.368  -6.314
  247    HZ   PHE  25           HZ       PHE  25  14.213  -9.951  -6.509
  248    H    SER  26           H        SER  26  20.492  -5.240  -4.543
  249    HA   SER  26           HA       SER  26  20.653  -2.320  -4.643
  250   1HB   SER  26          1HB       SER  26  22.700  -4.478  -4.075
  251   2HB   SER  26          2HB       SER  26  23.077  -2.758  -4.050
  252    HG   SER  26           HG       SER  26  20.995  -3.968  -2.545
  253    H    ARG  27           H        ARG  27  21.503  -1.109  -6.302
  254    HA   ARG  27           HA       ARG  27  22.147  -0.668  -8.527
  255   1HB   ARG  27          1HB       ARG  27  24.171  -2.782  -7.731
  256   2HB   ARG  27          2HB       ARG  27  24.332  -1.701  -9.116
  257   1HG   ARG  27          1HG       ARG  27  24.247   0.251  -7.606
  258   2HG   ARG  27          2HG       ARG  27  24.095  -0.830  -6.220
  259   1HD   ARG  27          1HD       ARG  27  26.280  -1.824  -6.727
  260   2HD   ARG  27          2HD       ARG  27  26.431  -0.799  -8.153
  261    HE   ARG  27           HE       ARG  27  26.052   1.007  -6.091
  262   1HH1  ARG  27          1HH1      ARG  27  28.159  -1.645  -6.734
  263   2HH1  ARG  27          2HH1      ARG  27  29.483  -0.984  -5.835
  264   1HH2  ARG  27          1HH2      ARG  27  27.769   1.886  -4.914
  265   2HH2  ARG  27          2HH2      ARG  27  29.263   1.017  -4.804
  266    H    SER  28           H        SER  28  23.603  -3.506  -9.480
  267    HA   SER  28           HA       SER  28  22.984  -5.094 -11.097
  268   1HB   SER  28          1HB       SER  28  21.906  -6.354  -9.454
  269   2HB   SER  28          2HB       SER  28  20.750  -5.076  -9.093
  270    HG   SER  28           HG       SER  28  20.810  -6.895 -11.247
  271    H    ALA  29           H        ALA  29  21.038  -5.647 -12.681
  272    HA   ALA  29           HA       ALA  29  19.763  -4.886 -14.494
  273   1HB   ALA  29          1HB       ALA  29  18.318  -4.201 -12.480
  274   2HB   ALA  29          2HB       ALA  29  18.020  -3.347 -13.993
  275   3HB   ALA  29          3HB       ALA  29  18.959  -2.576 -12.717
  276    H    ASP  30           H        ASP  30  22.434  -3.353 -13.412
  277    HA   ASP  30           HA       ASP  30  22.288  -0.842 -14.859
  278   1HB   ASP  30          1HB       ASP  30  24.693  -0.690 -14.424
  279   2HB   ASP  30          2HB       ASP  30  23.862  -1.229 -12.964
  280   1H    ASP  -3          1H        ASP  -3 -21.505   5.824   2.340
  281    HA   ASP  -3           HA       ASP  -3 -21.583   3.998   0.150
  282   1HB   ASP  -3          1HB       ASP  -3 -19.609   5.283   1.067
  283   2HB   ASP  -3          2HB       ASP  -3 -19.660   4.229   2.481
  284    H    SER  -2           H        SER  -2 -21.397   1.688   0.317
  285    HA   SER  -2           HA       SER  -2 -23.080   0.528   2.388
  286   1HB   SER  -2          1HB       SER  -2 -22.940  -1.468   1.155
  287   2HB   SER  -2          2HB       SER  -2 -22.768  -0.232  -0.087
  288    HG   SER  -2           HG       SER  -2 -20.506  -0.499   0.080
  289    H    LYS  -1           H        LYS  -1 -22.372  -1.136   3.900
  290    HA   LYS  -1           HA       LYS  -1 -19.894  -0.469   5.218
  291   1HB   LYS  -1          1HB       LYS  -1 -20.444  -2.312   6.734
  292   2HB   LYS  -1          2HB       LYS  -1 -21.890  -1.353   6.414
  293   1HG   LYS  -1          1HG       LYS  -1 -22.459  -3.005   4.579
  294   2HG   LYS  -1          2HG       LYS  -1 -21.144  -4.016   5.181
  295   1HD   LYS  -1          1HD       LYS  -1 -22.268  -3.858   7.476
  296   2HD   LYS  -1          2HD       LYS  -1 -23.666  -3.192   6.630
  297   1HE   LYS  -1          1HE       LYS  -1 -24.101  -5.520   6.747
  298   2HE   LYS  -1          2HE       LYS  -1 -23.511  -5.265   5.105
  299   1HZ   LYS  -1          1HZ       LYS  -1 -22.217  -7.008   5.762
  300   2HZ   LYS  -1          2HZ       LYS  -1 -22.175  -6.527   7.391
  301   3HZ   LYS  -1          3HZ       LYS  -1 -21.221  -5.721   6.240
  302    H    LEU   1           H        LEU   1 -20.827  -2.896   2.857
  303    HA   LEU   1           HA       LEU   1 -18.613  -4.664   3.194
  304   1HB   LEU   1          1HB       LEU   1 -20.558  -5.283   1.841
  305   2HB   LEU   1          2HB       LEU   1 -20.211  -3.982   0.703
  306    HG   LEU   1           HG       LEU   1 -18.099  -5.052   0.073
  307   1HD1  LEU   1          1HD1      LEU   1 -17.290  -6.142   1.992
  308   2HD1  LEU   1          2HD1      LEU   1 -17.820  -7.491   0.993
  309   3HD1  LEU   1          3HD1      LEU   1 -18.835  -6.927   2.320
  310   1HD2  LEU   1          1HD2      LEU   1 -20.473  -6.941   0.081
  311   2HD2  LEU   1          2HD2      LEU   1 -19.049  -7.123  -0.945
  312   3HD2  LEU   1          3HD2      LEU   1 -20.107  -5.725  -1.143
  313    H    CYS   2           H        CYS   2 -19.017  -1.729   1.220
  314    HA   CYS   2           HA       CYS   2 -16.504  -1.868  -0.125
  315   1HB   CYS   2          1HB       CYS   2 -18.113  -0.296  -0.936
  316   2HB   CYS   2          2HB       CYS   2 -18.278   0.460   0.648
  317    H    TYR   3           H        TYR   3 -17.406  -0.626   3.060
  318    HA   TYR   3           HA       TYR   3 -14.965   0.716   3.660
  319   1HB   TYR   3          1HB       TYR   3 -17.110   0.796   5.011
  320   2HB   TYR   3          2HB       TYR   3 -16.683  -0.794   5.646
  321    HD1  TYR   3           HD1      TYR   3 -15.366   2.683   5.250
  322    HD2  TYR   3           HD2      TYR   3 -15.201  -0.986   7.478
  323    HE1  TYR   3           HE1      TYR   3 -13.873   3.759   6.910
  324    HE2  TYR   3           HE2      TYR   3 -13.708   0.091   9.139
  325    HH   TYR   3           HH       TYR   3 -13.195   3.477   9.226
  326    H    LEU   4           H        LEU   4 -15.812  -2.687   3.652
  327    HA   LEU   4           HA       LEU   4 -13.572  -3.592   5.223
  328   1HB   LEU   4          1HB       LEU   4 -15.616  -4.966   4.741
  329   2HB   LEU   4          2HB       LEU   4 -15.093  -5.089   3.065
  330    HG   LEU   4           HG       LEU   4 -12.928  -6.107   3.906
  331   1HD1  LEU   4          1HD1      LEU   4 -13.284  -7.202   6.258
  332   2HD1  LEU   4          2HD1      LEU   4 -14.447  -5.901   6.506
  333   3HD1  LEU   4          3HD1      LEU   4 -12.756  -5.524   6.178
  334   1HD2  LEU   4          1HD2      LEU   4 -15.569  -7.481   4.463
  335   2HD2  LEU   4          2HD2      LEU   4 -14.020  -8.323   4.416
  336   3HD2  LEU   4          3HD2      LEU   4 -14.637  -7.529   2.967
  337    H    LEU   5           H        LEU   5 -14.093  -3.149   1.731
  338    HA   LEU   5           HA       LEU   5 -11.577  -4.220   0.897
  339   1HB   LEU   5          1HB       LEU   5 -13.540  -2.280  -0.320
  340   2HB   LEU   5          2HB       LEU   5 -11.992  -2.579  -1.110
  341    HG   LEU   5           HG       LEU   5 -12.493  -5.016  -1.118
  342   1HD1  LEU   5          1HD1      LEU   5 -15.086  -4.048   0.107
  343   2HD1  LEU   5          2HD1      LEU   5 -13.965  -5.244   0.758
  344   3HD1  LEU   5          3HD1      LEU   5 -14.927  -5.622  -0.669
  345   1HD2  LEU   5          1HD2      LEU   5 -13.046  -3.844  -3.128
  346   2HD2  LEU   5          2HD2      LEU   5 -14.475  -3.118  -2.395
  347   3HD2  LEU   5          3HD2      LEU   5 -14.452  -4.843  -2.759
  348    H    ASP   6           H        ASP   6 -12.564  -0.858   1.617
  349    HA   ASP   6           HA       ASP   6 -10.026   0.332   1.112
  350   1HB   ASP   6          1HB       ASP   6 -12.200   1.143   3.066
  351   2HB   ASP   6          2HB       ASP   6 -10.832   2.161   2.613
  352    H    GLY   7           H        GLY   7 -11.358  -1.185   4.031
  353   1HA   GLY   7          1HA       GLY   7  -9.280  -0.465   5.827
  354   2HA   GLY   7          2HA       GLY   7 -10.277  -1.913   5.980
  355    H    ILE   8           H        ILE   8  -9.593  -3.383   3.772
