*HEADER    SIGNALING PROTEIN                       31-JAN-08   2K0B              
*TITLE     NMR STRUCTURE OF THE UBA DOMAIN OF P62 (SQSTM1)                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SEQUESTOSOME-1;                                            
*COMPND   3 CHAIN: X;                                                            
*COMPND   4 FRAGMENT: UBA DOMAIN (UNP RESIDUES 387-436);                         
*COMPND   5 SYNONYM: PHOSPHOTYROSINE-INDEPENDENT LIGAND FOR THE LCK              
*COMPND   6 SH2 DOMAIN OF 62 KDA, UBIQUITIN-BINDING PROTEIN P62, EBI3-           
*COMPND   7 ASSOCIATED PROTEIN OF 60 KDA, P60, EBIAP;                            
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: SQSTM1, ORCA, OSIL;                                            
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PGEX-4T-1                                 
*KEYWDS    UBIQUITIN BINDING, HELICAL BUNDLE, THREE HELICES,                     
*KEYWDS   2 ALTERNATIVE SPLICING, APOPTOSIS, CYTOPLASM, DIFFERENTIATION,         
*KEYWDS   3 DISEASE MUTATION, ENDOSOME, IMMUNE RESPONSE, METAL-BINDING,          
*KEYWDS   4 NUCLEUS, PHOSPHOPROTEIN, POLYMORPHISM, ZINC, ZINC-FINGER,            
*KEYWDS   5 SIGNALING PROTEIN                                                    
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    J.E.LONG, B.CIANI, T.R.A.GALLAGHER, J.R.CAVEY, P.W.SHEPPARD,          
*AUTHOR   2 R.LAYFIELD, M.S.SEARLE                                               
*REVDAT   1   19-FEB-08 2K0B    0                                                


clas average
assign ( resid 7 and name HN ) ( resid 38 and name HE# ) 5.0 3.2 2.5
assign ( resid 9 and name HE ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 9 and name HN ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 10 and name HA ) ( resid 38 and name HD# ) 4.0 2.2 2.5
!assign ( resid 10 and name HB2 ) ( resid 38 and name HE# ) 5.0 3.2 2.5
assign ( resid 10 and name HD1# ) ( resid 38 and name HE# ) 5.0 3.2 2.5
assign ( resid 10 and name HD2# ) ( resid 38 and name HE# ) 2.8 1 2.5
assign ( resid 10 and name HN ) ( resid 38 and name HD# ) 4.0 2.2 2.5
assign ( resid 11 and name HN ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 17 and name HE# ) 5.0 3.2 2.5
assign ( resid 17 and name HE# ) ( resid 22 and name HD# ) 4.0 2.2 2.5
assign ( resid 17 and name HN ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 17 and name HE# ) ( resid 29 and name HD1# ) 2.5 0.7 2.5
assign ( resid 18 and name HN ) ( resid 17 and name HE# ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 20 and name HN ) ( resid 20 and name HE# ) 5.0 3.2 2.5
assign ( resid 20 and name HN ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 20 and name HE# ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 22 and name HD# ) ( resid 17 and name HB1 ) 6.0 4.2 2.5
assign ( resid 22 and name HD# ) ( resid 17 and name HB2 ) 6.0 4.2 2.5
assign ( resid 22 and name HZ ) ( resid 17 and name HE# ) 6.0 4.2 2.5
assign ( resid 22 and name HN ) ( resid 22 and name HD# ) 2.8 1 2.5
assign ( resid 22 and name HB1 ) ( resid 22 and name HD# ) 4.0 2.2 2.5
assign ( resid 22 and name HB2 ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 22 and name HD# ) ( resid 22 and name HA ) 5.0 3.2 2.5
assign ( resid 22 and name HD# ) ( resid 22 and name HB1 ) 5.0 3.2 2.5
assign ( resid 22 and name HD# ) ( resid 22 and name HE# ) 2.8 1 2.5
assign ( resid 22 and name HD# ) ( resid 22 and name HZ ) 6.0 4.2 2.5
!assign ( resid 22 and name HE# ) ( resid 22 and name HD# ) 2.8 1 2.5
!assign ( resid 22 and name HE# ) ( resid 22 and name HZ ) 5.0 3.2 2.5
assign ( resid 22 and name HZ ) ( resid 22 and name HE# ) 4.0 2.2 2.5
assign ( resid 22 and name HD# ) ( resid 47 and name HA ) 6.0 4.2 2.5
assign ( resid 22 and name HE# ) ( resid 47 and name HA ) 5.0 3.2 2.5
!assign ( resid 22 and name HE# ) ( resid 47 and name HD1# ) 6.0 4.2 2.5
assign ( resid 23 and name HN ) ( resid 22 and name HD# ) 2.8 1 2.5
assign ( resid 23 and name HN ) ( resid 22 and name HE# ) 5.0 3.2 2.5
assign ( resid 33 and name HB1 ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 38 and name HE# ) 5.0 3.2 2.5
assign ( resid 37 and name HA ) ( resid 38 and name HE# ) 5.0 3.2 2.5
assign ( resid 37 and name HN ) ( resid 38 and name HD# ) 5.0 3.2 2.5
!assign ( resid 38 and name HD# ) ( resid 10 and name HA ) 6.0 4.2 2.5
assign ( resid 38 and name HD# ) ( resid 10 and name HB2 ) 6.0 4.2 2.5
assign ( resid 38 and name HD# ) ( resid 10 and name HD1# ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 10 and name HA ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 10 and name HB1 ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 10 and name HB2 ) 4.0 2.2 2.5
!assign ( resid 38 and name HE# ) ( resid 10 and name HD2# ) 2.8 1 2.5
assign ( resid 38 and name HE# ) ( resid 10 and name HN ) 5.0 3.2 2.5
assign ( resid 38 and name HD# ) ( resid 12 and name HN ) 6.0 4.2 2.5
assign ( resid 38 and name HE# ) ( resid 12 and name HN ) 6.0 4.2 2.5
assign ( resid 38 and name HD# ) ( resid 33 and name HB2 ) 6.0 4.2 2.5
assign ( resid 38 and name HD# ) ( resid 33 and name HD2# ) 6.0 4.2 2.5
assign ( resid 38 and name HE# ) ( resid 33 and name HB2 ) 6.0 4.2 2.5
assign ( resid 38 and name HE# ) ( resid 33 and name HD1# ) 6.0 4.2 2.5
assign ( resid 38 and name HE# ) ( resid 34 and name HA ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 34 and name HG1 ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 34 and name HG2 ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 38 and name HD# ) 2.8 1 2.5
assign ( resid 38 and name HA ) ( resid 38 and name HD# ) 4.0 2.2 2.5
assign ( resid 38 and name HB1 ) ( resid 38 and name HD# ) 4.0 2.2 2.5
!assign ( resid 38 and name HD# ) ( resid 38 and name HA ) 5.0 3.2 2.5
assign ( resid 38 and name HD# ) ( resid 38 and name HB2 ) 4.0 2.2 2.5
!assign ( resid 38 and name HD# ) ( resid 38 and name HN ) 6.0 4.2 2.5
assign ( resid 38 and name HE# ) ( resid 38 and name HB2 ) 5.0 3.2 2.5
assign ( resid 38 and name HE# ) ( resid 38 and name HN ) 6.0 4.2 2.5
!assign ( resid 38 and name HD# ) ( resid 39 and name HN ) 6.0 4.2 2.5
assign ( resid 39 and name HN ) ( resid 38 and name HD# ) 5.0 3.2 2.5
assign ( resid 44 and name HD1# ) ( resid 49 and name HD# ) 4.0 2.2 2.5
assign ( resid 47 and name HD1# ) ( resid 22 and name HE# ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 22 and name HE# ) 5.0 3.2 2.5
assign ( resid 47 and name HN ) ( resid 49 and name HE# ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 22 and name HE# ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 22 and name HD# ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 49 and name HE# ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 49 and name HD# ) 4.0 2.2 2.5
assign ( resid 49 and name HD# ) ( resid 22 and name HZ ) 6.0 4.2 2.5
assign ( resid 49 and name HE# ) ( resid 22 and name HZ ) 5.0 3.2 2.5
assign ( resid 49 and name HD# ) ( resid 44 and name HB1 ) 6.0 4.2 2.5
!assign ( resid 49 and name HD# ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 49 and name HD# ) ( resid 44 and name HD2# ) 5.0 3.2 2.5
assign ( resid 49 and name HE# ) ( resid 44 and name HD1# ) 6.0 4.2 2.5
assign ( resid 49 and name HE# ) ( resid 44 and name HD2# ) 5.0 3.2 2.5
assign ( resid 49 and name HD# ) ( resid 48 and name HB1 ) 6.0 4.2 2.5
assign ( resid 49 and name HE# ) ( resid 48 and name HB1 ) 5.0 3.2 2.5
assign ( resid 49 and name HN ) ( resid 49 and name HE# ) 5.0 3.2 2.5
assign ( resid 49 and name HA ) ( resid 49 and name HD# ) 4.0 2.2 2.5
assign ( resid 49 and name HB1 ) ( resid 49 and name HD# ) 5.0 3.2 2.5
assign ( resid 49 and name HB2 ) ( resid 49 and name HD# ) 5.0 3.2 2.5
assign ( resid 49 and name HD# ) ( resid 49 and name HA ) 5.0 3.2 2.5
!assign ( resid 49 and name HD# ) ( resid 49 and name HB1 ) 5.0 3.2 2.5
!assign ( resid 49 and name HD# ) ( resid 49 and name HB2 ) 5.0 3.2 2.5
!assign ( resid 49 and name HD# ) ( resid 49 and name HE# ) 2.8 1 2.5
assign ( resid 49 and name HE# ) ( resid 49 and name HB1 ) 6.0 4.2 2.5
assign ( resid 49 and name HE# ) ( resid 49 and name HB2 ) 6.0 4.2 2.5
assign ( resid 49 and name HE# ) ( resid 49 and name HD# ) 2.5 0.7 2.5
assign ( resid 50 and name HN ) ( resid 49 and name HD# ) 4.0 2.2 2.5
assign ( resid 50 and name HN ) ( resid 49 and name HE# ) 5.0 3.2 2.5
assign ( resid 51 and name HN ) ( resid 49 and name HD# ) 5.0 3.2 2.5
assign ( resid 51 and name HN ) ( resid 49 and name HE# ) 5.0 3.2 2.5
clas NHNH
assign ( resid 5 and name HN ) ( resid 6 and name HN ) 4.0 2.2 0.5
!assign ( resid 6 and name HN ) ( resid 5 and name HN ) 4.0 2.2 0.5
assign ( resid 7 and name HN ) ( resid 10 and name HN ) 5.0 3.2 0.5
assign ( resid 7 and name HN ) ( resid 11 and name HN ) 5.0 3.2 0.5
!assign ( resid 9 and name HN ) ( resid 10 and name HN ) 4.0 2.2 0.5
!assign ( resid 10 and name HN ) ( resid 7 and name HN ) 5.0 3.2 0.5
assign ( resid 10 and name HN ) ( resid 9 and name HN ) 2.8 1 0.5
assign ( resid 10 and name HN ) ( resid 11 and name HN ) 4.0 2.2 0.5
assign ( resid 10 and name HN ) ( resid 12 and name HN ) 5.0 3.2 0.5
assign ( resid 11 and name HN ) ( resid 9 and name HN ) 5.0 3.2 0.5
!assign ( resid 11 and name HN ) ( resid 10 and name HN ) 4.0 2.2 0.5
!assign ( resid 11 and name HN ) ( resid 12 and name HN ) 4.0 2.2 0.5
assign ( resid 12 and name HN ) ( resid 7 and name HN ) 5.0 3.2 0.5
!assign ( resid 12 and name HN ) ( resid 10 and name HN ) 5.0 3.2 0.5
assign ( resid 12 and name HN ) ( resid 11 and name HN ) 2.8 1 0.5
assign ( resid 12 and name HN ) ( resid 14 and name HN ) 5.0 3.2 0.5
!assign ( resid 13 and name HN ) ( resid 14 and name HN ) 4.0 2.2 0.5
assign ( resid 14 and name HN ) ( resid 10 and name HN ) 5.0 3.2 0.5
assign ( resid 14 and name HN ) ( resid 13 and name HN ) 2.8 1 0.5
assign ( resid 14 and name HN ) ( resid 16 and name HN ) 4.0 2.2 0.5
assign ( resid 15 and name HN ) ( resid 10 and name HN ) 5.0 3.2 0.5
assign ( resid 15 and name HN ) ( resid 14 and name HN ) 4.0 2.2 0.5
assign ( resid 15 and name HN ) ( resid 16 and name HN ) 2.8 1 0.5
assign ( resid 15 and name HN ) ( resid 17 and name HN ) 5.0 3.2 0.5
!assign ( resid 15 and name HN ) ( resid 18 and name HN ) 5.0 3.2 0.5
!assign ( resid 16 and name HN ) ( resid 14 and name HN ) 5.0 3.2 0.5
!assign ( resid 16 and name HN ) ( resid 15 and name HN ) 2.8 1 0.5
assign ( resid 16 and name HN ) ( resid 17 and name HN ) 2.8 1 0.5
assign ( resid 16 and name HN ) ( resid 18 and name HN ) 5.0 3.2 0.5
!assign ( resid 17 and name HN ) ( resid 15 and name HN ) 5.0 3.2 0.5
!assign ( resid 17 and name HN ) ( resid 16 and name HN ) 4.0 2.2 0.5
assign ( resid 17 and name HN ) ( resid 18 and name HN ) 4.0 2.2 0.5
assign ( resid 18 and name HN ) ( resid 15 and name HN ) 4.0 2.2 0.5
!assign ( resid 18 and name HN ) ( resid 17 and name HN ) 4.0 2.2 0.5
assign ( resid 18 and name HN ) ( resid 19 and name HN ) 2.8 1 0.5
assign ( resid 18 and name HN ) ( resid 20 and name HN ) 5.0 3.2 0.5
assign ( resid 19 and name HN ) ( resid 17 and name HN ) 5.0 3.2 0.5
!assign ( resid 19 and name HN ) ( resid 18 and name HN ) 4.0 2.2 0.5
assign ( resid 19 and name HN ) ( resid 20 and name HN ) 4.0 2.2 0.5
assign ( resid 19 and name HN ) ( resid 21 and name HN ) 4.0 2.2 0.5
!assign ( resid 20 and name HN ) ( resid 19 and name HN ) 4.0 2.2 0.5
assign ( resid 20 and name HN ) ( resid 21 and name HN ) 4.0 2.2 0.5
!assign ( resid 20 and name HN ) ( resid 22 and name HN ) 5.0 3.2 0.5
!assign ( resid 21 and name HN ) ( resid 19 and name HN ) 4.0 2.2 0.5
!assign ( resid 21 and name HN ) ( resid 20 and name HN ) 4.0 2.2 0.5
assign ( resid 21 and name HN ) ( resid 22 and name HN ) 2.8 1 0.5
assign ( resid 22 and name HN ) ( resid 19 and name HN ) 5.0 3.2 0.5
assign ( resid 22 and name HN ) ( resid 20 and name HN ) 4.0 2.2 0.5
!assign ( resid 22 and name HN ) ( resid 21 and name HN ) 4.0 2.2 0.5
assign ( resid 22 and name HN ) ( resid 23 and name HN ) 5.0 3.2 0.5
!assign ( resid 23 and name HN ) ( resid 22 and name HN ) 5.0 3.2 0.5
assign ( resid 24 and name HN ) ( resid 25 and name HN ) 5.0 3.2 0.5
assign ( resid 25 and name HN ) ( resid 26 and name HN ) 4.0 2.2 0.5
assign ( resid 25 and name HN ) ( resid 27 and name HN ) 5.0 3.2 0.5
assign ( resid 25 and name HN ) ( resid 28 and name HN ) 5.0 3.2 0.5
assign ( resid 25 and name HN ) ( resid 29 and name HN ) 5.0 3.2 0.5
!assign ( resid 26 and name HN ) ( resid 25 and name HN ) 5.0 3.2 0.5
!assign ( resid 26 and name HN ) ( resid 27 and name HN ) 5.0 3.2 0.5
assign ( resid 27 and name HN ) ( resid 26 and name HN ) 4.0 2.2 0.5
assign ( resid 27 and name HN ) ( resid 28 and name HN ) 4.0 2.2 0.5
!assign ( resid 28 and name HN ) ( resid 25 and name HN ) 5.0 3.2 0.5
assign ( resid 28 and name HN ) ( resid 26 and name HN ) 5.0 3.2 0.5
!assign ( resid 28 and name HN ) ( resid 27 and name HN ) 4.0 2.2 0.5
assign ( resid 28 and name HN ) ( resid 29 and name HN ) 4.0 2.2 0.5
assign ( resid 28 and name HN ) ( resid 30 and name HN ) 5.0 3.2 0.5
!assign ( resid 29 and name HN ) ( resid 28 and name HN ) 5.0 3.2 0.5
assign ( resid 29 and name HN ) ( resid 30 and name HN ) 4.0 2.2 0.5
!assign ( resid 30 and name HN ) ( resid 29 and name HN ) 4.0 2.2 0.5
assign ( resid 30 and name HN ) ( resid 31 and name HN ) 4.0 2.2 0.5
!assign ( resid 31 and name HN ) ( resid 30 and name HN ) 5.0 3.2 0.5
!assign ( resid 31 and name HN ) ( resid 32 and name HN ) 5.0 3.2 0.5
assign ( resid 32 and name HN ) ( resid 29 and name HN ) 5.0 3.2 0.5
assign ( resid 32 and name HN ) ( resid 31 and name HN ) 4.0 2.2 0.5
assign ( resid 32 and name HN ) ( resid 33 and name HN ) 4.0 2.2 0.5
!assign ( resid 33 and name HN ) ( resid 32 and name HN ) 5.0 3.2 0.5
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 5.0 3.2 0.5
assign ( resid 34 and name HN ) ( resid 32 and name HN ) 5.0 3.2 0.5
!assign ( resid 34 and name HN ) ( resid 33 and name HN ) 5.0 3.2 0.5
assign ( resid 34 and name HN ) ( resid 35 and name HN ) 5.0 3.2 0.5
!assign ( resid 35 and name HN ) ( resid 34 and name HN ) 4.0 2.2 0.5
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 5.0 3.2 0.5
!assign ( resid 36 and name HN ) ( resid 35 and name HN ) 5.0 3.2 0.5
assign ( resid 36 and name HN ) ( resid 37 and name HN ) 4.0 2.2 0.5
assign ( resid 36 and name HN ) ( resid 38 and name HN ) 5.0 3.2 0.5
assign ( resid 37 and name HN ) ( resid 35 and name HN ) 5.0 3.2 0.5
!assign ( resid 37 and name HN ) ( resid 36 and name HN ) 4.0 2.2 0.5
!assign ( resid 37 and name HN ) ( resid 38 and name HN ) 4.0 2.2 0.5
assign ( resid 37 and name HN ) ( resid 39 and name HN ) 5.0 3.2 0.5
assign ( resid 38 and name HN ) ( resid 35 and name HN ) 5.0 3.2 0.5
!assign ( resid 38 and name HN ) ( resid 36 and name HN ) 5.0 3.2 0.5
assign ( resid 38 and name HN ) ( resid 37 and name HN ) 2.8 1 0.5
!assign ( resid 38 and name HN ) ( resid 39 and name HN ) 4.0 2.2 0.5
assign ( resid 39 and name HN ) ( resid 36 and name HN ) 5.0 3.2 0.5
!assign ( resid 39 and name HN ) ( resid 37 and name HN ) 5.0 3.2 0.5
assign ( resid 39 and name HN ) ( resid 38 and name HN ) 2.8 1 0.5
assign ( resid 39 and name HN ) ( resid 42 and name HN ) 5.0 3.2 0.5
assign ( resid 40 and name HN ) ( resid 39 and name HN ) 4.0 2.2 0.5
assign ( resid 40 and name HN ) ( resid 41 and name HN ) 2.8 1 0.5
assign ( resid 40 and name HN ) ( resid 42 and name HN ) 5.0 3.2 0.5
!assign ( resid 41 and name HN ) ( resid 40 and name HN ) 2.8 1 0.5
assign ( resid 41 and name HN ) ( resid 42 and name HN ) 2.8 1 0.5
assign ( resid 41 and name HN ) ( resid 44 and name HN ) 5.0 3.2 0.5
!assign ( resid 42 and name HN ) ( resid 39 and name HN ) 5.0 3.2 0.5
!assign ( resid 42 and name HN ) ( resid 40 and name HN ) 5.0 3.2 0.5
assign ( resid 42 and name HN ) ( resid 43 and name HN ) 2.8 1 0.5
assign ( resid 42 and name HN ) ( resid 44 and name HN ) 5.0 3.2 0.5
assign ( resid 43 and name HN ) ( resid 39 and name HN ) 5.0 3.2 0.5
!assign ( resid 43 and name HN ) ( resid 42 and name HN ) 2.8 1 0.5
assign ( resid 43 and name HN ) ( resid 44 and name HN ) 2.8 1 0.5
!assign ( resid 44 and name HN ) ( resid 43 and name HN ) 5.0 3.2 0.5
assign ( resid 44 and name HN ) ( resid 45 and name HN ) 4.0 2.2 0.5
assign ( resid 45 and name HN ) ( resid 43 and name HN ) 5.0 3.2 0.5
!assign ( resid 45 and name HN ) ( resid 44 and name HN ) 4.0 2.2 0.5
assign ( resid 45 and name HN ) ( resid 46 and name HN ) 2.8 1 0.5
assign ( resid 45 and name HN ) ( resid 47 and name HN ) 5.0 3.2 0.5
!assign ( resid 46 and name HN ) ( resid 45 and name HN ) 2.8 1 0.5
assign ( resid 46 and name HN ) ( resid 47 and name HN ) 4.0 2.2 0.5
assign ( resid 46 and name HN ) ( resid 48 and name HN ) 5.0 3.2 0.5
!assign ( resid 47 and name HN ) ( resid 45 and name HN ) 5.0 3.2 0.5
!assign ( resid 47 and name HN ) ( resid 46 and name HN ) 5.0 3.2 0.5
assign ( resid 47 and name HN ) ( resid 48 and name HN ) 4.0 2.2 0.5
!assign ( resid 47 and name HN ) ( resid 49 and name HN ) 5.0 3.2 0.5
assign ( resid 48 and name HN ) ( resid 49 and name HN ) 4.0 2.2 0.5
assign ( resid 49 and name HN ) ( resid 47 and name HN ) 4.0 2.2 0.5
!assign ( resid 49 and name HN ) ( resid 48 and name HN ) 4.0 2.2 0.5
!assign ( resid 49 and name HN ) ( resid 50 and name HN ) 5.0 3.2 0.5
assign ( resid 50 and name HN ) ( resid 49 and name HN ) 4.0 2.2 0.5
assign ( resid 50 and name HN ) ( resid 51 and name HN ) 2.8 1 0.5
!assign ( resid 51 and name HN ) ( resid 50 and name HN ) 2.8 1 0.5
assign ( resid 5 and name HN ) ( resid 4 and name HA ) 2.5 0.7 0.5
assign ( resid 5 and name HN ) ( resid 5 and name HA ) 2.8 1 0.5
assign ( resid 6 and name HN ) ( resid 4 and name HA ) 5.0 3.2 0.5
assign ( resid 6 and name HN ) ( resid 5 and name HA ) 2.5 0.7 0.5
assign ( resid 6 and name HN ) ( resid 6 and name HA ) 2.8 1 0.5
assign ( resid 7 and name HN ) ( resid 4 and name HA ) 5.0 3.2 0.5
assign ( resid 7 and name HN ) ( resid 6 and name HA ) 2.5 0.7 0.5
assign ( resid 7 and name HN ) ( resid 7 and name HA ) 2.8 1 0.5
assign ( resid 9 and name HN ) ( resid 7 and name HA ) 5.0 3.2 0.5
!assign ( resid 9 and name HN ) ( resid 8 and name HA ) 5.0 3.2 0.5
assign ( resid 9 and name HN ) ( resid 9 and name HA ) 4.0 2.2 0.5
assign ( resid 10 and name HN ) ( resid 8 and name HA ) 5.0 3.2 0.5
assign ( resid 10 and name HN ) ( resid 9 and name HA ) 4.0 2.2 0.5
assign ( resid 10 and name HN ) ( resid 10 and name HA ) 4.0 2.2 0.5
assign ( resid 10 and name HN ) ( resid 11 and name HA ) 5.0 3.2 0.5
assign ( resid 11 and name HN ) ( resid 8 and name HA ) 4.0 2.2 0.5
assign ( resid 11 and name HN ) ( resid 10 and name HA ) 5.0 3.2 0.5
assign ( resid 11 and name HN ) ( resid 11 and name HA ) 4.0 2.2 0.5
assign ( resid 12 and name HN ) ( resid 9 and name HA ) 4.0 2.2 0.5
assign ( resid 12 and name HN ) ( resid 11 and name HA ) 4.0 2.2 0.5
assign ( resid 12 and name HN ) ( resid 12 and name HA ) 2.8 1 0.5
assign ( resid 13 and name HN ) ( resid 11 and name HA ) 5.0 3.2 0.5
assign ( resid 13 and name HN ) ( resid 12 and name HA ) 4.0 2.2 0.5
assign ( resid 13 and name HN ) ( resid 13 and name HA ) 2.8 1 0.5
assign ( resid 13 and name HN ) ( resid 14 and name HA ) 5.0 3.2 0.5
assign ( resid 14 and name HN ) ( resid 11 and name HA ) 4.0 2.2 0.5
assign ( resid 14 and name HN ) ( resid 13 and name HA ) 4.0 2.2 0.5
assign ( resid 14 and name HN ) ( resid 14 and name HA ) 2.8 1 0.5
assign ( resid 14 and name HN ) ( resid 15 and name HA ) 4.0 2.2 0.5
assign ( resid 15 and name HN ) ( resid 11 and name HA ) 4.0 2.2 0.5
assign ( resid 15 and name HN ) ( resid 13 and name HA ) 5.0 3.2 0.5
assign ( resid 15 and name HN ) ( resid 14 and name HA ) 4.0 2.2 0.5
assign ( resid 15 and name HN ) ( resid 15 and name HA ) 2.8 1 0.5
assign ( resid 16 and name HN ) ( resid 13 and name HA ) 4.0 2.2 0.5
assign ( resid 16 and name HN ) ( resid 14 and name HA ) 5.0 3.2 0.5
assign ( resid 16 and name HN ) ( resid 16 and name HA ) 2.5 0.7 0.5
assign ( resid 16 and name HN ) ( resid 17 and name HA ) 5.0 3.2 0.5
assign ( resid 17 and name HN ) ( resid 13 and name HA ) 5.0 3.2 0.5
assign ( resid 17 and name HN ) ( resid 14 and name HA ) 5.0 3.2 0.5
assign ( resid 17 and name HN ) ( resid 16 and name HA ) 4.0 2.2 0.5
assign ( resid 17 and name HN ) ( resid 17 and name HA ) 4.0 2.2 0.5
assign ( resid 18 and name HN ) ( resid 14 and name HA ) 4.0 2.2 0.5
assign ( resid 18 and name HN ) ( resid 15 and name HA ) 2.8 1 0.5
assign ( resid 18 and name HN ) ( resid 17 and name HA ) 4.0 2.2 0.5
assign ( resid 18 and name HN ) ( resid 18 and name HA ) 2.8 1 0.5
assign ( resid 18 and name HN ) ( resid 19 and name HA ) 5.0 3.2 0.5
assign ( resid 19 and name HN ) ( resid 18 and name HA ) 4.0 2.2 0.5
assign ( resid 19 and name HN ) ( resid 19 and name HA ) 2.8 1 0.5
assign ( resid 20 and name HN ) ( resid 19 and name HA ) 5.0 3.2 0.5
assign ( resid 20 and name HN ) ( resid 20 and name HA ) 4.0 2.2 0.5
assign ( resid 21 and name HN ) ( resid 19 and name HA ) 5.0 3.2 0.5
assign ( resid 21 and name HN ) ( resid 20 and name HA ) 4.0 2.2 0.5
assign ( resid 21 and name HN ) ( resid 22 and name HA ) 5.0 3.2 0.5
assign ( resid 22 and name HN ) ( resid 20 and name HA ) 5.0 3.2 0.5
assign ( resid 22 and name HN ) ( resid 22 and name HA ) 4.0 2.2 0.5
assign ( resid 22 and name HN ) ( resid 23 and name HA ) 4.0 2.2 0.5
!assign ( resid 23 and name HN ) ( resid 22 and name HA ) 2.8 1 0.5
assign ( resid 23 and name HN ) ( resid 23 and name HA ) 2.8 1 0.5
!assign ( resid 24 and name HN ) ( resid 23 and name HA ) 2.8 1 0.5
assign ( resid 24 and name HN ) ( resid 24 and name HA ) 4.0 2.2 0.5
!assign ( resid 24 and name HN ) ( resid 25 and name HA ) 5.0 3.2 0.5
assign ( resid 25 and name HN ) ( resid 24 and name HA ) 2.8 1 0.5
assign ( resid 25 and name HN ) ( resid 25 and name HA ) 2.8 1 0.5
assign ( resid 26 and name HN ) ( resid 25 and name HA ) 2.8 1 0.5
assign ( resid 28 and name HN ) ( resid 28 and name HA ) 2.8 1 0.5
assign ( resid 28 and name HN ) ( resid 29 and name HA ) 5.0 3.2 0.5
assign ( resid 29 and name HN ) ( resid 24 and name HA ) 4.0 2.2 0.5
assign ( resid 29 and name HN ) ( resid 28 and name HA ) 5.0 3.2 0.5
assign ( resid 29 and name HN ) ( resid 29 and name HA ) 4.0 2.2 0.5
assign ( resid 30 and name HN ) ( resid 29 and name HA ) 5.0 3.2 0.5