  356    HA   ILE   8           HA       ILE   8  -7.038  -4.462   4.527
  357    HB   ILE   8           HB       ILE   8  -8.585  -4.917   1.958
  358   1HG1  ILE   8          1HG1      ILE   8  -8.681  -6.442   4.581
  359   2HG1  ILE   8          2HG1      ILE   8  -9.919  -5.308   4.042
  360   1HG2  ILE   8          1HG2      ILE   8  -6.514  -6.592   3.415
  361   2HG2  ILE   8          2HG2      ILE   8  -6.257  -5.732   1.897
  362   3HG2  ILE   8          3HG2      ILE   8  -7.387  -7.084   1.963
  363   1HD1  ILE   8          1HD1      ILE   8  -9.143  -7.953   2.807
  364   2HD1  ILE   8          2HD1      ILE   8 -10.056  -6.743   1.906
  365   3HD1  ILE   8          3HD1      ILE   8 -10.729  -7.439   3.380
  366    H    LEU   9           H        LEU   9  -8.029  -2.762   1.523
  367    HA   LEU   9           HA       LEU   9  -5.421  -2.592   0.416
  368   1HB   LEU   9          1HB       LEU   9  -7.666  -0.577   0.097
  369   2HB   LEU   9          2HB       LEU   9  -6.316  -0.826  -1.008
  370    HG   LEU   9           HG       LEU   9  -8.285  -3.023  -0.318
  371   1HD1  LEU   9          1HD1      LEU   9  -9.493  -1.126  -1.337
  372   2HD1  LEU   9          2HD1      LEU   9  -9.406  -2.493  -2.449
  373   3HD1  LEU   9          3HD1      LEU   9  -8.337  -1.107  -2.669
  374   1HD2  LEU   9          1HD2      LEU   9  -6.285  -3.921  -1.277
  375   2HD2  LEU   9          2HD2      LEU   9  -6.179  -2.619  -2.461
  376   3HD2  LEU   9          3HD2      LEU   9  -7.443  -3.838  -2.600
  377    H    PHE  10           H        PHE  10  -7.146  -0.365   2.601
  378    HA   PHE  10           HA       PHE  10  -5.146   1.674   2.623
  379   1HB   PHE  10          1HB       PHE  10  -7.410   2.022   3.534
  380   2HB   PHE  10          2HB       PHE  10  -7.074   0.866   4.824
  381    HD1  PHE  10           HD1      PHE  10  -6.194   1.654   6.854
  382    HD2  PHE  10           HD2      PHE  10  -5.678   3.988   3.284
  383    HE1  PHE  10           HE1      PHE  10  -5.157   3.467   8.190
  384    HE2  PHE  10           HE2      PHE  10  -4.640   5.801   4.621
  385    HZ   PHE  10           HZ       PHE  10  -4.380   5.540   7.074
  386    H    ILE  11           H        ILE  11  -5.719  -0.958   4.995
  387    HA   ILE  11           HA       ILE  11  -3.419  -0.492   6.575
  388    HB   ILE  11           HB       ILE  11  -4.852  -3.081   5.916
  389   1HG1  ILE  11          1HG1      ILE  11  -4.903  -1.399   8.435
  390   2HG1  ILE  11          2HG1      ILE  11  -6.068  -1.200   7.128
  391   1HG2  ILE  11          1HG2      ILE  11  -3.724  -3.844   8.088
  392   2HG2  ILE  11          2HG2      ILE  11  -2.637  -2.470   7.883
  393   3HG2  ILE  11          3HG2      ILE  11  -2.688  -3.743   6.664
  394   1HD1  ILE  11          1HD1      ILE  11  -5.558  -3.833   8.536
  395   2HD1  ILE  11          2HD1      ILE  11  -6.839  -3.480   7.377
  396   3HD1  ILE  11          3HD1      ILE  11  -6.859  -2.724   8.971
  397    H    TYR  12           H        TYR  12  -3.802  -2.438   3.624
  398    HA   TYR  12           HA       TYR  12  -1.214  -3.568   3.519
  399   1HB   TYR  12          1HB       TYR  12  -3.008  -4.167   1.931
  400   2HB   TYR  12          2HB       TYR  12  -2.909  -2.560   1.211
  401    HD1  TYR  12           HD1      TYR  12  -1.133  -5.770   1.693
  402    HD2  TYR  12           HD2      TYR  12  -1.088  -1.946  -0.263
  403    HE1  TYR  12           HE1      TYR  12   0.708  -6.543   0.223
  404    HE2  TYR  12           HE2      TYR  12   0.754  -2.717  -1.732
  405    HH   TYR  12           HH       TYR  12   2.352  -5.802  -1.204
  406    H    GLY  13           H        GLY  13  -2.349  -0.386   2.372
  407   1HA   GLY  13          1HA       GLY  13   0.190   0.419   1.292
  408   2HA   GLY  13          2HA       GLY  13  -1.125   1.512   1.729
  409    H    VAL  14           H        VAL  14  -1.300   0.791   4.495
  410    HA   VAL  14           HA       VAL  14   0.740   2.499   5.579
  411    HB   VAL  14           HB       VAL  14  -1.152   0.562   6.946
  412   1HG1  VAL  14          1HG1      VAL  14  -0.656   2.076   8.946
  413   2HG1  VAL  14          2HG1      VAL  14   0.730   2.669   8.030
  414   3HG1  VAL  14          3HG1      VAL  14   0.633   0.967   8.480
  415   1HG2  VAL  14          1HG2      VAL  14  -1.257   3.577   6.617
  416   2HG2  VAL  14          2HG2      VAL  14  -2.474   2.568   7.398
  417   3HG2  VAL  14          3HG2      VAL  14  -2.198   2.432   5.661
  418    H    ILE  15           H        ILE  15   0.293  -1.047   5.726
  419    HA   ILE  15           HA       ILE  15   2.656  -1.536   7.266
  420    HB   ILE  15           HB       ILE  15   1.233  -3.353   5.299
  421   1HG1  ILE  15          1HG1      ILE  15   0.993  -3.125   8.318
  422   2HG1  ILE  15          2HG1      ILE  15  -0.160  -2.435   7.177
  423   1HG2  ILE  15          1HG2      ILE  15   2.306  -5.154   6.698
  424   2HG2  ILE  15          2HG2      ILE  15   3.250  -3.899   7.499
  425   3HG2  ILE  15          3HG2      ILE  15   3.462  -4.197   5.774
  426   1HD1  ILE  15          1HD1      ILE  15  -0.581  -4.696   6.254
  427   2HD1  ILE  15          2HD1      ILE  15  -0.956  -4.616   7.976
  428   3HD1  ILE  15          3HD1      ILE  15   0.541  -5.374   7.433
  429    H    LEU  16           H        LEU  16   2.115  -1.333   3.753
  430    HA   LEU  16           HA       LEU  16   4.777  -2.187   3.059
  431   1HB   LEU  16          1HB       LEU  16   2.444  -1.619   1.648
  432   2HB   LEU  16          2HB       LEU  16   3.491  -0.296   1.167
  433    HG   LEU  16           HG       LEU  16   3.891  -1.978  -0.440
  434   1HD1  LEU  16          1HD1      LEU  16   6.140  -2.851   1.315
  435   2HD1  LEU  16          2HD1      LEU  16   5.976  -1.116   1.059
  436   3HD1  LEU  16          3HD1      LEU  16   6.161  -2.193  -0.319
  437   1HD2  LEU  16          1HD2      LEU  16   4.192  -4.021   1.785
  438   2HD2  LEU  16          2HD2      LEU  16   4.185  -4.334   0.052
  439   3HD2  LEU  16          3HD2      LEU  16   2.714  -3.784   0.851
  440    H    THR  17           H        THR  17   3.305   1.019   3.558
  441    HA   THR  17           HA       THR  17   5.624   2.548   2.889
  442    HB   THR  17           HB       THR  17   3.531   3.275   4.957
  443    HG1  THR  17           HG1      THR  17   2.510   2.684   3.052
  444   1HG2  THR  17          1HG2      THR  17   4.055   5.583   4.110
  445   2HG2  THR  17          2HG2      THR  17   5.369   4.883   3.166
  446   3HG2  THR  17          3HG2      THR  17   5.409   4.802   4.926
  447    H    ALA  18           H        ALA  18   4.569   1.060   5.934
  448    HA   ALA  18           HA       ALA  18   6.549   2.204   7.628
  449   1HB   ALA  18          1HB       ALA  18   5.072  -0.435   7.717
  450   2HB   ALA  18          2HB       ALA  18   4.755   1.018   8.664
  451   3HB   ALA  18          3HB       ALA  18   6.199   0.057   8.982
  452    H    LEU  19           H        LEU  19   6.588  -0.927   5.889
  453    HA   LEU  19           HA       LEU  19   9.296  -1.572   6.595
  454   1HB   LEU  19          1HB       LEU  19   7.748  -2.425   4.127
  455   2HB   LEU  19          2HB       LEU  19   9.164  -3.231   4.797
  456    HG   LEU  19           HG       LEU  19   6.598  -2.833   6.363
  457   1HD1  LEU  19          1HD1      LEU  19   7.489  -5.159   4.637
  458   2HD1  LEU  19          2HD1      LEU  19   6.023  -4.196   4.458
  459   3HD1  LEU  19          3HD1      LEU  19   6.207  -5.274   5.841
  460   1HD2  LEU  19          1HD2      LEU  19   9.115  -4.479   6.743
  461   2HD2  LEU  19          2HD2      LEU  19   7.619  -4.862   7.592
  462   3HD2  LEU  19          3HD2      LEU  19   8.402  -3.305   7.849
  463    H    PHE  20           H        PHE  20   7.895   0.337   3.976