assign ( resid 30 and name HN ) ( resid 30 and name HA ) 4.0 2.2 0.5
assign ( resid 30 and name HN ) ( resid 31 and name HA ) 5.0 3.2 0.5
assign ( resid 31 and name HN ) ( resid 31 and name HA ) 4.0 2.2 0.5
assign ( resid 32 and name HN ) ( resid 28 and name HA ) 4.0 2.2 0.5
assign ( resid 32 and name HN ) ( resid 29 and name HA ) 4.0 2.2 0.5
assign ( resid 32 and name HN ) ( resid 32 and name HA ) 2.8 1 0.5
assign ( resid 33 and name HN ) ( resid 29 and name HA ) 5.0 3.2 0.5
assign ( resid 33 and name HN ) ( resid 32 and name HA ) 5.0 3.2 0.5
assign ( resid 33 and name HN ) ( resid 33 and name HA ) 4.0 2.2 0.5
assign ( resid 34 and name HN ) ( resid 31 and name HA ) 5.0 3.2 0.5
assign ( resid 34 and name HN ) ( resid 34 and name HA ) 2.8 1 0.5
assign ( resid 35 and name HN ) ( resid 31 and name HA ) 5.0 3.2 0.5
assign ( resid 35 and name HN ) ( resid 34 and name HA ) 5.0 3.2 0.5
assign ( resid 35 and name HN ) ( resid 35 and name HA ) 4.0 2.2 0.5
assign ( resid 36 and name HN ) ( resid 33 and name HA ) 5.0 3.2 0.5
assign ( resid 36 and name HN ) ( resid 35 and name HA ) 4.0 2.2 0.5
assign ( resid 36 and name HN ) ( resid 36 and name HA ) 4.0 2.2 0.5
assign ( resid 36 and name HN ) ( resid 37 and name HA ) 5.0 3.2 0.5
assign ( resid 37 and name HN ) ( resid 36 and name HA ) 4.0 2.2 0.5
assign ( resid 37 and name HN ) ( resid 37 and name HA ) 2.5 0.7 0.5
assign ( resid 38 and name HN ) ( resid 35 and name HA ) 5.0 3.2 0.5
assign ( resid 38 and name HN ) ( resid 36 and name HA ) 5.0 3.2 0.5
assign ( resid 38 and name HN ) ( resid 37 and name HA ) 2.8 1 0.5
assign ( resid 38 and name HN ) ( resid 38 and name HA ) 2.8 1 0.5
assign ( resid 38 and name HN ) ( resid 39 and name HA ) 5.0 3.2 0.5
assign ( resid 39 and name HN ) ( resid 36 and name HA ) 5.0 3.2 0.5
assign ( resid 39 and name HN ) ( resid 37 and name HA ) 5.0 3.2 0.5
assign ( resid 39 and name HN ) ( resid 38 and name HA ) 4.0 2.2 0.5
assign ( resid 39 and name HN ) ( resid 39 and name HA ) 2.8 1 0.5
assign ( resid 40 and name HN ) ( resid 39 and name HA ) 2.5 0.7 0.5
assign ( resid 40 and name HN ) ( resid 40 and name HA ) 2.8 1 0.5
assign ( resid 41 and name HN ) ( resid 39 and name HA ) 4.0 2.2 0.5
assign ( resid 41 and name HN ) ( resid 40 and name HA ) 4.0 2.2 0.5
assign ( resid 41 and name HN ) ( resid 42 and name HA ) 5.0 3.2 0.5
assign ( resid 42 and name HN ) ( resid 39 and name HA ) 5.0 3.2 0.5
assign ( resid 42 and name HN ) ( resid 40 and name HA ) 4.0 2.2 0.5
assign ( resid 42 and name HN ) ( resid 42 and name HA ) 2.5 0.7 0.5
assign ( resid 43 and name HN ) ( resid 39 and name HA ) 5.0 3.2 0.5
assign ( resid 43 and name HN ) ( resid 40 and name HA ) 2.8 1 0.5
assign ( resid 43 and name HN ) ( resid 42 and name HA ) 2.8 1 0.5
assign ( resid 43 and name HN ) ( resid 43 and name HA ) 2.8 1 0.5
assign ( resid 44 and name HN ) ( resid 44 and name HA ) 4.0 2.2 0.5
assign ( resid 45 and name HN ) ( resid 42 and name HA ) 2.8 1 0.5
assign ( resid 45 and name HN ) ( resid 44 and name HA ) 4.0 2.2 0.5
assign ( resid 45 and name HN ) ( resid 45 and name HA ) 2.8 1 0.5
assign ( resid 45 and name HN ) ( resid 46 and name HA ) 5.0 3.2 0.5
assign ( resid 46 and name HN ) ( resid 43 and name HA ) 4.0 2.2 0.5
assign ( resid 46 and name HN ) ( resid 44 and name HA ) 5.0 3.2 0.5
assign ( resid 46 and name HN ) ( resid 45 and name HA ) 4.0 2.2 0.5
assign ( resid 46 and name HN ) ( resid 46 and name HA ) 2.8 1 0.5
assign ( resid 46 and name HN ) ( resid 50 and name HA ) 5.0 3.2 0.5
assign ( resid 47 and name HN ) ( resid 43 and name HA ) 5.0 3.2 0.5
assign ( resid 47 and name HN ) ( resid 44 and name HA ) 4.0 2.2 0.5
assign ( resid 47 and name HN ) ( resid 46 and name HA ) 4.0 2.2 0.5
assign ( resid 47 and name HN ) ( resid 47 and name HA ) 4.0 2.2 0.5
assign ( resid 48 and name HN ) ( resid 44 and name HA ) 5.0 3.2 0.5
assign ( resid 48 and name HN ) ( resid 47 and name HA ) 5.0 3.2 0.5
assign ( resid 48 and name HN ) ( resid 48 and name HA ) 2.8 1 0.5
assign ( resid 49 and name HN ) ( resid 44 and name HA ) 5.0 3.2 0.5
assign ( resid 49 and name HN ) ( resid 49 and name HA ) 4.0 2.2 0.5
assign ( resid 50 and name HN ) ( resid 49 and name HA ) 2.5 0.7 0.5
assign ( resid 50 and name HN ) ( resid 50 and name HA ) 2.8 1 0.5
assign ( resid 51 and name HN ) ( resid 49 and name HA ) 5.0 3.2 0.5
assign ( resid 51 and name HN ) ( resid 50 and name HA ) 2.5 0.7 0.5
assign ( resid 51 and name HN ) ( resid 51 and name HA ) 2.8 1 0.5
assign ( resid 51 and name HN ) ( resid 52 and name HA ) 4.0 2.2 0.5
assign ( resid 52 and name HN ) ( resid 51 and name HA ) 2.5 0.7 0.5
assign ( resid 52 and name HN ) ( resid 52 and name HA ) 2.8 1 0.5
assign ( resid 21 and name HN ) ( resid 21 and name HA1 ) 2.8 1 0.5
assign ( resid 22 and name HN ) ( resid 21 and name HA1 ) 4.0 2.2 0.5
assign ( resid 25 and name HN ) ( resid 26 and name HA1 ) 5.0 3.2 0.5
assign ( resid 26 and name HN ) ( resid 26 and name HA1 ) 4.0 2.2 0.5
assign ( resid 26 and name HN ) ( resid 27 and name HA1 ) 5.0 3.2 0.5
assign ( resid 27 and name HN ) ( resid 26 and name HA1 ) 4.0 2.2 0.5
assign ( resid 27 and name HN ) ( resid 27 and name HA1 ) 2.8 1 0.5
assign ( resid 28 and name HN ) ( resid 27 and name HA1 ) 4.0 2.2 0.5
assign ( resid 40 and name HN ) ( resid 41 and name HA1 ) 4.0 2.2 0.5
assign ( resid 41 and name HN ) ( resid 41 and name HA1 ) 2.5 0.7 0.5
assign ( resid 42 and name HN ) ( resid 41 and name HA1 ) 2.8 1 0.5
assign ( resid 43 and name HN ) ( resid 41 and name HA1 ) 4.0 2.2 0.5
assign ( resid 20 and name HN ) ( resid 21 and name HA2 ) 5.0 3.2 0.5
assign ( resid 21 and name HN ) ( resid 21 and name HA2 ) 2.8 1 0.5
assign ( resid 22 and name HN ) ( resid 21 and name HA2 ) 4.0 2.2 0.5
assign ( resid 25 and name HN ) ( resid 26 and name HA2 ) 5.0 3.2 0.5
assign ( resid 26 and name HN ) ( resid 26 and name HA2 ) 2.8 1 0.5
assign ( resid 27 and name HN ) ( resid 26 and name HA2 ) 4.0 2.2 0.5
assign ( resid 27 and name HN ) ( resid 27 and name HA2 ) 2.8 1 0.5
assign ( resid 28 and name HN ) ( resid 26 and name HA2 ) 5.0 3.2 0.5
assign ( resid 40 and name HN ) ( resid 41 and name HA2 ) 4.0 2.2 0.5
assign ( resid 41 and name HN ) ( resid 41 and name HA2 ) 2.5 0.7 0.5
assign ( resid 42 and name HN ) ( resid 41 and name HA2 ) 2.8 1 0.5
assign ( resid 44 and name HN ) ( resid 41 and name HA2 ) 5.0 3.2 0.5
assign ( resid 45 and name HN ) ( resid 41 and name HA2 ) 5.0 3.2 0.5
!assign ( resid 4 and name HA ) ( resid 5 and name HN ) 4.0 2.2 0.5
!assign ( resid 6 and name HA ) ( resid 7 and name HN ) 4.0 2.2 0.5
assign ( resid 8 and name HA ) ( resid 9 and name HN ) 5.0 3.2 0.5
!assign ( resid 8 and name HA ) ( resid 11 and name HN ) 5.0 3.2 0.5
assign ( resid 9 and name HA ) ( resid 9 and name HN ) 5.0 3.2 0.5
assign ( resid 11 and name HA ) ( resid 11 and name HN ) 4.0 2.2 0.5
assign ( resid 12 and name HA ) ( resid 12 and name HN ) 2.8 1 0.5
assign ( resid 14 and name HA ) ( resid 14 and name HN ) 4.0 2.2 0.5
assign ( resid 17 and name HA ) ( resid 17 and name HN ) 4.0 2.2 0.5
assign ( resid 18 and name HA ) ( resid 18 and name HN ) 4.0 2.2 0.5
assign ( resid 18 and name HA ) ( resid 22 and name HN ) 4.0 2.2 0.5
assign ( resid 19 and name HA ) ( resid 19 and name HN ) 4.0 2.2 0.5
assign ( resid 22 and name HA ) ( resid 23 and name HN ) 2.8 1 0.5
assign ( resid 23 and name HA ) ( resid 24 and name HN ) 2.8 1 0.5
assign ( resid 24 and name HA ) ( resid 25 and name HN ) 4.0 2.2 0.5
!assign ( resid 29 and name HA ) ( resid 32 and name HN ) 5.0 3.2 0.5
assign ( resid 30 and name HA ) ( resid 30 and name HN ) 5.0 3.2 0.5
assign ( resid 31 and name HA ) ( resid 31 and name HN ) 5.0 3.2 0.5
assign ( resid 32 and name HA ) ( resid 32 and name HN ) 5.0 3.2 0.5
assign ( resid 33 and name HA ) ( resid 33 and name HN ) 5.0 3.2 0.5
assign ( resid 35 and name HA ) ( resid 35 and name HN ) 4.0 2.2 0.5
assign ( resid 36 and name HA ) ( resid 36 and name HN ) 5.0 3.2 0.5
assign ( resid 37 and name HA ) ( resid 37 and name HN ) 2.8 1 0.5
!assign ( resid 37 and name HA ) ( resid 38 and name HN ) 4.0 2.2 0.5
assign ( resid 38 and name HA ) ( resid 38 and name HN ) 2.8 1 0.5
assign ( resid 39 and name HA ) ( resid 39 and name HN ) 5.0 3.2 0.5
!assign ( resid 39 and name HA ) ( resid 40 and name HN ) 2.8 1 0.5
assign ( resid 40 and name HA ) ( resid 40 and name HN ) 4.0 2.2 0.5
assign ( resid 42 and name HA ) ( resid 42 and name HN ) 2.8 1 0.5
assign ( resid 43 and name HA ) ( resid 43 and name HN ) 5.0 3.2 0.5
assign ( resid 44 and name HA ) ( resid 44 and name HN ) 5.0 3.2 0.5
assign ( resid 46 and name HA ) ( resid 46 and name HN ) 5.0 3.2 0.5
assign ( resid 48 and name HA ) ( resid 48 and name HN ) 2.8 1 0.5
assign ( resid 48 and name HA ) ( resid 49 and name HN ) 5.0 3.2 0.5
assign ( resid 49 and name HA ) ( resid 49 and name HN ) 5.0 3.2 0.5
!assign ( resid 49 and name HA ) ( resid 50 and name HN ) 2.8 1 0.5
assign ( resid 50 and name HA ) ( resid 50 and name HN ) 5.0 3.2 0.5
!assign ( resid 50 and name HA ) ( resid 51 and name HN ) 5.0 3.2 0.5
assign ( resid 21 and name HA1 ) ( resid 21 and name HN ) 5.0 3.2 0.5
assign ( resid 27 and name HA1 ) ( resid 27 and name HN ) 5.0 3.2 0.5
assign ( resid 41 and name HA1 ) ( resid 41 and name HN ) 2.8 1 0.5
assign ( resid 21 and name HA2 ) ( resid 21 and name HN ) 4.0 2.2 0.5
assign ( resid 27 and name HA2 ) ( resid 27 and name HN ) 4.0 2.2 0.5
assign ( resid 41 and name HA2 ) ( resid 41 and name HN ) 4.0 2.2 0.5
clas intra
assign ( resid 3 and name HD1 ) ( resid 3 and name HA ) 2.8 1 2.5
assign ( resid 3 and name HD1 ) ( resid 3 and name HB2 ) 5.0 3.2 2.5
assign ( resid 3 and name HD1 ) ( resid 3 and name HG2 ) 2.8 1 2.5
assign ( resid 4 and name HA ) ( resid 4 and name HB1 ) 5.0 3.2 2
assign ( resid 4 and name HA ) ( resid 4 and name HB2 ) 2.8 1 2
assign ( resid 4 and name HD1 ) ( resid 4 and name HG2 ) 4.0 2.2 2.5
assign ( resid 4 and name HD2 ) ( resid 4 and name HG2 ) 2.8 1 2.5
assign ( resid 5 and name HN ) ( resid 5 and name HB1 ) 2.8 1 2
assign ( resid 5 and name HN ) ( resid 5 and name HB2 ) 2.5 0.7 2
assign ( resid 5 and name HN ) ( resid 5 and name HG2 ) 2.8 1 2.5
assign ( resid 6 and name HA ) ( resid 6 and name HB# ) 2.8 1 2.5
!assign ( resid 6 and name HB# ) ( resid 6 and name HN ) 2.8 1 2.5
assign ( resid 6 and name HN ) ( resid 6 and name HB# ) 2.5 0.7 2.5
!assign ( resid 7 and name HB1 ) ( resid 7 and name HN ) 5.0 3.2 2.5
assign ( resid 7 and name HN ) ( resid 7 and name HB1 ) 2.5 0.7 2
assign ( resid 8 and name HB1 ) ( resid 8 and name HA ) 2.8 1 2.5
assign ( resid 8 and name HD1 ) ( resid 8 and name HB1 ) 5.0 3.2 2.5
assign ( resid 8 and name HD1 ) ( resid 8 and name HG2 ) 2.8 1 2.5
assign ( resid 9 and name HB1 ) ( resid 9 and name HA ) 5.0 3.2 2.5
assign ( resid 9 and name HB1 ) ( resid 9 and name HD1 ) 5.0 3.2 2.5
assign ( resid 9 and name HB2 ) ( resid 9 and name HB1 ) 2.8 1 2.5
assign ( resid 9 and name HB2 ) ( resid 9 and name HG2 ) 4.0 2.2 2.5
!assign ( resid 9 and name HB2 ) ( resid 9 and name HN ) 5.0 3.2 2.5
!assign ( resid 9 and name HD1 ) ( resid 9 and name HB1 ) 5.0 3.2 2.5