  464    HA   PHE  20           HA       PHE  20  10.241   0.522   2.357
  465   1HB   PHE  20          1HB       PHE  20   8.040   1.268   1.551
  466   2HB   PHE  20          2HB       PHE  20   8.012   2.545   2.767
  467    HD1  PHE  20           HD1      PHE  20   9.521   4.475   2.609
  468    HD2  PHE  20           HD2      PHE  20   9.461   1.432  -0.426
  469    HE1  PHE  20           HE1      PHE  20  10.774   5.973   1.084
  470    HE2  PHE  20           HE2      PHE  20  10.719   2.931  -1.949
  471    HZ   PHE  20           HZ       PHE  20  11.375   5.201  -1.196
  472    H    LEU  21           H        LEU  21   9.037   2.725   4.911
  473    HA   LEU  21           HA       LEU  21  11.328   4.452   4.842
  474   1HB   LEU  21          1HB       LEU  21   9.441   3.874   7.146
  475   2HB   LEU  21          2HB       LEU  21  10.528   5.256   7.033
  476    HG   LEU  21           HG       LEU  21   8.431   4.678   4.926
  477   1HD1  LEU  21          1HD1      LEU  21   7.234   4.933   7.021
  478   2HD1  LEU  21          2HD1      LEU  21   7.062   6.427   6.099
  479   3HD1  LEU  21          3HD1      LEU  21   8.198   6.348   7.446
  480   1HD2  LEU  21          1HD2      LEU  21   8.700   7.229   4.675
  481   2HD2  LEU  21          2HD2      LEU  21  10.050   6.241   4.129
  482   3HD2  LEU  21          3HD2      LEU  21  10.136   7.069   5.682
  483    H    ARG  22           H        ARG  22  10.578   1.539   6.730
  484    HA   ARG  22           HA       ARG  22  12.749   1.623   8.536
  485   1HB   ARG  22          1HB       ARG  22  10.870  -0.053   8.562
  486   2HB   ARG  22          2HB       ARG  22  11.647  -0.868   7.206
  487   1HG   ARG  22          1HG       ARG  22  13.704  -1.141   8.586
  488   2HG   ARG  22          2HG       ARG  22  12.853  -0.414   9.950
  489   1HD   ARG  22          1HD       ARG  22  11.994  -2.931   8.493
  490   2HD   ARG  22          2HD       ARG  22  12.785  -2.884  10.068
  491    HE   ARG  22           HE       ARG  22  10.564  -1.267  10.403
  492   1HH1  ARG  22          1HH1      ARG  22  11.176  -4.454   9.242
  493   2HH1  ARG  22          2HH1      ARG  22   9.655  -5.086   9.778
  494   1HH2  ARG  22          1HH2      ARG  22   8.575  -2.076  11.114
  495   2HH2  ARG  22          2HH2      ARG  22   8.185  -3.740  10.842
  496    H    VAL  23           H        VAL  23  12.626   0.447   5.184
  497    HA   VAL  23           HA       VAL  23  15.268  -0.627   5.077
  498    HB   VAL  23           HB       VAL  23  13.566   0.663   2.923
  499   1HG1  VAL  23          1HG1      VAL  23  16.197  -0.828   2.782
  500   2HG1  VAL  23          2HG1      VAL  23  15.817   0.763   2.124
  501   3HG1  VAL  23          3HG1      VAL  23  15.116  -0.682   1.396
  502   1HG2  VAL  23          1HG2      VAL  23  14.186  -2.263   3.381
  503   2HG2  VAL  23          2HG2      VAL  23  12.925  -1.567   2.363
  504   3HG2  VAL  23          3HG2      VAL  23  12.794  -1.473   4.118
  505    H    LYS  24           H        LYS  24  14.048   2.676   4.669
  506    HA   LYS  24           HA       LYS  24  16.587   3.777   3.835
  507   1HB   LYS  24          1HB       LYS  24  14.079   5.004   5.002
  508   2HB   LYS  24          2HB       LYS  24  15.496   5.970   4.581
  509   1HG   LYS  24          1HG       LYS  24  15.389   5.026   2.263
  510   2HG   LYS  24          2HG       LYS  24  13.890   4.209   2.706
  511   1HD   LYS  24          1HD       LYS  24  12.782   6.314   3.116
  512   2HD   LYS  24          2HD       LYS  24  14.294   7.203   2.929
  513   1HE   LYS  24          1HE       LYS  24  13.044   5.528   0.737
  514   2HE   LYS  24          2HE       LYS  24  12.820   7.271   0.889
  515   1HZ   LYS  24          1HZ       LYS  24  14.630   6.670  -0.634
  516   2HZ   LYS  24          2HZ       LYS  24  15.449   5.910   0.646
  517   3HZ   LYS  24          3HZ       LYS  24  15.180   7.587   0.683
  518    H    PHE  25           H        PHE  25  14.984   3.376   6.981
  519    HA   PHE  25           HA       PHE  25  16.992   4.814   8.477
  520   1HB   PHE  25          1HB       PHE  25  14.892   2.770   9.231
  521   2HB   PHE  25          2HB       PHE  25  16.025   3.408  10.421
  522    HD1  PHE  25           HD1      PHE  25  12.894   3.945   8.828
  523    HD2  PHE  25           HD2      PHE  25  16.264   6.030  10.484
  524    HE1  PHE  25           HE1      PHE  25  11.508   5.984   9.083
  525    HE2  PHE  25           HE2      PHE  25  14.878   8.069  10.739
  526    HZ   PHE  25           HZ       PHE  25  12.499   8.046  10.039
  527    H    SER  26           H        SER  26  16.656   1.486   7.377
  528    HA   SER  26           HA       SER  26  18.688   0.311   9.000
  529   1HB   SER  26          1HB       SER  26  18.725  -1.477   7.362
  530   2HB   SER  26          2HB       SER  26  17.057  -0.952   7.567
  531    HG   SER  26           HG       SER  26  18.524   0.404   5.654
  532    H    ARG  27           H        ARG  27  18.842   2.267   6.090
  533    HA   ARG  27           HA       ARG  27  21.514   1.672   5.303
  534   1HB   ARG  27          1HB       ARG  27  19.892   4.219   5.048
  535   2HB   ARG  27          2HB       ARG  27  21.460   3.977   4.278
  536   1HG   ARG  27          1HG       ARG  27  20.531   1.937   3.154
  537   2HG   ARG  27          2HG       ARG  27  18.950   2.341   3.825
  538   1HD   ARG  27          1HD       ARG  27  19.146   4.598   2.709
  539   2HD   ARG  27          2HD       ARG  27  20.593   4.000   1.898
  540    HE   ARG  27           HE       ARG  27  18.672   2.091   1.313
  541   1HH1  ARG  27          1HH1      ARG  27  18.963   5.517   1.055
  542   2HH1  ARG  27          2HH1      ARG  27  17.941   5.632  -0.338
  543   1HH2  ARG  27          1HH2      ARG  27  17.338   2.221  -0.507
  544   2HH2  ARG  27          2HH2      ARG  27  17.022   3.765  -1.224
  545    H    SER  28           H        SER  28  23.481   2.860   5.759
  546    HA   SER  28           HA       SER  28  23.989   3.376   8.480
  547   1HB   SER  28          1HB       SER  28  25.457   4.746   6.219
  548   2HB   SER  28          2HB       SER  28  26.092   4.275   7.792
  549    HG   SER  28           HG       SER  28  25.383   2.059   7.021
  550    H    ALA  29           H        ALA  29  22.916   5.575   5.921
  551    HA   ALA  29           HA       ALA  29  22.251   7.831   6.025
  552   1HB   ALA  29          1HB       ALA  29  20.738   8.326   7.910
  553   2HB   ALA  29          2HB       ALA  29  21.305   6.880   8.747
  554   3HB   ALA  29          3HB       ALA  29  20.403   6.731   7.239
  555    H    ASP  30           H        ASP  30  22.203   8.539   9.259
  556    HA   ASP  30           HA       ASP  30  25.033   9.059   9.693
  557   1HB   ASP  30          1HB       ASP  30  24.376  10.835   8.021
  558   2HB   ASP  30          2HB       ASP  30  23.243  11.459   9.221
  Start of MODEL   15
    1   1H    ASP  -3          1H        ASP  -3 -23.847   0.269  -2.257
    2    HA   ASP  -3           HA       ASP  -3 -22.465  -0.540  -3.790
    3   1HB   ASP  -3          1HB       ASP  -3 -24.282  -2.155  -4.449
    4   2HB   ASP  -3          2HB       ASP  -3 -24.832  -0.970  -5.635
    5    H    SER  -2           H        SER  -2 -22.081   1.902  -3.680
    6    HA   SER  -2           HA       SER  -2 -22.903   3.363  -6.133
    7   1HB   SER  -2          1HB       SER  -2 -22.926   4.395  -3.785
    8   2HB   SER  -2          2HB       SER  -2 -21.167   4.397  -3.881
    9    HG   SER  -2           HG       SER  -2 -22.485   5.389  -6.097
   10    H    LYS  -1           H        LYS  -1 -21.404   4.062  -7.683
   11    HA   LYS  -1           HA       LYS  -1 -19.025   2.447  -7.999
   12   1HB   LYS  -1          1HB       LYS  -1 -18.647   3.767 -10.016
   13   2HB   LYS  -1          2HB       LYS  -1 -20.364   3.374  -9.903
   14   1HG   LYS  -1          1HG       LYS  -1 -20.690   5.621  -8.761
   15   2HG   LYS  -1          2HG       LYS  -1 -19.028   6.002  -9.214
   16   1HD   LYS  -1          1HD       LYS  -1 -19.665   5.467 -11.608
   17   2HD   LYS  -1          2HD       LYS  -1 -21.343   5.392 -11.067
   18   1HE   LYS  -1          1HE       LYS  -1 -20.959   7.628 -11.883
   19   2HE   LYS  -1          2HE       LYS  -1 -21.044   7.721 -10.124
   20   1HZ   LYS  -1          1HZ       LYS  -1 -19.169   8.975 -10.948
   21   2HZ   LYS  -1          2HZ       LYS  -1 -18.560   7.607 -11.750
   22   3HZ   LYS  -1          3HZ       LYS  -1 -18.621   7.644 -10.052
   23    H    LEU   1           H        LEU   1 -19.697   5.430  -6.405
   24    HA   LEU   1           HA       LEU   1 -17.179   6.728  -6.599
   25   1HB   LEU   1          1HB       LEU   1 -19.270   7.721  -5.612
   26   2HB   LEU   1          2HB       LEU   1 -19.034   6.698  -4.200
   27    HG   LEU   1           HG       LEU   1 -16.734   7.750  -3.942
   28   1HD1  LEU   1          1HD1      LEU   1 -17.834   9.426  -6.197
   29   2HD1  LEU   1          2HD1      LEU   1 -16.220   8.747  -6.005
   30   3HD1  LEU   1          3HD1      LEU   1 -16.710  10.132  -5.037
   31   1HD2  LEU   1          1HD2      LEU   1 -17.667   9.837  -2.944
   32   2HD2  LEU   1          2HD2      LEU   1 -18.610   8.408  -2.524
   33   3HD2  LEU   1          3HD2      LEU   1 -19.194   9.515  -3.766
   34    H    CYS   2           H        CYS   2 -18.348   4.306  -4.248
   35    HA   CYS   2           HA       CYS   2 -16.024   4.250  -2.617
   36   1HB   CYS   2          1HB       CYS   2 -18.257   3.107  -2.170
   37   2HB   CYS   2          2HB       CYS   2 -17.732   1.840  -3.278
   38    H    TYR   3           H        TYR   3 -16.772   2.613  -5.664
   39    HA   TYR   3           HA       TYR   3 -14.543   0.834  -5.699
   40   1HB   TYR   3          1HB       TYR   3 -16.552   0.864  -7.283
   41   2HB   TYR   3          2HB       TYR   3 -15.729   2.166  -8.143
   42    HD1  TYR   3           HD1      TYR   3 -13.918   1.712  -9.626
   43    HD2  TYR   3           HD2      TYR   3 -15.382  -1.365  -7.010
   44    HE1  TYR   3           HE1      TYR   3 -12.524   0.040 -10.812
   45    HE2  TYR   3           HE2      TYR   3 -13.987  -3.037  -8.197
   46    HH   TYR   3           HH       TYR   3 -11.667  -2.070 -10.668
   47    H    LEU   4           H        LEU   4 -14.822   4.260  -6.411
   48    HA   LEU   4           HA       LEU   4 -12.363   4.573  -7.840
   49   1HB   LEU   4          1HB       LEU   4 -14.173   6.307  -7.674
   50   2HB   LEU   4          2HB       LEU   4 -13.709   6.570  -5.997
   51    HG   LEU   4           HG       LEU   4 -11.367   7.097  -6.822
   52   1HD1  LEU   4          1HD1      LEU   4 -12.798   6.803  -9.463
   53   2HD1  LEU   4          2HD1      LEU   4 -11.208   6.206  -8.992
   54   3HD1  LEU   4          3HD1      LEU   4 -11.444   7.922  -9.308
   55   1HD2  LEU   4          1HD2      LEU   4 -12.841   8.894  -6.167
   56   2HD2  LEU   4          2HD2      LEU   4 -13.714   8.802  -7.698
   57   3HD2  LEU   4          3HD2      LEU   4 -12.047   9.377  -7.666
   58    H    LEU   5           H        LEU   5 -13.130   4.608  -4.371
   59    HA   LEU   5           HA       LEU   5 -10.539   5.405  -3.468
   60   1HB   LEU   5          1HB       LEU   5 -12.798   3.841  -2.215
   61   2HB   LEU   5          2HB       LEU   5 -11.270   4.041  -1.358
   62    HG   LEU   5           HG       LEU   5 -11.493   6.523  -1.657
   63   1HD1  LEU   5          1HD1      LEU   5 -13.874   7.286  -2.189
   64   2HD1  LEU   5          2HD1      LEU   5 -14.153   5.660  -2.812
   65   3HD1  LEU   5          3HD1      LEU   5 -12.934   6.694  -3.558
   66   1HD2  LEU   5          1HD2      LEU   5 -13.426   6.721  -0.011
   67   2HD2  LEU   5          2HD2      LEU   5 -12.153   5.592   0.455
   68   3HD2  LEU   5          3HD2      LEU   5 -13.668   4.985  -0.215
   69    H    ASP   6           H        ASP   6 -11.944   2.196  -4.102
   70    HA   ASP   6           HA       ASP   6  -9.703   0.653  -3.273
   71   1HB   ASP   6          1HB       ASP   6 -11.771   0.118  -5.425
   72   2HB   ASP   6          2HB       ASP   6 -10.630  -1.086  -4.827
   73    H    GLY   7           H        GLY   7 -10.446   2.218  -6.374
   74   1HA   GLY   7          1HA       GLY   7  -8.277   1.102  -7.860
   75   2HA   GLY   7          2HA       GLY   7  -9.076   2.628  -8.235
   76    H    ILE   8           H        ILE   8  -8.502   4.198  -6.070
   77    HA   ILE   8           HA       ILE   8  -5.774   4.950  -6.553
   78    HB   ILE   8           HB       ILE   8  -7.552   5.723  -4.217
   79   1HG1  ILE   8          1HG1      ILE   8  -7.154   7.067  -6.911
   80   2HG1  ILE   8          2HG1      ILE   8  -8.584   6.147  -6.447
   81   1HG2  ILE   8          1HG2      ILE   8  -5.161   6.274  -3.905
   82   2HG2  ILE   8          2HG2      ILE   8  -6.118   7.733  -4.145
   83   3HG2  ILE   8          3HG2      ILE   8  -5.147   7.088  -5.468
   84   1HD1  ILE   8          1HD1      ILE   8  -7.587   8.753  -5.286
   85   2HD1  ILE   8          2HD1      ILE   8  -8.763   7.745  -4.443
   86   3HD1  ILE   8          3HD1      ILE   8  -9.154   8.419  -6.025
   87    H    LEU   9           H        LEU   9  -7.293   3.467  -3.656
   88    HA   LEU   9           HA       LEU   9  -4.866   3.126  -2.216
   89   1HB   LEU   9          1HB       LEU   9  -7.329   1.359  -2.123
   90   2HB   LEU   9          2HB       LEU   9  -6.090   1.482  -0.877
   91    HG   LEU   9           HG       LEU   9  -7.635   3.913  -1.799
   92   1HD1  LEU   9          1HD1      LEU   9  -9.340   2.373  -1.071
   93   2HD1  LEU   9          2HD1      LEU   9  -9.068   3.515   0.245
   94   3HD1  LEU   9          3HD1      LEU   9  -8.382   1.893   0.329
   95   1HD2  LEU   9          1HD2      LEU   9  -7.069   4.618   0.574
   96   2HD2  LEU   9          2HD2      LEU   9  -5.679   4.443  -0.492
   97   3HD2  LEU   9          3HD2      LEU   9  -6.051   3.184   0.686
   98    H    PHE  10           H        PHE  10  -6.470   1.034  -4.603
   99    HA   PHE  10           HA       PHE  10  -4.696  -1.197  -4.279
  100   1HB   PHE  10          1HB       PHE  10  -6.837  -1.384  -5.489
  101   2HB   PHE  10          2HB       PHE  10  -6.227  -0.306  -6.744
  102    HD1  PHE  10           HD1      PHE  10  -5.605  -3.578  -5.059
  103    HD2  PHE  10           HD2      PHE  10  -4.880  -1.131  -8.515
  104    HE1  PHE  10           HE1      PHE  10  -4.555  -5.510  -6.207
  105    HE2  PHE  10           HE2      PHE  10  -3.830  -3.062  -9.662
  106    HZ   PHE  10           HZ       PHE  10  -3.667  -5.250  -8.509
  107    H    ILE  11           H        ILE  11  -4.701   1.411  -6.739
  108    HA   ILE  11           HA       ILE  11  -2.248   0.701  -7.970
  109    HB   ILE  11           HB       ILE  11  -3.528   3.423  -7.586
  110   1HG1  ILE  11          1HG1      ILE  11  -3.428   1.627 -10.024
  111   2HG1  ILE  11          2HG1      ILE  11  -4.764   1.615  -8.874
  112   1HG2  ILE  11          1HG2      ILE  11  -1.235   3.857  -8.076
  113   2HG2  ILE  11          2HG2      ILE  11  -2.072   3.977  -9.624
  114   3HG2  ILE  11          3HG2      ILE  11  -1.154   2.525  -9.230
  115   1HD1  ILE  11          1HD1      ILE  11  -3.831   4.168 -10.193
  116   2HD1  ILE  11          2HD1      ILE  11  -5.363   3.855  -9.379
  117   3HD1  ILE  11          3HD1      ILE  11  -5.031   3.119 -10.946
  118    H    TYR  12           H        TYR  12  -2.925   2.568  -5.054
  119    HA   TYR  12           HA       TYR  12  -0.319   3.622  -4.605
  120   1HB   TYR  12          1HB       TYR  12  -2.289   4.320  -3.296
  121   2HB   TYR  12          2HB       TYR  12  -2.377   2.717  -2.570
  122    HD1  TYR  12           HD1      TYR  12  -0.792   2.000  -0.882
  123    HD2  TYR  12           HD2      TYR  12  -0.426   5.848  -2.756