assign ( resid 9 and name HD1 ) ( resid 9 and name HG2 ) 4.0 2.2 2.5
assign ( resid 9 and name HD2 ) ( resid 9 and name HB1 ) 5.0 3.2 2.5
assign ( resid 9 and name HD2 ) ( resid 9 and name HG2 ) 2.8 1 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HA ) 5.0 3.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HB1 ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HB2 ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HD1 ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HD2 ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HG2 ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 9 and name HN ) 5.0 3.2 2.5
!assign ( resid 9 and name HG2 ) ( resid 9 and name HN ) 5.0 3.2 2.5
assign ( resid 9 and name HN ) ( resid 9 and name HB1 ) 4.0 2.2 2
assign ( resid 9 and name HN ) ( resid 9 and name HB2 ) 4.0 2.2 2
assign ( resid 9 and name HN ) ( resid 9 and name HG2 ) 4.0 2.2 2.5
assign ( resid 10 and name HB1 ) ( resid 10 and name HD2# ) 4.0 2.2 2.5
!assign ( resid 10 and name HB1 ) ( resid 10 and name HN ) 4.0 2.2 2.5
assign ( resid 10 and name HB2 ) ( resid 10 and name HD2# ) 4.0 2.2 2.5
!assign ( resid 10 and name HB2 ) ( resid 10 and name HN ) 5.0 3.2 2.5
assign ( resid 10 and name HD2# ) ( resid 10 and name HA ) 2.8 1 2.5
assign ( resid 10 and name HN ) ( resid 10 and name HB1 ) 2.8 1 2
assign ( resid 10 and name HN ) ( resid 10 and name HB2 ) 2.8 1 2
assign ( resid 10 and name HN ) ( resid 10 and name HD1# ) 2.8 1 2.5
assign ( resid 10 and name HN ) ( resid 10 and name HD2# ) 2.8 1 2.5
assign ( resid 10 and name HN ) ( resid 10 and name HG ) 4.0 2.2 2.5
assign ( resid 11 and name HB ) ( resid 11 and name HA ) 4.0 2.2 2.5
assign ( resid 11 and name HB ) ( resid 11 and name HG12 ) 4.0 2.2 2.5
assign ( resid 11 and name HB ) ( resid 11 and name HN ) 4.0 2.2 2.5
assign ( resid 11 and name HD1# ) ( resid 11 and name HA ) 4.0 2.2 2.5
assign ( resid 11 and name HD1# ) ( resid 11 and name HB ) 4.0 2.2 2.5
assign ( resid 11 and name HD1# ) ( resid 11 and name HG11 ) 2.8 1 2.5
assign ( resid 11 and name HD1# ) ( resid 11 and name HG12 ) 2.5 0.7 2.5
!assign ( resid 11 and name HG11 ) ( resid 11 and name HN ) 4.0 2.2 2.5
!assign ( resid 11 and name HG12 ) ( resid 11 and name HN ) 5.0 3.2 2.5
!assign ( resid 11 and name HN ) ( resid 11 and name HB ) 2.8 1 2.5
assign ( resid 11 and name HN ) ( resid 11 and name HD1# ) 4.0 2.2 2.5
assign ( resid 11 and name HN ) ( resid 11 and name HG11 ) 2.8 1 2.5
assign ( resid 11 and name HN ) ( resid 11 and name HG12 ) 4.0 2.2 2.5
assign ( resid 11 and name HN ) ( resid 11 and name HG2# ) 2.8 1 2.5
!assign ( resid 12 and name HB1 ) ( resid 12 and name HN ) 2.8 1 2.5
!assign ( resid 12 and name HB2 ) ( resid 12 and name HN ) 2.8 1 2.5
!assign ( resid 12 and name HG2 ) ( resid 12 and name HN ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 12 and name HB1 ) 2.8 1 2
assign ( resid 12 and name HN ) ( resid 12 and name HB2 ) 2.8 1 2
assign ( resid 12 and name HN ) ( resid 12 and name HG2 ) 2.8 1 2.5
assign ( resid 13 and name HN ) ( resid 13 and name HB1 ) 2.8 1 2
assign ( resid 13 and name HN ) ( resid 13 and name HB2 ) 2.8 1 2
assign ( resid 14 and name HA ) ( resid 14 and name HD2# ) 2.8 1 2.5
assign ( resid 14 and name HB1 ) ( resid 14 and name HA ) 4.0 2.2 2.5
assign ( resid 14 and name HB1 ) ( resid 14 and name HD1# ) 2.8 1 2.5
!assign ( resid 14 and name HB1 ) ( resid 14 and name HN ) 4.0 2.2 2.5
assign ( resid 14 and name HB2 ) ( resid 14 and name HA ) 4.0 2.2 2.5
!assign ( resid 14 and name HB2 ) ( resid 14 and name HN ) 4.0 2.2 2.5
assign ( resid 14 and name HG ) ( resid 14 and name HN ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 14 and name HB1 ) 2.8 1 2
assign ( resid 14 and name HN ) ( resid 14 and name HB2 ) 2.5 0.7 2
assign ( resid 14 and name HN ) ( resid 14 and name HD1# ) 2.8 1 2.5
assign ( resid 14 and name HN ) ( resid 14 and name HD2# ) 4.0 2.2 2.5
assign ( resid 15 and name HN ) ( resid 15 and name HB1 ) 2.5 0.7 2
assign ( resid 16 and name HB2 ) ( resid 16 and name HA ) 4.0 2.2 2.5
!assign ( resid 16 and name HB2 ) ( resid 16 and name HN ) 4.0 2.2 2.5
assign ( resid 16 and name HE21 ) ( resid 16 and name HB2 ) 4.0 2.2 2.5
assign ( resid 16 and name HE21 ) ( resid 16 and name HG1 ) 5.0 3.2 2.5
assign ( resid 16 and name HE21 ) ( resid 16 and name HG2 ) 4.0 2.2 2.5
assign ( resid 16 and name HE22 ) ( resid 16 and name HB2 ) 4.0 2.2 2.5
assign ( resid 16 and name HE22 ) ( resid 16 and name HG1 ) 4.0 2.2 2.5
assign ( resid 16 and name HE22 ) ( resid 16 and name HG2 ) 4.0 2.2 2.5
assign ( resid 16 and name HN ) ( resid 16 and name HB1 ) 2.8 1 2
assign ( resid 16 and name HN ) ( resid 16 and name HB2 ) 2.8 1 2
assign ( resid 16 and name HN ) ( resid 16 and name HE22 ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 16 and name HG1 ) 2.8 1 2.5
assign ( resid 16 and name HN ) ( resid 16 and name HG2 ) 2.8 1 2.5
assign ( resid 17 and name HB1 ) ( resid 17 and name HN ) 5.0 3.2 2.5
!assign ( resid 17 and name HB2 ) ( resid 17 and name HN ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 17 and name HB2 ) 4.0 2.2 2
assign ( resid 17 and name HN ) ( resid 17 and name HG1 ) 4.0 2.2 2.5
assign ( resid 17 and name HN ) ( resid 17 and name HG2 ) 4.0 2.2 2.5
assign ( resid 18 and name HA ) ( resid 18 and name HB1 ) 2.8 1 2
assign ( resid 18 and name HA ) ( resid 18 and name HD2# ) 2.8 1 2.5
!assign ( resid 18 and name HB1 ) ( resid 18 and name HA ) 4.0 2.2 2.5
assign ( resid 18 and name HB1 ) ( resid 18 and name HN ) 5.0 3.2 2.5
assign ( resid 18 and name HB2 ) ( resid 18 and name HA ) 4.0 2.2 2.5
assign ( resid 18 and name HB2 ) ( resid 18 and name HN ) 4.0 2.2 2.5
assign ( resid 18 and name HG ) ( resid 18 and name HN ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 18 and name HB1 ) 2.5 0.7 2
assign ( resid 18 and name HN ) ( resid 18 and name HD1# ) 2.8 1 2.5
!assign ( resid 19 and name HB1 ) ( resid 19 and name HN ) 4.0 2.2 2.5
assign ( resid 19 and name HN ) ( resid 19 and name HB1 ) 2.8 1 2
assign ( resid 20 and name HB1 ) ( resid 20 and name HA ) 4.0 2.2 2.5
assign ( resid 20 and name HB2 ) ( resid 20 and name HA ) 4.0 2.2 2.5
assign ( resid 20 and name HG1 ) ( resid 20 and name HA ) 5.0 3.2 2.5
!assign ( resid 20 and name HG1 ) ( resid 20 and name HN ) 5.0 3.2 2.5
assign ( resid 20 and name HG2 ) ( resid 20 and name HA ) 5.0 3.2 2.5
assign ( resid 20 and name HN ) ( resid 20 and name HB1 ) 4.0 2.2 2
assign ( resid 20 and name HN ) ( resid 20 and name HB2 ) 4.0 2.2 2
assign ( resid 20 and name HN ) ( resid 20 and name HG1 ) 4.0 2.2 2.5
assign ( resid 20 and name HN ) ( resid 20 and name HG2 ) 5.0 3.2 2.5
assign ( resid 21 and name HA1 ) ( resid 21 and name HA2 ) 2.8 1 2.5
!assign ( resid 21 and name HA2 ) ( resid 21 and name HA1 ) 2.8 1 2.5
assign ( resid 22 and name HA ) ( resid 22 and name HB1 ) 4.0 2.2 2
assign ( resid 22 and name HA ) ( resid 22 and name HB2 ) 4.0 2.2 2
!assign ( resid 22 and name HB1 ) ( resid 22 and name HA ) 5.0 3.2 2.5
assign ( resid 22 and name HB1 ) ( resid 22 and name HB2 ) 2.8 1 2.5
!assign ( resid 22 and name HB2 ) ( resid 22 and name HB1 ) 2.8 1 2.5
assign ( resid 22 and name HN ) ( resid 22 and name HB1 ) 4.0 2.2 2
assign ( resid 22 and name HN ) ( resid 22 and name HB2 ) 4.0 2.2 2
assign ( resid 23 and name HB1 ) ( resid 23 and name HA ) 2.8 1 2.5
!assign ( resid 23 and name HB1 ) ( resid 23 and name HN ) 4.0 2.2 2.5
assign ( resid 23 and name HB2 ) ( resid 23 and name HA ) 2.8 1 2.5
assign ( resid 23 and name HN ) ( resid 23 and name HB1 ) 4.0 2.2 2
assign ( resid 23 and name HN ) ( resid 23 and name HB2 ) 4.0 2.2 2
assign ( resid 24 and name HA ) ( resid 24 and name HB1 ) 4.0 2.2 2
!assign ( resid 24 and name HA ) ( resid 24 and name HB1 ) 4.0 2.2 2
!assign ( resid 24 and name HB1 ) ( resid 24 and name HA ) 5.0 3.2 2.5
assign ( resid 24 and name HB1 ) ( resid 24 and name HB2) 2.8 1 2.5
!assign ( resid 24 and name HB1 ) ( resid 24 and name HB1 ) 2.8 1 2.5
!assign ( resid 24 and name HB1 ) ( resid 24 and name HN ) 5.0 3.2 2.5
!assign ( resid 24 and name HB1 ) ( resid 24 and name HN ) 5.0 3.2 2.5
assign ( resid 24 and name HN ) ( resid 24 and name HB2 ) 4.0 2.2 2
assign ( resid 24 and name HN ) ( resid 24 and name HB1 ) 4.0 2.2 2
assign ( resid 25 and name HA ) ( resid 25 and name HB1 ) 2.8 1 2
assign ( resid 25 and name HA ) ( resid 25 and name HG2 ) 2.8 1 2.5
!assign ( resid 25 and name HG2 ) ( resid 25 and name HA ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 25 and name HB2 ) 2.5 0.7 2
assign ( resid 25 and name HN ) ( resid 25 and name HG2 ) 2.8 1 2.5
assign ( resid 26 and name HA1 ) ( resid 26 and name HA2 ) 2.8 1 2.5
!assign ( resid 26 and name HA2 ) ( resid 26 and name HA1 ) 2.8 1 2.5
assign ( resid 28 and name HB1 ) ( resid 28 and name HB2 ) 2.8 1 2.5
!assign ( resid 28 and name HB2 ) ( resid 28 and name HB1 ) 2.8 1 2.5
assign ( resid 28 and name HD1 ) ( resid 28 and name HA ) 6.0 4.2 2.5
assign ( resid 28 and name HD1 ) ( resid 28 and name HB2 ) 5.0 3.2 2.5
!assign ( resid 28 and name HD1 ) ( resid 28 and name HE1 ) 4.0 2.2 2.5
!assign ( resid 28 and name HD1 ) ( resid 28 and name HN ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 28 and name HB1 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 28 and name HB2 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 28 and name HD1 ) 2.8 1 2.5
assign ( resid 28 and name HE1 ) ( resid 28 and name HH2 ) 5.0 3.2 2.5
!assign ( resid 28 and name HE1 ) ( resid 28 and name HN ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 28 and name HZ2 ) 2.8 1 2.5
assign ( resid 28 and name HE3 ) ( resid 28 and name HA ) 5.0 3.2 2.5
assign ( resid 28 and name HE3 ) ( resid 28 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HE3 ) ( resid 28 and name HZ3 ) 5.0 3.2 2.5
assign ( resid 28 and name HH2 ) ( resid 28 and name HE3 ) 4.0 2.2 2.5
assign ( resid 28 and name HH2 ) ( resid 28 and name HZ3 ) 4.0 2.2 2.5
assign ( resid 28 and name HN ) ( resid 28 and name HB2 ) 2.8 1 2
assign ( resid 28 and name HN ) ( resid 28 and name HD1 ) 2.8 1 2.5
assign ( resid 28 and name HN ) ( resid 28 and name HE1 ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 28 and name HE3 ) 4.0 2.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 28 and name HA ) 6.0 4.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 28 and name HD1 ) 5.0 3.2 2.5
!assign ( resid 28 and name HZ2 ) ( resid 28 and name HE1 ) 5.0 3.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 28 and name HH2 ) 4.0 2.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 28 and name HZ3 ) 6.0 4.2 2.5
!assign ( resid 28 and name HZ3 ) ( resid 28 and name HE3 ) 5.0 3.2 2.5
assign ( resid 29 and name HA ) ( resid 29 and name HB1 ) 5.0 3.2 2
assign ( resid 29 and name HA ) ( resid 29 and name HB2 ) 5.0 3.2 2
assign ( resid 29 and name HA ) ( resid 29 and name HD1# ) 2.8 1 2.5
!assign ( resid 29 and name HB1 ) ( resid 29 and name HA ) 5.0 3.2 2.5
assign ( resid 29 and name HB1 ) ( resid 29 and name HB2 ) 2.8 1 2.5
assign ( resid 29 and name HB1 ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
!assign ( resid 29 and name HB1 ) ( resid 29 and name HN ) 5.0 3.2 2.5