  124    HE1  TYR  12           HE1      TYR  12   0.842   2.688   0.852
  125    HE2  TYR  12           HE2      TYR  12   1.209   6.537  -1.022
  126    HH   TYR  12           HH       TYR  12   1.550   5.258   1.790
  127    H    GLY  13           H        GLY  13  -1.748   0.485  -3.715
  128   1HA   GLY  13          1HA       GLY  13   0.545  -0.440  -2.242
  129   2HA   GLY  13          2HA       GLY  13  -0.724  -1.469  -2.907
  130    H    VAL  14           H        VAL  14  -0.400  -0.701  -5.659
  131    HA   VAL  14           HA       VAL  14   1.726  -2.490  -6.400
  132    HB   VAL  14           HB       VAL  14   0.142  -0.493  -8.041
  133   1HG1  VAL  14          1HG1      VAL  14   2.148  -0.926  -9.266
  134   2HG1  VAL  14          2HG1      VAL  14   0.929  -2.000  -9.951
  135   3HG1  VAL  14          3HG1      VAL  14   2.131  -2.634  -8.827
  136   1HG2  VAL  14          1HG2      VAL  14  -1.175  -2.418  -8.686
  137   2HG2  VAL  14          2HG2      VAL  14  -1.087  -2.402  -6.926
  138   3HG2  VAL  14          3HG2      VAL  14  -0.075  -3.512  -7.848
  139    H    ILE  15           H        ILE  15   1.447   1.073  -6.525
  140    HA   ILE  15           HA       ILE  15   4.046   1.486  -7.667
  141    HB   ILE  15           HB       ILE  15   2.378   3.323  -5.920
  142   1HG1  ILE  15          1HG1      ILE  15   2.703   3.233  -8.937
  143   2HG1  ILE  15          2HG1      ILE  15   1.342   2.514  -8.076
  144   1HG2  ILE  15          1HG2      ILE  15   3.773   5.099  -7.072
  145   2HG2  ILE  15          2HG2      ILE  15   4.816   3.803  -7.657
  146   3HG2  ILE  15          3HG2      ILE  15   4.663   4.099  -5.925
  147   1HD1  ILE  15          1HD1      ILE  15   0.748   4.709  -7.145
  148   2HD1  ILE  15          2HD1      ILE  15   0.799   4.788  -8.905
  149   3HD1  ILE  15          3HD1      ILE  15   2.133   5.441  -7.954
  150    H    LEU  16           H        LEU  16   2.917   1.398  -4.280
  151    HA   LEU  16           HA       LEU  16   5.477   2.043  -3.150
  152   1HB   LEU  16          1HB       LEU  16   2.916   1.677  -2.159
  153   2HB   LEU  16          2HB       LEU  16   3.731   0.254  -1.538
  154    HG   LEU  16           HG       LEU  16   4.013   1.866   0.155
  155   1HD1  LEU  16          1HD1      LEU  16   6.231   0.829  -0.965
  156   2HD1  LEU  16          2HD1      LEU  16   6.283   1.914   0.417
  157   3HD1  LEU  16          3HD1      LEU  16   6.589   2.539  -1.198
  158   1HD2  LEU  16          1HD2      LEU  16   4.860   3.906  -1.926
  159   2HD2  LEU  16          2HD2      LEU  16   4.595   4.191  -0.209
  160   3HD2  LEU  16          3HD2      LEU  16   3.234   3.792  -1.253
  161    H    THR  17           H        THR  17   3.871  -1.070  -3.822
  162    HA   THR  17           HA       THR  17   5.926  -2.749  -2.798
  163    HB   THR  17           HB       THR  17   4.148  -3.326  -5.184
  164    HG1  THR  17           HG1      THR  17   3.186  -2.563  -3.089
  165   1HG2  THR  17          1HG2      THR  17   4.355  -5.669  -4.256
  166   2HG2  THR  17          2HG2      THR  17   5.596  -5.054  -3.166
  167   3HG2  THR  17          3HG2      THR  17   5.851  -5.004  -4.911
  168    H    ALA  18           H        ALA  18   5.528  -1.255  -6.000
  169    HA   ALA  18           HA       ALA  18   7.689  -2.597  -7.289
  170   1HB   ALA  18          1HB       ALA  18   6.442   0.123  -7.730
  171   2HB   ALA  18          2HB       ALA  18   6.171  -1.354  -8.654
  172   3HB   ALA  18          3HB       ALA  18   7.718  -0.515  -8.767
  173    H    LEU  19           H        LEU  19   7.653   0.609  -5.684
  174    HA   LEU  19           HA       LEU  19  10.458   1.094  -5.959
  175   1HB   LEU  19          1HB       LEU  19   8.624   2.029  -3.729
  176   2HB   LEU  19          2HB       LEU  19  10.157   2.762  -4.192
  177    HG   LEU  19           HG       LEU  19   7.797   2.494  -6.075
  178   1HD1  LEU  19          1HD1      LEU  19   8.634   4.766  -4.258
  179   2HD1  LEU  19          2HD1      LEU  19   7.077   3.939  -4.299
  180   3HD1  LEU  19          3HD1      LEU  19   7.555   4.985  -5.636
  181   1HD2  LEU  19          1HD2      LEU  19  10.474   3.902  -6.177
  182   2HD2  LEU  19          2HD2      LEU  19   9.127   4.441  -7.176
  183   3HD2  LEU  19          3HD2      LEU  19   9.761   2.810  -7.363
  184    H    PHE  20           H        PHE  20   8.611  -0.692  -3.533
  185    HA   PHE  20           HA       PHE  20  10.728  -0.986  -1.634
  186   1HB   PHE  20          1HB       PHE  20   8.371  -1.517  -1.115
  187   2HB   PHE  20          2HB       PHE  20   8.429  -2.869  -2.245
  188    HD1  PHE  20           HD1      PHE  20   9.460  -4.945  -1.656
  189    HD2  PHE  20           HD2      PHE  20   9.811  -1.542   0.937
  190    HE1  PHE  20           HE1      PHE  20  10.391  -6.400   0.123
  191    HE2  PHE  20           HE2      PHE  20  10.743  -2.995   2.718
  192    HZ   PHE  20           HZ       PHE  20  11.033  -5.425   2.309
  193    H    LEU  21           H        LEU  21   9.676  -3.160  -4.281
  194    HA   LEU  21           HA       LEU  21  11.776  -5.073  -3.846
  195   1HB   LEU  21          1HB       LEU  21  10.256  -4.453  -6.396
  196   2HB   LEU  21          2HB       LEU  21  11.193  -5.913  -6.089
  197    HG   LEU  21           HG       LEU  21   8.866  -5.041  -4.353
  198   1HD1  LEU  21          1HD1      LEU  21   7.585  -6.811  -5.575
  199   2HD1  LEU  21          2HD1      LEU  21   8.928  -6.945  -6.711
  200   3HD1  LEU  21          3HD1      LEU  21   8.016  -5.439  -6.596
  201   1HD2  LEU  21          1HD2      LEU  21  10.191  -6.593  -3.143
  202   2HD2  LEU  21          2HD2      LEU  21  10.559  -7.540  -4.583
  203   3HD2  LEU  21          3HD2      LEU  21   8.945  -7.597  -3.878
  204    H    ARG  22           H        ARG  22  11.541  -2.210  -5.946
  205    HA   ARG  22           HA       ARG  22  13.910  -2.592  -7.433
  206   1HB   ARG  22          1HB       ARG  22  12.196  -0.744  -7.741
  207   2HB   ARG  22          2HB       ARG  22  12.954   0.084  -6.381
  208   1HG   ARG  22          1HG       ARG  22  15.110   0.087  -7.571
  209   2HG   ARG  22          2HG       ARG  22  14.367  -0.757  -8.930
  210   1HD   ARG  22          1HD       ARG  22  12.706   1.191  -9.038
  211   2HD   ARG  22          2HD       ARG  22  13.798   2.044  -7.945
  212    HE   ARG  22           HE       ARG  22  15.452   1.190  -9.996
  213   1HH1  ARG  22          1HH1      ARG  22  12.496   2.942  -9.726
  214   2HH1  ARG  22          2HH1      ARG  22  12.779   3.900 -11.142
  215   1HH2  ARG  22          1HH2      ARG  22  15.839   2.430 -11.850
  216   2HH2  ARG  22          2HH2      ARG  22  14.671   3.610 -12.344
  217    H    VAL  23           H        VAL  23  13.485  -1.201  -4.186
  218    HA   VAL  23           HA       VAL  23  16.294  -0.537  -3.883
  219    HB   VAL  23           HB       VAL  23  14.075  -0.890  -1.846
  220   1HG1  VAL  23          1HG1      VAL  23  15.702   0.492  -0.416
  221   2HG1  VAL  23          2HG1      VAL  23  16.943   0.033  -1.583
  222   3HG1  VAL  23          3HG1      VAL  23  16.109  -1.209  -0.648
  223   1HG2  VAL  23          1HG2      VAL  23  15.393   1.622  -2.918
  224   2HG2  VAL  23          2HG2      VAL  23  13.976   1.527  -1.870
  225   3HG2  VAL  23          3HG2      VAL  23  13.876   0.972  -3.541
  226    H    LYS  24           H        LYS  24  14.320  -3.377  -3.222
  227    HA   LYS  24           HA       LYS  24  16.104  -4.750  -1.483
  228   1HB   LYS  24          1HB       LYS  24  13.757  -5.465  -2.022
  229   2HB   LYS  24          2HB       LYS  24  14.329  -5.997  -3.604
  230   1HG   LYS  24          1HG       LYS  24  15.928  -7.532  -2.507
  231   2HG   LYS  24          2HG       LYS  24  15.332  -7.015  -0.928
  232   1HD   LYS  24          1HD       LYS  24  13.073  -7.820  -1.516
  233   2HD   LYS  24          2HD       LYS  24  13.671  -8.347  -3.089
  234   1HE   LYS  24          1HE       LYS  24  13.669 -10.287  -1.674
  235   2HE   LYS  24          2HE       LYS  24  15.352  -9.789  -1.846
  236   1HZ   LYS  24          1HZ       LYS  24  13.557  -9.162   0.436
  237   2HZ   LYS  24          2HZ       LYS  24  15.149  -8.593   0.265
  238   3HZ   LYS  24          3HZ       LYS  24  14.854 -10.256   0.451
  239    H    PHE  25           H        PHE  25  15.976  -4.608  -5.037
  240    HA   PHE  25           HA       PHE  25  18.121  -6.502  -5.426
  241   1HB   PHE  25          1HB       PHE  25  16.970  -4.345  -7.214
  242   2HB   PHE  25          2HB       PHE  25  18.206  -5.488  -7.738
  243    HD1  PHE  25           HD1      PHE  25  14.692  -4.950  -7.306
  244    HD2  PHE  25           HD2      PHE  25  17.704  -8.008  -7.421
  245    HE1  PHE  25           HE1      PHE  25  12.944  -6.653  -7.744
  246    HE2  PHE  25           HE2      PHE  25  15.958  -9.713  -7.861
  247    HZ   PHE  25           HZ       PHE  25  13.577  -9.035  -8.022
  248    H    SER  26           H        SER  26  17.999  -3.093  -4.703
  249    HA   SER  26           HA       SER  26  20.556  -2.293  -5.638
  250   1HB   SER  26          1HB       SER  26  19.193  -1.353  -3.099
  251   2HB   SER  26          2HB       SER  26  20.405  -0.478  -4.031
  252    HG   SER  26           HG       SER  26  18.650   0.315  -4.927
  253    H    ARG  27           H        ARG  27  19.602  -3.980  -2.672
  254    HA   ARG  27           HA       ARG  27  22.048  -3.804  -1.259
  255   1HB   ARG  27          1HB       ARG  27  19.905  -4.769  -0.370
  256   2HB   ARG  27          2HB       ARG  27  20.204  -6.209  -1.345
  257   1HG   ARG  27          1HG       ARG  27  22.316  -6.598  -0.179
  258   2HG   ARG  27          2HG       ARG  27  22.099  -5.123   0.760
  259   1HD   ARG  27          1HD       ARG  27  19.728  -6.439   1.270
  260   2HD   ARG  27          2HD       ARG  27  20.849  -7.790   1.136
  261    HE   ARG  27           HE       ARG  27  20.611  -6.135   3.393
  262   1HH1  ARG  27          1HH1      ARG  27  23.104  -7.147   1.226
  263   2HH1  ARG  27          2HH1      ARG  27  24.380  -6.814   2.342
  264   1HH2  ARG  27          1HH2      ARG  27  22.263  -5.720   4.853
  265   2HH2  ARG  27          2HH2      ARG  27  23.907  -6.016   4.395
  266    H    SER  28           H        SER  28  21.068  -5.961  -3.888
  267    HA   SER  28           HA       SER  28  22.333  -7.450  -5.189
  268   1HB   SER  28          1HB       SER  28  24.432  -6.665  -5.866
  269   2HB   SER  28          2HB       SER  28  23.666  -5.186  -5.292
  270    HG   SER  28           HG       SER  28  24.660  -5.867  -3.180
  271    H    ALA  29           H        ALA  29  24.622  -8.787  -4.921
  272    HA   ALA  29           HA       ALA  29  25.132  -9.568  -2.142
  273   1HB   ALA  29          1HB       ALA  29  22.996 -10.784  -2.862
  274   2HB   ALA  29          2HB       ALA  29  24.308 -11.807  -2.275
  275   3HB   ALA  29          3HB       ALA  29  24.005 -11.668  -4.007
  276    H    ASP  30           H        ASP  30  26.913 -11.155  -2.027
  277    HA   ASP  30           HA       ASP  30  28.907 -10.667  -4.068
  278   1HB   ASP  30          1HB       ASP  30  30.281 -12.276  -2.749
  279   2HB   ASP  30          2HB       ASP  30  29.568 -11.018  -1.738
  280   1H    ASP  -3          1H        ASP  -3 -27.093   0.067   4.676
  281    HA   ASP  -3           HA       ASP  -3 -26.125  -2.299   4.134
  282   1HB   ASP  -3          1HB       ASP  -3 -28.185  -1.325   3.187
  283   2HB   ASP  -3          2HB       ASP  -3 -27.218  -0.367   2.066
  284    H    SER  -2           H        SER  -2 -24.935   0.612   2.443
  285    HA   SER  -2           HA       SER  -2 -23.089  -0.903   0.786
  286   1HB   SER  -2          1HB       SER  -2 -23.952   1.333   0.119
  287   2HB   SER  -2          2HB       SER  -2 -23.088   2.055   1.473
  288    HG   SER  -2           HG       SER  -2 -22.133   1.746  -0.866
  289    H    LYS  -1           H        LYS  -1 -23.049  -0.919   3.911
  290    HA   LYS  -1           HA       LYS  -1 -20.419   0.140   4.566
  291   1HB   LYS  -1          1HB       LYS  -1 -22.120  -1.862   6.093
  292   2HB   LYS  -1          2HB       LYS  -1 -20.753  -0.948   6.734
  293   1HG   LYS  -1          1HG       LYS  -1 -21.960   1.166   6.263
  294   2HG   LYS  -1          2HG       LYS  -1 -23.339   0.233   5.680
  295   1HD   LYS  -1          1HD       LYS  -1 -23.491  -0.874   7.910
  296   2HD   LYS  -1          2HD       LYS  -1 -22.184   0.164   8.483
  297   1HE   LYS  -1          1HE       LYS  -1 -23.564   2.160   7.912
  298   2HE   LYS  -1          2HE       LYS  -1 -24.885   1.084   7.454
  299   1HZ   LYS  -1          1HZ       LYS  -1 -23.684   0.678  10.081
  300   2HZ   LYS  -1          2HZ       LYS  -1 -25.304   0.530   9.590
  301   3HZ   LYS  -1          3HZ       LYS  -1 -24.638   2.066   9.883
  302    H    LEU   1           H        LEU   1 -21.142  -2.269   2.544
  303    HA   LEU   1           HA       LEU   1 -19.291  -4.317   3.581
  304   1HB   LEU   1          1HB       LEU   1 -21.354  -4.944   2.316
  305   2HB   LEU   1          2HB       LEU   1 -20.698  -4.129   0.899
  306    HG   LEU   1           HG       LEU   1 -18.719  -5.664   0.985
  307   1HD1  LEU   1          1HD1      LEU   1 -19.277  -7.836   2.385
  308   2HD1  LEU   1          2HD1      LEU   1 -20.252  -6.727   3.349
  309   3HD1  LEU   1          3HD1      LEU   1 -18.518  -6.456   3.175
  310   1HD2  LEU   1          1HD2      LEU   1 -19.858  -7.510  -0.034
  311   2HD2  LEU   1          2HD2      LEU   1 -20.839  -6.085  -0.374
  312   3HD2  LEU   1          3HD2      LEU   1 -21.324  -7.206   0.898
  313    H    CYS   2           H        CYS   2 -19.452  -2.036   0.848
  314    HA   CYS   2           HA       CYS   2 -16.955  -2.657  -0.330
  315   1HB   CYS   2          1HB       CYS   2 -18.632  -1.169  -1.372
  316   2HB   CYS   2          2HB       CYS   2 -18.314   0.049  -0.138
  317    H    TYR   3           H        TYR   3 -17.735  -0.717   2.499
  318    HA   TYR   3           HA       TYR   3 -15.292   0.678   2.809
  319   1HB   TYR   3          1HB       TYR   3 -17.386   0.963   4.205
  320   2HB   TYR   3          2HB       TYR   3 -16.928  -0.506   5.068
  321    HD1  TYR   3           HD1      TYR   3 -15.757   2.917   4.165
  322    HD2  TYR   3           HD2      TYR   3 -15.282  -0.458   6.781
  323    HE1  TYR   3           HE1      TYR   3 -14.220   4.240   5.591
  324    HE2  TYR   3           HE2      TYR   3 -13.744   0.866   8.208
  325    HH   TYR   3           HH       TYR   3 -13.335   3.310   8.693
  326    H    LEU   4           H        LEU   4 -16.058  -2.696   3.305
  327    HA   LEU   4           HA       LEU   4 -13.821  -3.345   4.989
  328   1HB   LEU   4          1HB       LEU   4 -15.687  -4.890   4.791
  329   2HB   LEU   4          2HB       LEU   4 -15.437  -5.033   3.053
  330    HG   LEU   4           HG       LEU   4 -13.299  -6.138   3.393
  331   1HD1  LEU   4          1HD1      LEU   4 -12.723  -6.729   5.867
  332   2HD1  LEU   4          2HD1      LEU   4 -13.770  -5.369   6.274
  333   3HD1  LEU   4          3HD1      LEU   4 -12.334  -5.112   5.284
  334   1HD2  LEU   4          1HD2      LEU   4 -14.077  -8.158   4.647
  335   2HD2  LEU   4          2HD2      LEU   4 -15.261  -7.581   3.474
  336   3HD2  LEU   4          3HD2      LEU   4 -15.482  -7.238   5.189
  337    H    LEU   5           H        LEU   5 -14.253  -3.197   1.471
  338    HA   LEU   5           HA       LEU   5 -11.708  -4.345   0.803
  339   1HB   LEU   5          1HB       LEU   5 -13.670  -2.577  -0.647
  340   2HB   LEU   5          2HB       LEU   5 -12.100  -2.915  -1.369