!assign ( resid 29 and name HB2 ) ( resid 29 and name HA ) 5.0 3.2 2.5
!assign ( resid 29 and name HB2 ) ( resid 29 and name HB1 ) 2.8 1 2.5
assign ( resid 29 and name HB2 ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
!assign ( resid 29 and name HB2 ) ( resid 29 and name HN ) 5.0 3.2 2.5
!assign ( resid 29 and name HD1# ) ( resid 29 and name HA ) 4.0 2.2 2.5
!assign ( resid 29 and name HD1# ) ( resid 29 and name HB2 ) 4.0 2.2 2.5
assign ( resid 29 and name HG ) ( resid 29 and name HA ) 2.8 1 2.5
assign ( resid 29 and name HG ) ( resid 29 and name HB1 ) 2.8 1 2.5
assign ( resid 29 and name HG ) ( resid 29 and name HB2 ) 4.0 2.2 2.5
assign ( resid 29 and name HN ) ( resid 29 and name HB1 ) 4.0 2.2 2
assign ( resid 29 and name HN ) ( resid 29 and name HB2 ) 4.0 2.2 2
assign ( resid 29 and name HN ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
assign ( resid 29 and name HN ) ( resid 29 and name HD2# ) 4.0 2.2 2.5
assign ( resid 30 and name HA ) ( resid 30 and name HB ) 5.0 3.2 2.5
assign ( resid 30 and name HA ) ( resid 30 and name HG1 ) 2.8 1 2.5
!assign ( resid 30 and name HB ) ( resid 30 and name HA ) 5.0 3.2 2.5
!assign ( resid 30 and name HB ) ( resid 30 and name HN ) 4.0 2.2 2.5
!assign ( resid 30 and name HG1 ) ( resid 30 and name HA ) 2.8 1 2.5
assign ( resid 30 and name HG1 ) ( resid 30 and name HB ) 2.8 1 2.5
!assign ( resid 30 and name HG1 ) ( resid 30 and name HN ) 5.0 3.2 2.5
assign ( resid 30 and name HN ) ( resid 30 and name HB ) 2.8 1 2.5
assign ( resid 30 and name HN ) ( resid 30 and name HG1 ) 2.8 1 2.5
!assign ( resid 31 and name HA ) ( resid 31 and name HD1 ) 4.0 2.2 2.5
assign ( resid 31 and name HA ) ( resid 31 and name HG2 ) 4.0 2.2 2.5
!assign ( resid 31 and name HB1 ) ( resid 31 and name HN ) 5.0 3.2 2.5
!assign ( resid 31 and name HB2 ) ( resid 31 and name HN ) 4.0 2.2 2.5
assign ( resid 31 and name HD1 ) ( resid 31 and name HA ) 2.8 1 2.5
assign ( resid 31 and name HD1 ) ( resid 31 and name HB2 ) 4.0 2.2 2.5
assign ( resid 31 and name HD1 ) ( resid 31 and name HG2 ) 2.8 1 2.5
!assign ( resid 31 and name HG2 ) ( resid 31 and name HN ) 5.0 3.2 2.5
assign ( resid 31 and name HN ) ( resid 31 and name HB1 ) 4.0 2.2 2
assign ( resid 31 and name HN ) ( resid 31 and name HB2 ) 4.0 2.2 2
assign ( resid 31 and name HN ) ( resid 31 and name HD1 ) 5.0 3.2 2.5
assign ( resid 31 and name HN ) ( resid 31 and name HG2 ) 4.0 2.2 2.5
assign ( resid 32 and name HA ) ( resid 32 and name HD1# ) 2.8 1 2.5
assign ( resid 32 and name HB1 ) ( resid 32 and name HB2 ) 2.8 1 2.5
assign ( resid 32 and name HB1 ) ( resid 32 and name HD2# ) 4.0 2.2 2.5
!assign ( resid 32 and name HB1 ) ( resid 32 and name HN ) 5.0 3.2 2.5
assign ( resid 32 and name HB2 ) ( resid 32 and name HA ) 5.0 3.2 2.5
assign ( resid 32 and name HB2 ) ( resid 32 and name HD2# ) 4.0 2.2 2.5
assign ( resid 32 and name HB2 ) ( resid 32 and name HN ) 5.0 3.2 2.5
!assign ( resid 32 and name HD1# ) ( resid 32 and name HA ) 2.8 1 2.5
assign ( resid 32 and name HD1# ) ( resid 32 and name HB1 ) 5.0 3.2 2.5
assign ( resid 32 and name HD1# ) ( resid 32 and name HB2 ) 2.8 1 2.5
assign ( resid 32 and name HN ) ( resid 32 and name HB1 ) 2.8 1 2
assign ( resid 32 and name HN ) ( resid 32 and name HD1# ) 4.0 2.2 2.5
assign ( resid 32 and name HN ) ( resid 32 and name HD2# ) 4.0 2.2 2.5
assign ( resid 32 and name HN ) ( resid 32 and name HG ) 4.0 2.2 2.5
assign ( resid 33 and name HA ) ( resid 33 and name HB2 ) 4.0 2.2 2
!assign ( resid 33 and name HA ) ( resid 33 and name HD2# ) 2.8 1 2.5
assign ( resid 33 and name HA ) ( resid 33 and name HG ) 4.0 2.2 2.5
assign ( resid 33 and name HB1 ) ( resid 33 and name HA ) 4.0 2.2 2.5
assign ( resid 33 and name HB1 ) ( resid 33 and name HB2 ) 2.8 1 2.5
assign ( resid 33 and name HB1 ) ( resid 33 and name HD1# ) 4.0 2.2 2.5
assign ( resid 33 and name HB1 ) ( resid 33 and name HG ) 5.0 3.2 2.5
!assign ( resid 33 and name HB2 ) ( resid 33 and name HA ) 4.0 2.2 2.5
assign ( resid 33 and name HB2 ) ( resid 33 and name HD1# ) 4.0 2.2 2.5
assign ( resid 33 and name HB2 ) ( resid 33 and name HN ) 4.0 2.2 2.5
assign ( resid 33 and name HD2# ) ( resid 33 and name HA ) 2.5 0.7 2.5
assign ( resid 33 and name HD2# ) ( resid 33 and name HB2 ) 2.8 1 2.5
assign ( resid 33 and name HD2# ) ( resid 33 and name HG ) 2.8 1 2.5
assign ( resid 33 and name HD2# ) ( resid 33 and name HN ) 5.0 3.2 2.5
assign ( resid 33 and name HN ) ( resid 33 and name HB1 ) 5.0 3.2 2
!assign ( resid 33 and name HN ) ( resid 33 and name HB2 ) 5.0 3.2 2
assign ( resid 33 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
!assign ( resid 33 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 33 and name HN ) ( resid 33 and name HG ) 4.0 2.2 2.5
assign ( resid 34 and name HA ) ( resid 34 and name HB1 ) 2.8 1 2
assign ( resid 34 and name HA ) ( resid 34 and name HB2 ) 4.0 2.2 2
assign ( resid 34 and name HA ) ( resid 34 and name HG1 ) 4.0 2.2 2.5
assign ( resid 34 and name HA ) ( resid 34 and name HG2 ) 5.0 3.2 2.5
!assign ( resid 34 and name HB1 ) ( resid 34 and name HA ) 4.0 2.2 2.5
!assign ( resid 34 and name HB2 ) ( resid 34 and name HN ) 5.0 3.2 2.5
assign ( resid 34 and name HE21 ) ( resid 34 and name HB1 ) 5.0 3.2 2.5
assign ( resid 34 and name HE21 ) ( resid 34 and name HB2 ) 5.0 3.2 2.5
assign ( resid 34 and name HE21 ) ( resid 34 and name HG1 ) 4.0 2.2 2.5
assign ( resid 34 and name HE21 ) ( resid 34 and name HG2 ) 4.0 2.2 2.5
assign ( resid 34 and name HE22 ) ( resid 34 and name HB1 ) 5.0 3.2 2.5
assign ( resid 34 and name HE22 ) ( resid 34 and name HG1 ) 4.0 2.2 2.5
assign ( resid 34 and name HE22 ) ( resid 34 and name HG2 ) 4.0 2.2 2.5
!assign ( resid 34 and name HG1 ) ( resid 34 and name HA ) 5.0 3.2 2.5
!assign ( resid 34 and name HG1 ) ( resid 34 and name HN ) 5.0 3.2 2.5
!assign ( resid 34 and name HG2 ) ( resid 34 and name HA ) 5.0 3.2 2.5
assign ( resid 34 and name HG2 ) ( resid 34 and name HB1 ) 4.0 2.2 2.5
!assign ( resid 34 and name HG2 ) ( resid 34 and name HN ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 34 and name HB1 ) 4.0 2.2 2
assign ( resid 34 and name HN ) ( resid 34 and name HB2 ) 2.8 1 2
assign ( resid 34 and name HN ) ( resid 34 and name HG1 ) 4.0 2.2 2.5
assign ( resid 34 and name HN ) ( resid 34 and name HG2 ) 4.0 2.2 2.5
assign ( resid 35 and name HB ) ( resid 35 and name HA ) 2.8 1 2.5
assign ( resid 35 and name HB ) ( resid 35 and name HG1 ) 2.8 1 2.5
!assign ( resid 35 and name HB ) ( resid 35 and name HN ) 4.0 2.2 2.5
assign ( resid 35 and name HN ) ( resid 35 and name HB ) 4.0 2.2 2.5
assign ( resid 35 and name HN ) ( resid 35 and name HG1 ) 4.0 2.2 2.5
assign ( resid 36 and name HA ) ( resid 36 and name HB1 ) 4.0 2.2 2
assign ( resid 36 and name HA ) ( resid 36 and name HD1 ) 2.8 1 2.5
assign ( resid 36 and name HA ) ( resid 36 and name HG1 ) 5.0 3.2 2.5
!assign ( resid 36 and name HD1 ) ( resid 36 and name HA ) 4.0 2.2 2.5
assign ( resid 36 and name HD1 ) ( resid 36 and name HE1 ) 5.0 3.2 2.5
assign ( resid 36 and name HD2 ) ( resid 36 and name HA ) 5.0 3.2 2.5
assign ( resid 36 and name HD2 ) ( resid 36 and name HE2 ) 5.0 3.2 2.5
assign ( resid 36 and name HD2 ) ( resid 36 and name HE1 ) 5.0 3.2 2.5
assign ( resid 36 and name HE2 ) ( resid 36 and name HD1 ) 2.8 1 2.5
assign ( resid 36 and name HE2 ) ( resid 36 and name HG1 ) 5.0 3.2 2.5
assign ( resid 36 and name HE1 ) ( resid 36 and name HG1 ) 5.0 3.2 2.5
assign ( resid 36 and name HN ) ( resid 36 and name HB1 ) 5.0 3.2 2
assign ( resid 37 and name HA ) ( resid 37 and name HB1 ) 4.0 2.2 2
assign ( resid 37 and name HA ) ( resid 37 and name HB2 ) 4.0 2.2 2
!assign ( resid 37 and name HB1 ) ( resid 37 and name HA ) 4.0 2.2 2.5
assign ( resid 37 and name HB1 ) ( resid 37 and name HB2 ) 2.5 0.7 2.5
!assign ( resid 37 and name HB2 ) ( resid 37 and name HA ) 4.0 2.2 2.5
!assign ( resid 37 and name HB2 ) ( resid 37 and name HB1 ) 2.8 1 2.5
assign ( resid 37 and name HD21 ) ( resid 37 and name HB1 ) 4.0 2.2 2.5
assign ( resid 37 and name HD21 ) ( resid 37 and name HB2 ) 4.0 2.2 2.5
assign ( resid 37 and name HD22 ) ( resid 37 and name HA ) 5.0 3.2 2.5
assign ( resid 37 and name HD22 ) ( resid 37 and name HB1 ) 2.8 1 2.5
assign ( resid 37 and name HD22 ) ( resid 37 and name HB2 ) 2.8 1 2.5
assign ( resid 37 and name HN ) ( resid 37 and name HB1 ) 2.8 1 2
assign ( resid 37 and name HN ) ( resid 37 and name HB2 ) 2.8 1 2
assign ( resid 38 and name HA ) ( resid 38 and name HB2 ) 2.8 1 2
assign ( resid 38 and name HB1 ) ( resid 38 and name HA ) 2.8 1 2.5
assign ( resid 38 and name HN ) ( resid 38 and name HB1 ) 2.8 1 2
assign ( resid 39 and name HA ) ( resid 39 and name HB2 ) 4.0 2.2 2
assign ( resid 39 and name HB1 ) ( resid 39 and name HA ) 5.0 3.2 2.5
!assign ( resid 39 and name HB1 ) ( resid 39 and name HB2 ) 2.8 1 2.5
!assign ( resid 39 and name HB1 ) ( resid 39 and name HN ) 4.0 2.2 2.5
assign ( resid 39 and name HB2 ) ( resid 39 and name HB1 ) 2.5 0.7 2.5
!assign ( resid 39 and name HB2 ) ( resid 39 and name HN ) 4.0 2.2 2.5
assign ( resid 39 and name HN ) ( resid 39 and name HB1 ) 2.8 1 2
assign ( resid 39 and name HN ) ( resid 39 and name HB2 ) 2.8 1 2
assign ( resid 40 and name HA ) ( resid 40 and name HB ) 4.0 2.2 2.5
assign ( resid 40 and name HA ) ( resid 40 and name HG11 ) 2.8 1 2.5
assign ( resid 40 and name HA ) ( resid 40 and name HG12 ) 5.0 3.2 2.5
assign ( resid 40 and name HA ) ( resid 40 and name HG2# ) 2.8 1 2.5
!assign ( resid 40 and name HB ) ( resid 40 and name HA ) 4.0 2.2 2.5
assign ( resid 40 and name HB ) ( resid 40 and name HG11 ) 4.0 2.2 2.5
assign ( resid 40 and name HB ) ( resid 40 and name HG2# ) 2.8 1 2.5
!assign ( resid 40 and name HB ) ( resid 40 and name HN ) 4.0 2.2 2.5
assign ( resid 40 and name HD1# ) ( resid 40 and name HA ) 5.0 3.2 2.5
assign ( resid 40 and name HD1# ) ( resid 40 and name HB ) 2.8 1 2.5
assign ( resid 40 and name HD1# ) ( resid 40 and name HG11 ) 2.5 0.7 2.5
assign ( resid 40 and name HD1# ) ( resid 40 and name HG12 ) 2.8 1 2.5
!assign ( resid 40 and name HG11 ) ( resid 40 and name HN ) 5.0 3.2 2.5
!assign ( resid 40 and name HG12 ) ( resid 40 and name HN ) 4.0 2.2 2.5
assign ( resid 40 and name HN ) ( resid 40 and name HB ) 2.8 1 2.5
assign ( resid 40 and name HN ) ( resid 40 and name HD1# ) 2.5 0.7 2.5
assign ( resid 40 and name HN ) ( resid 40 and name HG11 ) 2.8 1 2.5
assign ( resid 40 and name HN ) ( resid 40 and name HG12 ) 2.8 1 2.5
assign ( resid 42 and name HA ) ( resid 42 and name HB# ) 2.8 1 2.5
!assign ( resid 42 and name HB# ) ( resid 42 and name HA ) 2.8 1 2.5
!assign ( resid 42 and name HB# ) ( resid 42 and name HN ) 2.8 1 2.5
assign ( resid 42 and name HN ) ( resid 42 and name HB# ) 2.5 0.7 2.5
assign ( resid 43 and name HA ) ( resid 43 and name HB# ) 2.8 1 2.5
!assign ( resid 43 and name HB# ) ( resid 43 and name HN ) 2.8 1 2.5
assign ( resid 43 and name HN ) ( resid 43 and name HB# ) 2.8 1 2.5
assign ( resid 44 and name HA ) ( resid 44 and name HD1# ) 2.8 1 2.5
assign ( resid 44 and name HB1 ) ( resid 44 and name HA ) 5.0 3.2 2.5
assign ( resid 44 and name HB1 ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 44 and name HB1 ) ( resid 44 and name HD2# ) 4.0 2.2 2.5
assign ( resid 44 and name HB2 ) ( resid 44 and name HA ) 4.0 2.2 2.5
assign ( resid 44 and name HB2 ) ( resid 44 and name HB1 ) 2.5 0.7 2.5
assign ( resid 44 and name HB2 ) ( resid 44 and name HD2# ) 4.0 2.2 2.5
!assign ( resid 44 and name HB2 ) ( resid 44 and name HN ) 5.0 3.2 2.5
!assign ( resid 44 and name HD1# ) ( resid 44 and name HA ) 2.8 1 2.5
!assign ( resid 44 and name HD1# ) ( resid 44 and name HN ) 5.0 3.2 2.5
assign ( resid 44 and name HG ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 44 and name HG ) ( resid 44 and name HD2# ) 2.8 1 2.5
!assign ( resid 44 and name HG ) ( resid 44 and name HN ) 5.0 3.2 2.5
assign ( resid 44 and name HN ) ( resid 44 and name HB1 ) 4.0 2.2 2
assign ( resid 44 and name HN ) ( resid 44 and name HB2 ) 5.0 3.2 2
assign ( resid 44 and name HN ) ( resid 44 and name HD1# ) 4.0 2.2 2.5
assign ( resid 44 and name HN ) ( resid 44 and name HD2# ) 4.0 2.2 2.5
assign ( resid 44 and name HN ) ( resid 44 and name HG ) 4.0 2.2 2.5
assign ( resid 45 and name HA ) ( resid 45 and name HB2 ) 2.8 1 2
assign ( resid 45 and name HB1 ) ( resid 45 and name HA ) 4.0 2.2 2.5
!assign ( resid 45 and name HB1 ) ( resid 45 and name HN ) 4.0 2.2 2.5
!assign ( resid 45 and name HB2 ) ( resid 45 and name HA ) 4.0 2.2 2.5
!assign ( resid 45 and name HB2 ) ( resid 45 and name HN ) 4.0 2.2 2.5
assign ( resid 45 and name HN ) ( resid 45 and name HB1 ) 2.8 1 2
assign ( resid 45 and name HN ) ( resid 45 and name HB2 ) 2.8 1 2
assign ( resid 46 and name HB ) ( resid 46 and name HG1 ) 2.8 1 2.5
!assign ( resid 46 and name HB ) ( resid 46 and name HN ) 4.0 2.2 2.5
assign ( resid 46 and name HG1 ) ( resid 46 and name HA ) 2.8 1 2.5
!assign ( resid 46 and name HG1 ) ( resid 46 and name HB ) 2.8 1 2.5
!assign ( resid 46 and name HG1 ) ( resid 46 and name HN ) 5.0 3.2 2.5
assign ( resid 46 and name HN ) ( resid 46 and name HB ) 2.8 1 2.5
assign ( resid 46 and name HN ) ( resid 46 and name HG1 ) 4.0 2.2 2.5
!assign ( resid 47 and name HB ) ( resid 47 and name HD1# ) 4.0 2.2 2.5
assign ( resid 47 and name HB ) ( resid 47 and name HG12 ) 5.0 3.2 2.5
assign ( resid 47 and name HD1# ) ( resid 47 and name HB ) 2.8 1 2.5
assign ( resid 47 and name HD1# ) ( resid 47 and name HG12 ) 2.8 1 2.5
assign ( resid 47 and name HG11 ) ( resid 47 and name HN ) 5.0 3.2 2.5
!assign ( resid 47 and name HG12 ) ( resid 47 and name HN ) 4.0 2.2 2.5
assign ( resid 47 and name HG2# ) ( resid 47 and name HB ) 2.8 1 2.5
assign ( resid 47 and name HG2# ) ( resid 47 and name HG11 ) 2.8 1 2.5
!assign ( resid 47 and name HG2# ) ( resid 47 and name HN ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 47 and name HB ) 5.0 3.2 2.5
assign ( resid 47 and name HN ) ( resid 47 and name HD1# ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 47 and name HG12 ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 47 and name HG2# ) 4.0 2.2 2.5
assign ( resid 48 and name HE22 ) ( resid 48 and name HB1 ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 48 and name HB2 ) 6.0 4.2 2.5
assign ( resid 48 and name HE22 ) ( resid 48 and name HE21 ) 2.8 1 2.5
assign ( resid 48 and name HE22 ) ( resid 48 and name HG1 ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 48 and name HB2 ) 4.0 2.2 2
assign ( resid 48 and name HN ) ( resid 48 and name HG1 ) 4.0 2.2 2.5
assign ( resid 49 and name HA ) ( resid 49 and name HB1 ) 5.0 3.2 2
assign ( resid 49 and name HA ) ( resid 49 and name HB2 ) 4.0 2.2 2
assign ( resid 49 and name HB1 ) ( resid 49 and name HB2 ) 2.8 1 2.5
!assign ( resid 49 and name HB1 ) ( resid 49 and name HN ) 5.0 3.2 2.5
!assign ( resid 49 and name HB2 ) ( resid 49 and name HA ) 5.0 3.2 2.5
!assign ( resid 49 and name HB2 ) ( resid 49 and name HB1 ) 2.8 1 2.5
!assign ( resid 49 and name HB2 ) ( resid 49 and name HN ) 4.0 2.2 2.5
assign ( resid 49 and name HN ) ( resid 49 and name HB1 ) 4.0 2.2 2
assign ( resid 49 and name HN ) ( resid 49 and name HB2 ) 4.0 2.2 2
assign ( resid 50 and name HA ) ( resid 50 and name HB1 ) 2.8 1 2
!assign ( resid 50 and name HB1 ) ( resid 50 and name HN ) 4.0 2.2 2.5
assign ( resid 50 and name HN ) ( resid 50 and name HB1 ) 2.8 1 2
assign ( resid 51 and name HG2 ) ( resid 51 and name HD1 ) 2.8 1 2.5
assign ( resid 51 and name HN ) ( resid 51 and name HB1 ) 2.8 1 2
assign ( resid 51 and name HN ) ( resid 51 and name HB2 ) 2.8 1 2
assign ( resid 51 and name HN ) ( resid 51 and name HG2 ) 4.0 2.2 2.5
assign ( resid 52 and name HN ) ( resid 52 and name HB1 ) 4.0 2.2 2
clas short
assign ( resid 3 and name HD1 ) ( resid 7 and name HB1 ) 6.0 4.2 2.5
assign ( resid 24 and name HA ) ( resid 28 and name HE1 ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 29 and name HB1 ) 5.0 3.2 2
assign ( resid 25 and name HN ) ( resid 29 and name HB2 ) 5.0 3.2 2
assign ( resid 25 and name HN ) ( resid 29 and name HD2# ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 31 and name HD1 ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 31 and name HG2 ) 5.0 3.2 2.5
assign ( resid 28 and name HB1 ) ( resid 32 and name HD1# ) 6.0 4.2 2.5
assign ( resid 28 and name HD1 ) ( resid 32 and name HD1# ) 6.0 4.2 2.5
assign ( resid 28 and name HE1 ) ( resid 32 and name HB1 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HE3 ) ( resid 32 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HE3 ) ( resid 32 and name HD2# ) 6.0 4.2 2.5
assign ( resid 28 and name HN ) ( resid 32 and name HB1 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 32 and name HB2 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
!assign ( resid 28 and name HZ3 ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 29 and name HA ) ( resid 33 and name HG ) 5.0 3.2 2.5
assign ( resid 29 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 30 and name HG1 ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 30 and name HG1 ) ( resid 34 and name HE22 ) 5.0 3.2 2.5
assign ( resid 30 and name HG1 ) ( resid 34 and name HG2 ) 4.0 2.2 2.5
assign ( resid 32 and name HD1# ) ( resid 36 and name HE2 ) 5.0 3.2 2.5
assign ( resid 32 and name HD1# ) ( resid 36 and name HE1 ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 43 and name HB# ) 5.0 3.2 2.5
assign ( resid 43 and name HN ) ( resid 47 and name HD1# ) 5.0 3.2 2.5
assign ( resid 13 and name HN ) ( resid 9 and name HG2 ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 10 and name HD2# ) 4.0 2.2 2.5
assign ( resid 15 and name HN ) ( resid 11 and name HD1# ) 5.0 3.2 2.5
assign ( resid 15 and name HN ) ( resid 11 and name HG12 ) 5.0 3.2 2.5
assign ( resid 15 and name HN ) ( resid 11 and name HG2# ) 4.0 2.2 2.5
assign ( resid 18 and name HN ) ( resid 14 and name HD1# ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 14 and name HG ) 5.0 3.2 2.5
assign ( resid 22 and name HN ) ( resid 18 and name HB1 ) 5.0 3.2 2
assign ( resid 22 and name HN ) ( resid 18 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 24 and name HN ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
assign ( resid 29 and name HN ) ( resid 25 and name HB1 ) 5.0 3.2 2
assign ( resid 32 and name HD2# ) ( resid 28 and name HZ3 ) 4.0 2.2 2.5
assign ( resid 32 and name HN ) ( resid 28 and name HB2 ) 4.0 2.2 2
assign ( resid 32 and name HN ) ( resid 28 and name HD1 ) 5.0 3.2 2.5
assign ( resid 32 and name HN ) ( resid 28 and name HE1 ) 5.0 3.2 2.5
assign ( resid 32 and name HN ) ( resid 28 and name HZ3 ) 5.0 3.2 2.5
assign ( resid 33 and name HG ) ( resid 29 and name HG ) 5.0 3.2 2.5
assign ( resid 33 and name HN ) ( resid 29 and name HG ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 30 and name HG1 ) 4.0 2.2 2.5
!assign ( resid 36 and name HE2 ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
!assign ( resid 36 and name HE1 ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 36 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 43 and name HN ) ( resid 39 and name HB1 ) 5.0 3.2 2
assign ( resid 46 and name HN ) ( resid 42 and name HB# ) 5.0 3.2 2.5
assign ( resid 47 and name HN ) ( resid 43 and name HB# ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 4 and name HD1 ) ( resid 7 and name HB1 ) 6.0 4.2 2.5
assign ( resid 5 and name HN ) ( resid 8 and name HD1 ) 5.0 3.2 2.5
assign ( resid 5 and name HN ) ( resid 8 and name HD2 ) 5.0 3.2 2.5
assign ( resid 6 and name HA ) ( resid 9 and name HB2 ) 6.0 4.2 2
assign ( resid 6 and name HN ) ( resid 9 and name HB2 ) 5.0 3.2 2
assign ( resid 7 and name HN ) ( resid 10 and name HD2# ) 4.0 2.2 2.5
assign ( resid 15 and name HN ) ( resid 18 and name HG ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 28 and name HD1 ) 2.8 1 2.5
assign ( resid 25 and name HN ) ( resid 28 and name HE1 ) 2.8 1 2.5
assign ( resid 25 and name HN ) ( resid 28 and name HZ2 ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 31 and name HB1 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 31 and name HB2 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 31 and name HD1 ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 31 and name HG2 ) 4.0 2.2 2.5
assign ( resid 29 and name HA ) ( resid 32 and name HB1 ) 5.0 3.2 2
assign ( resid 29 and name HN ) ( resid 32 and name HB1 ) 5.0 3.2 2
assign ( resid 30 and name HA ) ( resid 33 and name HB2 ) 5.0 3.2 2
assign ( resid 30 and name HA ) ( resid 33 and name HD1# ) 4.0 2.2 2.5
assign ( resid 30 and name HN ) ( resid 33 and name HD1# ) 4.0 2.2 2.5
!assign ( resid 39 and name HB1 ) ( resid 42 and name HB# ) 4.0 2.2 2.5
!assign ( resid 39 and name HB1 ) ( resid 42 and name HN ) 6.0 4.2 2.5
!assign ( resid 39 and name HB2 ) ( resid 42 and name HN ) 6.0 4.2 2.5
assign ( resid 39 and name HN ) ( resid 42 and name HB# ) 2.8 1 2.5
assign ( resid 40 and name HN ) ( resid 43 and name HB# ) 2.8 1 2.5
assign ( resid 41 and name HN ) ( resid 44 and name HB2 ) 5.0 3.2 2
assign ( resid 42 and name HA ) ( resid 45 and name HB1 ) 2.8 1 2
assign ( resid 42 and name HN ) ( resid 45 and name HB1 ) 4.0 2.2 2
assign ( resid 42 and name HN ) ( resid 45 and name HB2 ) 5.0 3.2 2
assign ( resid 43 and name HN ) ( resid 46 and name HG1 ) 4.0 2.2 2.5
assign ( resid 6 and name HN ) ( resid 3 and name HD1 ) 5.0 3.2 2.5
assign ( resid 10 and name HN ) ( resid 7 and name HB1 ) 4.0 2.2 2
assign ( resid 11 and name HB ) ( resid 8 and name HA ) 4.0 2.2 2.5
assign ( resid 11 and name HD1# ) ( resid 8 and name HA ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 9 and name HB2 ) 5.0 3.2 2
assign ( resid 12 and name HN ) ( resid 9 and name HG2 ) 5.0 3.2 2.5
assign ( resid 13 and name HN ) ( resid 10 and name HD2# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 11 and name HB ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 11 and name HG12 ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 14 and name HG ) 5.0 3.2 2.5
assign ( resid 18 and name HB1 ) ( resid 15 and name HA ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 15 and name HB1 ) 4.0 2.2 2
assign ( resid 20 and name HB1 ) ( resid 17 and name HN ) 5.0 3.2 2.5
assign ( resid 20 and name HB2 ) ( resid 17 and name HN ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 18 and name HB1 ) 5.0 3.2 2