  341    HG   LEU   5           HG       LEU   5 -13.933  -4.488  -2.090
  342   1HD1  LEU   5          1HD1      LEU   5 -11.956  -6.169  -0.579
  343   2HD1  LEU   5          2HD1      LEU   5 -11.341  -5.053  -1.798
  344   3HD1  LEU   5          3HD1      LEU   5 -12.504  -6.296  -2.248
  345   1HD2  LEU   5          1HD2      LEU   5 -15.048  -4.529   0.169
  346   2HD2  LEU   5          2HD2      LEU   5 -13.726  -5.545   0.745
  347   3HD2  LEU   5          3HD2      LEU   5 -14.792  -6.125  -0.533
  348    H    ASP   6           H        ASP   6 -12.758  -0.987   1.345
  349    HA   ASP   6           HA       ASP   6 -10.235   0.218   0.707
  350   1HB   ASP   6          1HB       ASP   6 -12.502   1.127   2.501
  351   2HB   ASP   6          2HB       ASP   6 -11.111   2.135   2.102
  352    H    GLY   7           H        GLY   7 -11.566  -1.113   3.707
  353   1HA   GLY   7          1HA       GLY   7  -9.544  -0.182   5.478
  354   2HA   GLY   7          2HA       GLY   7 -10.511  -1.634   5.735
  355    H    ILE   8           H        ILE   8  -9.760  -3.326   3.760
  356    HA   ILE   8           HA       ILE   8  -7.219  -4.288   4.630
  357    HB   ILE   8           HB       ILE   8  -8.624  -4.907   2.013
  358   1HG1  ILE   8          1HG1      ILE   8  -8.870  -6.268   4.717
  359   2HG1  ILE   8          2HG1      ILE   8 -10.080  -5.184   4.030
  360   1HG2  ILE   8          1HG2      ILE   8  -7.415  -7.054   2.207
  361   2HG2  ILE   8          2HG2      ILE   8  -6.650  -6.491   3.693
  362   3HG2  ILE   8          3HG2      ILE   8  -6.285  -5.702   2.158
  363   1HD1  ILE   8          1HD1      ILE   8 -10.097  -6.741   1.993
  364   2HD1  ILE   8          2HD1      ILE   8 -10.820  -7.377   3.471
  365   3HD1  ILE   8          3HD1      ILE   8  -9.199  -7.882   2.993
  366    H    LEU   9           H        LEU   9  -8.088  -2.751   1.505
  367    HA   LEU   9           HA       LEU   9  -5.448  -2.615   0.489
  368   1HB   LEU   9          1HB       LEU   9  -7.716  -0.652   0.038
  369   2HB   LEU   9          2HB       LEU   9  -6.297  -0.841  -0.989
  370    HG   LEU   9           HG       LEU   9  -8.229  -3.099  -0.395
  371   1HD1  LEU   9          1HD1      LEU   9  -9.424  -1.308  -1.561
  372   2HD1  LEU   9          2HD1      LEU   9  -9.145  -2.658  -2.662
  373   3HD1  LEU   9          3HD1      LEU   9  -8.141  -1.211  -2.767
  374   1HD2  LEU   9          1HD2      LEU   9  -5.893  -2.708  -2.276
  375   2HD2  LEU   9          2HD2      LEU   9  -7.152  -3.884  -2.644
  376   3HD2  LEU   9          3HD2      LEU   9  -6.205  -4.043  -1.168
  377    H    PHE  10           H        PHE  10  -7.218  -0.311   2.558
  378    HA   PHE  10           HA       PHE  10  -5.194   1.710   2.558
  379   1HB   PHE  10          1HB       PHE  10  -7.468   2.147   3.381
  380   2HB   PHE  10          2HB       PHE  10  -7.216   1.014   4.711
  381    HD1  PHE  10           HD1      PHE  10  -5.766   4.108   3.172
  382    HD2  PHE  10           HD2      PHE  10  -6.294   1.777   6.742
  383    HE1  PHE  10           HE1      PHE  10  -4.722   5.917   4.509
  384    HE2  PHE  10           HE2      PHE  10  -5.251   3.587   8.078
  385    HZ   PHE  10           HZ       PHE  10  -4.464   5.657   6.961
  386    H    ILE  11           H        ILE  11  -5.854  -0.880   4.950
  387    HA   ILE  11           HA       ILE  11  -3.624  -0.352   6.618
  388    HB   ILE  11           HB       ILE  11  -5.009  -2.975   5.983
  389   1HG1  ILE  11          1HG1      ILE  11  -5.219  -1.157   8.402
  390   2HG1  ILE  11          2HG1      ILE  11  -6.334  -1.093   7.038
  391   1HG2  ILE  11          1HG2      ILE  11  -2.857  -3.548   6.871
  392   2HG2  ILE  11          2HG2      ILE  11  -3.985  -3.655   8.222
  393   3HG2  ILE  11          3HG2      ILE  11  -2.930  -2.251   8.063
  394   1HD1  ILE  11          1HD1      ILE  11  -6.773  -3.563   7.415
  395   2HD1  ILE  11          2HD1      ILE  11  -7.350  -2.503   8.701
  396   3HD1  ILE  11          3HD1      ILE  11  -5.858  -3.420   8.916
  397    H    TYR  12           H        TYR  12  -3.878  -2.330   3.677
  398    HA   TYR  12           HA       TYR  12  -1.279  -3.467   3.719
  399   1HB   TYR  12          1HB       TYR  12  -2.983  -4.137   2.076
  400   2HB   TYR  12          2HB       TYR  12  -2.907  -2.540   1.329
  401    HD1  TYR  12           HD1      TYR  12  -1.036  -5.677   1.952
  402    HD2  TYR  12           HD2      TYR  12  -1.080  -1.913  -0.120
  403    HE1  TYR  12           HE1      TYR  12   0.870  -6.423   0.554
  404    HE2  TYR  12           HE2      TYR  12   0.829  -2.659  -1.520
  405    HH   TYR  12           HH       TYR  12   2.748  -4.374  -1.239
  406    H    GLY  13           H        GLY  13  -2.388  -0.319   2.477
  407   1HA   GLY  13          1HA       GLY  13   0.121   0.505   1.392
  408   2HA   GLY  13          2HA       GLY  13  -1.164   1.598   1.905
  409    H    VAL  14           H        VAL  14  -1.259   0.835   4.652
  410    HA   VAL  14           HA       VAL  14   0.878   2.466   5.683
  411    HB   VAL  14           HB       VAL  14  -1.074   0.623   7.092
  412   1HG1  VAL  14          1HG1      VAL  14  -0.473   2.120   9.075
  413   2HG1  VAL  14          2HG1      VAL  14   0.915   2.656   8.127
  414   3HG1  VAL  14          3HG1      VAL  14   0.762   0.960   8.587
  415   1HG2  VAL  14          1HG2      VAL  14  -2.134   2.472   5.868
  416   2HG2  VAL  14          2HG2      VAL  14  -1.038   3.623   6.632
  417   3HG2  VAL  14          3HG2      VAL  14  -2.230   2.763   7.605
  418    H    ILE  15           H        ILE  15   0.253  -1.056   5.895
  419    HA   ILE  15           HA       ILE  15   2.644  -1.648   7.353
  420    HB   ILE  15           HB       ILE  15   1.070  -3.411   5.450
  421   1HG1  ILE  15          1HG1      ILE  15   0.946  -3.211   8.475
  422   2HG1  ILE  15          2HG1      ILE  15  -0.193  -2.406   7.395
  423   1HG2  ILE  15          1HG2      ILE  15   3.158  -4.018   7.563
  424   2HG2  ILE  15          2HG2      ILE  15   3.251  -4.376   5.839
  425   3HG2  ILE  15          3HG2      ILE  15   2.104  -5.243   6.858
  426   1HD1  ILE  15          1HD1      ILE  15  -1.139  -4.536   8.131
  427   2HD1  ILE  15          2HD1      ILE  15   0.300  -5.394   7.579
  428   3HD1  ILE  15          3HD1      ILE  15  -0.771  -4.623   6.409
  429    H    LEU  16           H        LEU  16   1.970  -1.501   3.863
  430    HA   LEU  16           HA       LEU  16   4.585  -2.455   3.097
  431   1HB   LEU  16          1HB       LEU  16   2.291  -2.181   1.736
  432   2HB   LEU  16          2HB       LEU  16   3.008  -0.640   1.295
  433    HG   LEU  16           HG       LEU  16   3.629  -2.215  -0.406
  434   1HD1  LEU  16          1HD1      LEU  16   5.416  -0.662   0.623
  435   2HD1  LEU  16          2HD1      LEU  16   5.971  -1.979  -0.405
  436   3HD1  LEU  16          3HD1      LEU  16   6.081  -2.125   1.348
  437   1HD2  LEU  16          1HD2      LEU  16   5.033  -4.059   1.512
  438   2HD2  LEU  16          2HD2      LEU  16   4.338  -4.399  -0.069
  439   3HD2  LEU  16          3HD2      LEU  16   3.286  -4.214   1.330
  440    H    THR  17           H        THR  17   3.193   0.774   3.596
  441    HA   THR  17           HA       THR  17   5.492   2.225   2.659
  442    HB   THR  17           HB       THR  17   3.448   3.102   4.720
  443    HG1  THR  17           HG1      THR  17   2.245   2.696   3.001
  444   1HG2  THR  17          1HG2      THR  17   5.366   4.581   4.640
  445   2HG2  THR  17          2HG2      THR  17   4.025   5.364   3.803
  446   3HG2  THR  17          3HG2      THR  17   5.321   4.608   2.877
  447    H    ALA  18           H        ALA  18   4.553   0.990   5.852
  448    HA   ALA  18           HA       ALA  18   6.596   2.247   7.376
  449   1HB   ALA  18          1HB       ALA  18   4.862   1.141   8.575
  450   2HB   ALA  18          2HB       ALA  18   6.315   0.191   8.888
  451   3HB   ALA  18          3HB       ALA  18   5.128  -0.374   7.712
  452    H    LEU  19           H        LEU  19   6.611  -0.951   5.770
  453    HA   LEU  19           HA       LEU  19   9.296  -1.631   6.491
  454   1HB   LEU  19          1HB       LEU  19   7.786  -2.433   3.985
  455   2HB   LEU  19          2HB       LEU  19   9.172  -3.270   4.678
  456    HG   LEU  19           HG       LEU  19   6.569  -2.844   6.170
  457   1HD1  LEU  19          1HD1      LEU  19   7.523  -5.233   4.563
  458   2HD1  LEU  19          2HD1      LEU  19   6.123  -4.221   4.206
  459   3HD1  LEU  19          3HD1      LEU  19   6.128  -5.245   5.643
  460   1HD2  LEU  19          1HD2      LEU  19   9.086  -4.448   6.665
  461   2HD2  LEU  19          2HD2      LEU  19   7.563  -4.880   7.439
  462   3HD2  LEU  19          3HD2      LEU  19   8.286  -3.303   7.739
  463    H    PHE  20           H        PHE  20   7.985   0.271   3.813
  464    HA   PHE  20           HA       PHE  20  10.418   0.442   2.311
  465   1HB   PHE  20          1HB       PHE  20   8.259   1.093   1.352
  466   2HB   PHE  20          2HB       PHE  20   8.115   2.406   2.520
  467    HD1  PHE  20           HD1      PHE  20   9.982   1.173  -0.428
  468    HD2  PHE  20           HD2      PHE  20   9.385   4.446   2.287
  469    HE1  PHE  20           HE1      PHE  20  11.279   2.658  -1.932
  470    HE2  PHE  20           HE2      PHE  20  10.683   5.932   0.785
  471    HZ   PHE  20           HZ       PHE  20  11.629   5.038  -1.325
  472    H    LEU  21           H        LEU  21   9.006   2.684   4.725
  473    HA   LEU  21           HA       LEU  21  11.239   4.481   4.730
  474   1HB   LEU  21          1HB       LEU  21   9.286   3.867   6.970
  475   2HB   LEU  21          2HB       LEU  21  10.325   5.286   6.876
  476    HG   LEU  21           HG       LEU  21   8.297   4.583   4.737
  477   1HD1  LEU  21          1HD1      LEU  21   7.068   4.930   6.796
  478   2HD1  LEU  21          2HD1      LEU  21   6.896   6.375   5.800
  479   3HD1  LEU  21          3HD1      LEU  21   8.012   6.374   7.165
  480   1HD2  LEU  21          1HD2      LEU  21   8.548   7.147   4.394
  481   2HD2  LEU  21          2HD2      LEU  21   9.870   6.122   3.849
  482   3HD2  LEU  21          3HD2      LEU  21  10.008   7.000   5.371
  483    H    ARG  22           H        ARG  22  10.505   1.579   6.646
  484    HA   ARG  22           HA       ARG  22  12.636   1.758   8.499
  485   1HB   ARG  22          1HB       ARG  22  10.770   0.045   8.503
  486   2HB   ARG  22          2HB       ARG  22  11.640  -0.806   7.224
  487   1HG   ARG  22          1HG       ARG  22  13.617  -0.992   8.702
  488   2HG   ARG  22          2HG       ARG  22  12.726  -0.173   9.985
  489   1HD   ARG  22          1HD       ARG  22  11.845  -2.762   8.680
  490   2HD   ARG  22          2HD       ARG  22  12.697  -2.662  10.220
  491    HE   ARG  22           HE       ARG  22  10.509  -0.994  10.559
  492   1HH1  ARG  22          1HH1      ARG  22  11.048  -4.250   9.567
  493   2HH1  ARG  22          2HH1      ARG  22   9.536  -4.828  10.182
  494   1HH2  ARG  22          1HH2      ARG  22   8.533  -1.730  11.372
  495   2HH2  ARG  22          2HH2      ARG  22   8.113  -3.402  11.205
  496    H    VAL  23           H        VAL  23  12.597   0.423   5.196
  497    HA   VAL  23           HA       VAL  23  15.351  -0.448   5.257
  498    HB   VAL  23           HB       VAL  23  13.495   0.219   2.952
  499   1HG1  VAL  23          1HG1      VAL  23  15.200  -1.170   1.645
  500   2HG1  VAL  23          2HG1      VAL  23  16.294  -0.928   3.007
  501   3HG1  VAL  23          3HG1      VAL  23  15.708   0.460   2.088
  502   1HG2  VAL  23          1HG2      VAL  23  13.148  -2.139   2.804
  503   2HG2  VAL  23          2HG2      VAL  23  13.002  -1.751   4.518
  504   3HG2  VAL  23          3HG2      VAL  23  14.486  -2.478   3.903
  505    H    LYS  24           H        LYS  24  13.731   2.557   4.328
  506    HA   LYS  24           HA       LYS  24  15.915   3.858   3.076
  507   1HB   LYS  24          1HB       LYS  24  13.530   4.698   3.214
  508   2HB   LYS  24          2HB       LYS  24  13.873   5.193   4.872
  509   1HG   LYS  24          1HG       LYS  24  15.741   6.600   4.055
  510   2HG   LYS  24          2HG       LYS  24  15.353   6.134   2.398
  511   1HD   LYS  24          1HD       LYS  24  13.091   7.102   2.661
  512   2HD   LYS  24          2HD       LYS  24  13.500   7.591   4.306
  513   1HE   LYS  24          1HE       LYS  24  13.785   9.469   2.727
  514   2HE   LYS  24          2HE       LYS  24  15.328   9.000   3.442
  515   1HZ   LYS  24          1HZ       LYS  24  14.375   7.950   0.841
  516   2HZ   LYS  24          2HZ       LYS  24  15.940   7.850   1.496
  517   3HZ   LYS  24          3HZ       LYS  24  15.328   9.347   0.972
  518    H    PHE  25           H        PHE  25  15.102   3.482   6.502
  519    HA   PHE  25           HA       PHE  25  17.515   5.035   7.287
  520   1HB   PHE  25          1HB       PHE  25  15.269   3.785   8.900
  521   2HB   PHE  25          2HB       PHE  25  16.639   4.637   9.611
  522    HD1  PHE  25           HD1      PHE  25  17.093   7.051   8.806
  523    HD2  PHE  25           HD2      PHE  25  13.377   4.994   8.161
  524    HE1  PHE  25           HE1      PHE  25  15.955   9.222   8.429
  525    HE2  PHE  25           HE2      PHE  25  12.241   7.165   7.782
  526    HZ   PHE  25           HZ       PHE  25  13.530   9.279   7.917
  527    H    SER  26           H        SER  26  19.385   3.997   7.831
  528    HA   SER  26           HA       SER  26  19.754   1.215   7.430
  529   1HB   SER  26          1HB       SER  26  21.590   2.926   7.503
  530   2HB   SER  26          2HB       SER  26  21.394   3.003   9.252
  531    HG   SER  26           HG       SER  26  22.688   1.178   7.733
  532    H    ARG  27           H        ARG  27  18.957   3.040  10.360
  533    HA   ARG  27           HA       ARG  27  17.889   0.621  11.595
  534   1HB   ARG  27          1HB       ARG  27  19.359   0.708  13.585
  535   2HB   ARG  27          2HB       ARG  27  20.281   0.358  12.122
  536   1HG   ARG  27          1HG       ARG  27  20.736   2.856  11.955
  537   2HG   ARG  27          2HG       ARG  27  20.068   3.000  13.580
  538   1HD   ARG  27          1HD       ARG  27  22.527   1.482  12.705
  539   2HD   ARG  27          2HD       ARG  27  22.410   2.766  13.908
  540    HE   ARG  27           HE       ARG  27  20.778   0.768  14.915
  541   1HH1  ARG  27          1HH1      ARG  27  24.025   1.023  13.788
  542   2HH1  ARG  27          2HH1      ARG  27  24.626  -0.223  14.830
  543   1HH2  ARG  27          1HH2      ARG  27  21.541  -0.861  16.281
  544   2HH2  ARG  27          2HH2      ARG  27  23.219  -1.291  16.240
  545    H    SER  28           H        SER  28  16.824   1.153  13.689
  546    HA   SER  28           HA       SER  28  15.604   3.801  13.563
  547   1HB   SER  28          1HB       SER  28  14.399   1.678  14.255
  548   2HB   SER  28          2HB       SER  28  15.320   1.729  15.755
  549    HG   SER  28           HG       SER  28  13.353   2.783  16.036
  550    H    ALA  29           H        ALA  29  15.997   5.530  14.949
  551    HA   ALA  29           HA       ALA  29  17.576   5.245  17.370
  552   1HB   ALA  29          1HB       ALA  29  18.875   6.778  15.108
  553   2HB   ALA  29          2HB       ALA  29  19.295   5.109  15.492
  554   3HB   ALA  29          3HB       ALA  29  19.568   6.383  16.680
  555    H    ASP  30           H        ASP  30  17.125   6.964  18.700
  556    HA   ASP  30           HA       ASP  30  16.405   9.587  17.597
  557   1HB   ASP  30          1HB       ASP  30  14.359   7.957  19.136
  558   2HB   ASP  30          2HB       ASP  30  14.164   9.634  18.625