assign ( resid 21 and name HN ) ( resid 18 and name HD2# ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
!assign ( resid 27 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
assign ( resid 28 and name HD1 ) ( resid 25 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HD1 ) ( resid 25 and name HG2 ) 6.0 4.2 2.5
!assign ( resid 28 and name HD1 ) ( resid 25 and name HN ) 6.0 4.2 2.5
assign ( resid 28 and name HE1 ) ( resid 25 and name HA ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 25 and name HB2 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
!assign ( resid 28 and name HE1 ) ( resid 25 and name HN ) 4.0 2.2 2.5
assign ( resid 28 and name HN ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
assign ( resid 31 and name HN ) ( resid 28 and name HB1 ) 5.0 3.2 2
assign ( resid 31 and name HN ) ( resid 28 and name HB2 ) 5.0 3.2 2
assign ( resid 32 and name HN ) ( resid 29 and name HB2 ) 5.0 3.2 2
assign ( resid 33 and name HN ) ( resid 30 and name HG1 ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 31 and name HG2 ) 5.0 3.2 2.5
assign ( resid 35 and name HB ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 35 and name HG1 ) ( resid 32 and name HD1# ) 4.0 2.2 2.5
assign ( resid 36 and name HD2 ) ( resid 33 and name HN ) 4.0 2.2 2.5
assign ( resid 36 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 37 and name HN ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 36 and name HB1 ) 4.0 2.2 2
assign ( resid 39 and name HN ) ( resid 36 and name HD2 ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 36 and name HE1 ) 5.0 3.2 2.5
assign ( resid 40 and name HN ) ( resid 37 and name HD22 ) 5.0 3.2 2.5
assign ( resid 42 and name HB# ) ( resid 39 and name HB1 ) 2.8 1 2.5
assign ( resid 42 and name HB# ) ( resid 39 and name HB2 ) 4.0 2.2 2.5
assign ( resid 42 and name HN ) ( resid 39 and name HB1 ) 4.0 2.2 2
assign ( resid 42 and name HN ) ( resid 39 and name HB2 ) 4.0 2.2 2
assign ( resid 43 and name HN ) ( resid 40 and name HG2# ) 2.8 1 2.5
!assign ( resid 45 and name HB1 ) ( resid 42 and name HA ) 5.0 3.2 2.5
assign ( resid 45 and name HB2 ) ( resid 42 and name HA ) 4.0 2.2 2.5
assign ( resid 46 and name HN ) ( resid 43 and name HB# ) 5.0 3.2 2.5
assign ( resid 47 and name HN ) ( resid 44 and name HB2 ) 5.0 3.2 2
assign ( resid 47 and name HN ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 12 and name HN ) ( resid 14 and name HD2# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 16 and name HB1 ) 5.0 3.2 2
assign ( resid 14 and name HN ) ( resid 16 and name HB2 ) 5.0 3.2 2
assign ( resid 14 and name HN ) ( resid 16 and name HG2 ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 18 and name HG ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 30 and name HG1 ) 5.0 3.2 2.5
assign ( resid 30 and name HN ) ( resid 32 and name HB1 ) 5.0 3.2 2
assign ( resid 38 and name HN ) ( resid 40 and name HD1# ) 5.0 3.2 2.5
assign ( resid 40 and name HN ) ( resid 42 and name HB# ) 4.0 2.2 2.5
assign ( resid 47 and name HD1# ) ( resid 49 and name HB1 ) 5.0 3.2 2.5
assign ( resid 47 and name HD1# ) ( resid 49 and name HB2 ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 49 and name HB1 ) 5.0 3.2 2
assign ( resid 47 and name HN ) ( resid 49 and name HB2 ) 5.0 3.2 2
assign ( resid 9 and name HN ) ( resid 7 and name HB1 ) 5.0 3.2 2
assign ( resid 13 and name HN ) ( resid 11 and name HB ) 5.0 3.2 2.5
assign ( resid 15 and name HN ) ( resid 13 and name HB1 ) 5.0 3.2 2
assign ( resid 16 and name HN ) ( resid 14 and name HB1 ) 5.0 3.2 2
assign ( resid 16 and name HN ) ( resid 14 and name HB2 ) 5.0 3.2 2
assign ( resid 16 and name HN ) ( resid 14 and name HD1# ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 15 and name HB1 ) 5.0 3.2 2
assign ( resid 20 and name HN ) ( resid 18 and name HD1# ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 19 and name HB1 ) 5.0 3.2 2
assign ( resid 22 and name HN ) ( resid 20 and name HB2 ) 5.0 3.2 2
assign ( resid 25 and name HN ) ( resid 23 and name HB1 ) 4.0 2.2 2
assign ( resid 25 and name HN ) ( resid 23 and name HB2 ) 4.0 2.2 2
assign ( resid 27 and name HN ) ( resid 25 and name HB1 ) 5.0 3.2 2
!assign ( resid 27 and name HN ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
assign ( resid 30 and name HN ) ( resid 28 and name HD1 ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 36 and name HB1 ) 5.0 3.2 2
assign ( resid 38 and name HN ) ( resid 36 and name HD1 ) 4.0 2.2 2.5
assign ( resid 38 and name HN ) ( resid 36 and name HD2 ) 5.0 3.2 2.5
assign ( resid 41 and name HN ) ( resid 39 and name HB1 ) 5.0 3.2 2
assign ( resid 41 and name HN ) ( resid 39 and name HB2 ) 5.0 3.2 2
assign ( resid 42 and name HN ) ( resid 40 and name HD1# ) 4.0 2.2 2.5
assign ( resid 42 and name HN ) ( resid 40 and name HG12 ) 2.8 1 2.5
assign ( resid 45 and name HN ) ( resid 43 and name HB# ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 46 and name HB ) 5.0 3.2 2.5
assign ( resid 49 and name HN ) ( resid 47 and name HD1# ) 5.0 3.2 2.5
assign ( resid 49 and name HN ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
clas seq
assign ( resid 5 and name HN ) ( resid 6 and name HB# ) 5.0 3.2 2.5
assign ( resid 6 and name HA ) ( resid 7 and name HB1 ) 5.0 3.2 2
assign ( resid 6 and name HN ) ( resid 7 and name HB1 ) 5.0 3.2 2
assign ( resid 7 and name HN ) ( resid 8 and name HD1 ) 4.0 2.2 2.5
assign ( resid 8 and name HD1 ) ( resid 9 and name HN ) 5.0 3.2 2.5
assign ( resid 10 and name HN ) ( resid 11 and name HB ) 5.0 3.2 2.5
assign ( resid 10 and name HN ) ( resid 11 and name HD1# ) 5.0 3.2 2.5
assign ( resid 10 and name HN ) ( resid 11 and name HG2# ) 5.0 3.2 2.5
!assign ( resid 11 and name HB ) ( resid 12 and name HN ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 13 and name HB1 ) 5.0 3.2 2
assign ( resid 13 and name HN ) ( resid 14 and name HB2 ) 5.0 3.2 2
!assign ( resid 14 and name HB1 ) ( resid 15 and name HN ) 5.0 3.2 2.5
!assign ( resid 14 and name HB2 ) ( resid 15 and name HN ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 15 and name HB1 ) 4.0 2.2 2
assign ( resid 15 and name HN ) ( resid 16 and name HB1 ) 4.0 2.2 2
assign ( resid 15 and name HN ) ( resid 16 and name HB2 ) 5.0 3.2 2
assign ( resid 15 and name HN ) ( resid 16 and name HG1 ) 5.0 3.2 2.5
assign ( resid 15 and name HN ) ( resid 16 and name HG2 ) 5.0 3.2 2.5
!assign ( resid 16 and name HB2 ) ( resid 17 and name HN ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 17 and name HB2 ) 5.0 3.2 2
assign ( resid 17 and name HN ) ( resid 18 and name HB2 ) 5.0 3.2 2
assign ( resid 18 and name HB1 ) ( resid 19 and name HN ) 5.0 3.2 2.5
assign ( resid 18 and name HB2 ) ( resid 19 and name HN ) 5.0 3.2 2.5
assign ( resid 19 and name HN ) ( resid 20 and name HG1 ) 5.0 3.2 2.5
assign ( resid 19 and name HN ) ( resid 20 and name HG2 ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 22 and name HB1 ) 5.0 3.2 2
assign ( resid 22 and name HA ) ( resid 23 and name HA ) 5.0 3.2 2.5
assign ( resid 23 and name HB2 ) ( resid 24 and name HN ) 4.0 2.2 2.5
assign ( resid 24 and name HN ) ( resid 25 and name HB1 ) 5.0 3.2 2
!assign ( resid 28 and name HD1 ) ( resid 29 and name HN ) 6.0 4.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HA ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HB1 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HB2 ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HD2# ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 29 and name HN ) 5.0 3.2 2.5
!assign ( resid 28 and name HE3 ) ( resid 29 and name HA ) 6.0 4.2 2.5
assign ( resid 28 and name HH2 ) ( resid 29 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HH2 ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 29 and name HB1 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 29 and name HB2 ) 5.0 3.2 2
assign ( resid 28 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HN ) ( resid 29 and name HD2# ) 5.0 3.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 29 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
!assign ( resid 29 and name HB1 ) ( resid 30 and name HN ) 6.0 4.2 2.5
assign ( resid 29 and name HN ) ( resid 30 and name HB ) 5.0 3.2 2.5
assign ( resid 29 and name HN ) ( resid 30 and name HG1 ) 5.0 3.2 2.5
assign ( resid 30 and name HB ) ( resid 31 and name HN ) 5.0 3.2 2.5
assign ( resid 30 and name HN ) ( resid 31 and name HD1 ) 5.0 3.2 2.5
assign ( resid 31 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 31 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 32 and name HD1# ) ( resid 33 and name HB1 ) 2.5 0.7 2.5
assign ( resid 34 and name HB2 ) ( resid 35 and name HN ) 5.0 3.2 2.5
assign ( resid 35 and name HB ) ( resid 36 and name HN ) 5.0 3.2 2.5
assign ( resid 35 and name HG1 ) ( resid 36 and name HN ) 5.0 3.2 2.5
assign ( resid 35 and name HN ) ( resid 36 and name HB2 ) 5.0 3.2 2
assign ( resid 39 and name HB2 ) ( resid 40 and name HN ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 40 and name HB ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 40 and name HD1# ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 40 and name HG12 ) 5.0 3.2 2.5
!assign ( resid 40 and name HB ) ( resid 41 and name HN ) 5.0 3.2 2.5
assign ( resid 41 and name HN ) ( resid 42 and name HB# ) 4.0 2.2 2.5
!assign ( resid 42 and name HB# ) ( resid 43 and name HN ) 4.0 2.2 2.5
assign ( resid 42 and name HN ) ( resid 43 and name HB# ) 2.8 1 2.5
assign ( resid 43 and name HB# ) ( resid 44 and name HN ) 4.0 2.2 2.5
assign ( resid 43 and name HN ) ( resid 44 and name HD1# ) 4.0 2.2 2.5
!assign ( resid 44 and name HB2 ) ( resid 45 and name HN ) 5.0 3.2 2.5
assign ( resid 45 and name HA ) ( resid 46 and name HA ) 2.8 1 2.5
assign ( resid 45 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 46 and name HB ) ( resid 47 and name HN ) 5.0 3.2 2.5
assign ( resid 46 and name HG1 ) ( resid 47 and name HN ) 5.0 3.2 2.5
assign ( resid 46 and name HN ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 6 and name HN ) ( resid 5 and name HB1 ) 2.8 1 2
assign ( resid 6 and name HN ) ( resid 5 and name HB2 ) 4.0 2.2 2
assign ( resid 6 and name HN ) ( resid 5 and name HG2 ) 4.0 2.2 2.5
assign ( resid 7 and name HN ) ( resid 6 and name HB# ) 2.8 1 2.5
assign ( resid 9 and name HN ) ( resid 8 and name HB1 ) 5.0 3.2 2
!assign ( resid 9 and name HN ) ( resid 8 and name HD1 ) 5.0 3.2 2.5
assign ( resid 10 and name HN ) ( resid 9 and name HB1 ) 4.0 2.2 2
assign ( resid 10 and name HN ) ( resid 9 and name HD1 ) 5.0 3.2 2.5
assign ( resid 11 and name HN ) ( resid 10 and name HB1 ) 4.0 2.2 2
assign ( resid 11 and name HN ) ( resid 10 and name HD1# ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 11 and name HB ) 2.8 1 2.5
assign ( resid 12 and name HN ) ( resid 11 and name HD1# ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 11 and name HG11 ) 4.0 2.2 2.5
assign ( resid 12 and name HN ) ( resid 11 and name HG12 ) 5.0 3.2 2.5
assign ( resid 12 and name HN ) ( resid 11 and name HG2# ) 2.8 1 2.5
assign ( resid 13 and name HN ) ( resid 12 and name HB1 ) 4.0 2.2 2
assign ( resid 13 and name HN ) ( resid 12 and name HB2 ) 2.8 1 2
assign ( resid 13 and name HN ) ( resid 12 and name HG2 ) 4.0 2.2 2.5
assign ( resid 14 and name HN ) ( resid 13 and name HB1 ) 4.0 2.2 2
assign ( resid 14 and name HN ) ( resid 13 and name HB2 ) 4.0 2.2 2
assign ( resid 15 and name HN ) ( resid 14 and name HB1 ) 2.8 1 2
assign ( resid 15 and name HN ) ( resid 14 and name HB2 ) 2.8 1 2
assign ( resid 15 and name HN ) ( resid 14 and name HD1# ) 4.0 2.2 2.5
assign ( resid 16 and name HN ) ( resid 15 and name HB1 ) 2.5 0.7 2
assign ( resid 17 and name HN ) ( resid 16 and name HB1 ) 2.8 1 2
assign ( resid 17 and name HN ) ( resid 16 and name HB2 ) 4.0 2.2 2
assign ( resid 18 and name HN ) ( resid 17 and name HB1 ) 4.0 2.2 2
assign ( resid 18 and name HN ) ( resid 17 and name HG1 ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 17 and name HG2 ) 5.0 3.2 2.5
assign ( resid 19 and name HN ) ( resid 18 and name HD1# ) 4.0 2.2 2.5
assign ( resid 19 and name HN ) ( resid 18 and name HG ) 2.8 1 2.5
assign ( resid 20 and name HN ) ( resid 19 and name HB1 ) 5.0 3.2 2
assign ( resid 21 and name HN ) ( resid 20 and name HB1 ) 5.0 3.2 2
assign ( resid 21 and name HN ) ( resid 20 and name HB2 ) 5.0 3.2 2
assign ( resid 21 and name HN ) ( resid 20 and name HG1 ) 5.0 3.2 2.5
assign ( resid 21 and name HN ) ( resid 20 and name HG2 ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 22 and name HB1 ) 4.0 2.2 2
assign ( resid 23 and name HN ) ( resid 22 and name HB2 ) 4.0 2.2 2
assign ( resid 24 and name HN ) ( resid 23 and name HB1 ) 4.0 2.2 2
!assign ( resid 24 and name HN ) ( resid 23 and name HB2 ) 4.0 2.2 2
assign ( resid 25 and name HN ) ( resid 24 and name HB1 ) 4.0 2.2 2
!assign ( resid 25 and name HN ) ( resid 24 and name HB1 ) 4.0 2.2 2
assign ( resid 26 and name HN ) ( resid 25 and name HB1 ) 2.8 1 2
!assign ( resid 26 and name HN ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
assign ( resid 26 and name HN ) ( resid 25 and name HG2 ) 5.0 3.2 2.5
assign ( resid 29 and name HA ) ( resid 28 and name HE3 ) 5.0 3.2 2.5
assign ( resid 29 and name HD1# ) ( resid 28 and name HE3 ) 5.0 3.2 2.5
assign ( resid 29 and name HG ) ( resid 28 and name HE3 ) 5.0 3.2 2.5
assign ( resid 29 and name HG ) ( resid 28 and name HZ3 ) 5.0 3.2 2.5
assign ( resid 29 and name HN ) ( resid 28 and name HB2 ) 5.0 3.2 2
assign ( resid 29 and name HN ) ( resid 28 and name HD1 ) 5.0 3.2 2.5
assign ( resid 29 and name HN ) ( resid 28 and name HE3 ) 5.0 3.2 2.5
assign ( resid 30 and name HN ) ( resid 29 and name HB1 ) 4.0 2.2 2
assign ( resid 30 and name HN ) ( resid 29 and name HB2 ) 5.0 3.2 2
assign ( resid 30 and name HN ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
assign ( resid 31 and name HN ) ( resid 30 and name HG1 ) 2.8 1 2.5
assign ( resid 32 and name HD1# ) ( resid 31 and name HA ) 4.0 2.2 2.5
assign ( resid 32 and name HN ) ( resid 31 and name HB2 ) 4.0 2.2 2
assign ( resid 32 and name HN ) ( resid 31 and name HD1 ) 5.0 3.2 2.5
assign ( resid 32 and name HN ) ( resid 31 and name HG2 ) 4.0 2.2 2.5
assign ( resid 33 and name HN ) ( resid 32 and name HG ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 33 and name HB1 ) 5.0 3.2 2
assign ( resid 34 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 34 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 35 and name HN ) ( resid 34 and name HB1 ) 5.0 3.2 2
!assign ( resid 35 and name HN ) ( resid 34 and name HB2 ) 5.0 3.2 2
assign ( resid 35 and name HN ) ( resid 34 and name HG1 ) 5.0 3.2 2.5
assign ( resid 35 and name HN ) ( resid 34 and name HG2 ) 5.0 3.2 2.5
!assign ( resid 36 and name HN ) ( resid 35 and name HB ) 5.0 3.2 2.5
assign ( resid 37 and name HN ) ( resid 36 and name HB2 ) 4.0 2.2 2
assign ( resid 38 and name HN ) ( resid 37 and name HB2 ) 4.0 2.2 2
assign ( resid 39 and name HA ) ( resid 38 and name HB1 ) 4.0 2.2 2
assign ( resid 40 and name HN ) ( resid 39 and name HB1 ) 4.0 2.2 2
!assign ( resid 40 and name HN ) ( resid 39 and name HB2 ) 2.8 1 2
assign ( resid 41 and name HN ) ( resid 40 and name HB ) 2.8 1 2.5
assign ( resid 41 and name HN ) ( resid 40 and name HD1# ) 2.8 1 2.5
assign ( resid 41 and name HN ) ( resid 40 and name HG11 ) 4.0 2.2 2.5
assign ( resid 41 and name HN ) ( resid 40 and name HG12 ) 4.0 2.2 2.5
assign ( resid 43 and name HN ) ( resid 42 and name HB# ) 2.5 0.7 2.5
!assign ( resid 44 and name HN ) ( resid 43 and name HB# ) 4.0 2.2 2.5
assign ( resid 45 and name HB1 ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 45 and name HN ) ( resid 44 and name HB1 ) 4.0 2.2 2
assign ( resid 45 and name HN ) ( resid 44 and name HB2 ) 4.0 2.2 2
assign ( resid 45 and name HN ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 45 and name HN ) ( resid 44 and name HD2# ) 4.0 2.2 2.5
assign ( resid 45 and name HN ) ( resid 44 and name HG ) 5.0 3.2 2.5
assign ( resid 46 and name HN ) ( resid 45 and name HB1 ) 4.0 2.2 2
assign ( resid 46 and name HN ) ( resid 45 and name HB2 ) 4.0 2.2 2
!assign ( resid 47 and name HN ) ( resid 46 and name HB ) 5.0 3.2 2.5
!assign ( resid 47 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 47 and name HD1# ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 47 and name HG12 ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 49 and name HN ) ( resid 48 and name HB2 ) 5.0 3.2 2
assign ( resid 50 and name HN ) ( resid 49 and name HB1 ) 4.0 2.2 2
assign ( resid 50 and name HN ) ( resid 49 and name HB2 ) 4.0 2.2 2
assign ( resid 51 and name HN ) ( resid 50 and name HB1 ) 2.8 1 2
assign ( resid 52 and name HN ) ( resid 51 and name HB1 ) 4.0 2.2 2
assign ( resid 52 and name HN ) ( resid 51 and name HD1 ) 4.0 2.2 2.5
assign ( resid 52 and name HN ) ( resid 51 and name HG2 ) 4.0 2.2 2.5
clas long
assign ( resid 6 and name HN ) ( resid 11 and name HD1# ) 4.0 2.2 2.5
assign ( resid 9 and name HE ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 9 and name HN ) ( resid 38 and name HB2 ) 5.0 3.2 2
assign ( resid 10 and name HD2# ) ( resid 33 and name HA ) 4.0 2.2 2.5
assign ( resid 10 and name HD1# ) ( resid 34 and name HE22 ) 5.0 3.2 2.5
assign ( resid 12 and name HN ) ( resid 7 and name HB1 ) 5.0 3.2 2
assign ( resid 12 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 13 and name HA ) ( resid 33 and name HD1# ) 6.0 4.2 2.5
assign ( resid 13 and name HB1 ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 13 and name HB2 ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 13 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 13 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 13 and name HA ) ( resid 40 and name HD1# ) 4.0 2.2 2.5
assign ( resid 13 and name HB1 ) ( resid 40 and name HD1# ) 5.0 3.2 2.5
assign ( resid 13 and name HN ) ( resid 40 and name HD1# ) 4.0 2.2 2.5
assign ( resid 14 and name HN ) ( resid 6 and name HB# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 14 and name HN ) ( resid 40 and name HD1# ) 4.0 2.2 2.5
assign ( resid 15 and name HN ) ( resid 10 and name HD2# ) 5.0 3.2 2.5
assign ( resid 16 and name HE22 ) ( resid 22 and name HA ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 40 and name HD1# ) 2.8 1 2.5
assign ( resid 16 and name HN ) ( resid 43 and name HB# ) 5.0 3.2 2.5
assign ( resid 16 and name HN ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 17 and name HN ) ( resid 29 and name HD2# ) 4.0 2.2 2.5
assign ( resid 17 and name HN ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 18 and name HN ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
assign ( resid 21 and name HN ) ( resid 48 and name HE22 ) 5.0 3.2 2.5
assign ( resid 22 and name HB1 ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 22 and name HB2 ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 22 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
!assign ( resid 22 and name HZ ) ( resid 44 and name HD1# ) 6.0 4.2 2.5
!assign ( resid 22 and name HZ ) ( resid 47 and name HD1# ) 6.0 4.2 2.5
assign ( resid 23 and name HN ) ( resid 16 and name HE22 ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 28 and name HE1 ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 28 and name HH2 ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 29 and name HD1# ) 4.0 2.2 2.5
assign ( resid 23 and name HN ) ( resid 29 and name HD2# ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 23 and name HN ) ( resid 48 and name HG1 ) 5.0 3.2 2.5
assign ( resid 24 and name HN ) ( resid 18 and name HD1# ) 4.0 2.2 2.5
assign ( resid 24 and name HA ) ( resid 29 and name HB1 ) 5.0 3.2 2
assign ( resid 24 and name HB1 ) ( resid 29 and name HB2 ) 6.0 4.2 2.5
assign ( resid 24 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 46 and name HG1 ) 4.0 2.2 2.5
assign ( resid 25 and name HN ) ( resid 47 and name HD1# ) 5.0 3.2 2.5
assign ( resid 25 and name HN ) ( resid 48 and name HE22 ) 4.0 2.2 2.5
assign ( resid 25 and name HN ) ( resid 48 and name HG1 ) 5.0 3.2 2.5
assign ( resid 26 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 27 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 28 and name HH2 ) ( resid 22 and name HB1 ) 6.0 4.2 2.5
assign ( resid 28 and name HH2 ) ( resid 22 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 22 and name HA ) 6.0 4.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 22 and name HB1 ) 5.0 3.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 22 and name HB2 ) 6.0 4.2 2.5
assign ( resid 28 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 28 and name HE1 ) ( resid 43 and name HB# ) 5.0 3.2 2.5
!assign ( resid 28 and name HD1 ) ( resid 46 and name HG1 ) 6.0 4.2 2.5
assign ( resid 28 and name HE1 ) ( resid 46 and name HG1 ) 2.8 1 2.5
assign ( resid 28 and name HH2 ) ( resid 46 and name HG1 ) 6.0 4.2 2.5
assign ( resid 28 and name HN ) ( resid 46 and name HG1 ) 5.0 3.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 46 and name HG1 ) 4.0 2.2 2.5
!assign ( resid 28 and name HH2 ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 28 and name HZ2 ) ( resid 47 and name HG2# ) 6.0 4.2 2.5
!assign ( resid 28 and name HZ3 ) ( resid 47 and name HG2# ) 5.0 3.2 2.5
assign ( resid 29 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
!assign ( resid 30 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
assign ( resid 30 and name HN ) ( resid 24 and name HB1 ) 5.0 3.2 2
assign ( resid 32 and name HD1# ) ( resid 43 and name HA ) 5.0 3.2 2.5
assign ( resid 33 and name HD2# ) ( resid 38 and name HB2 ) 5.0 3.2 2.5
assign ( resid 33 and name HD2# ) ( resid 39 and name HB2 ) 4.0 2.2 2.5
assign ( resid 38 and name HN ) ( resid 10 and name HD1# ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 10 and name HD2# ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 13 and name HB1 ) 5.0 3.2 2
assign ( resid 38 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 38 and name HA ) ( resid 33 and name HD2# ) 4.0 2.2 2.5
assign ( resid 38 and name HN ) ( resid 33 and name HB2 ) 5.0 3.2 2
assign ( resid 38 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 38 and name HN ) ( resid 33 and name HD2# ) 4.0 2.2 2.5
assign ( resid 39 and name HN ) ( resid 28 and name HZ3 ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 39 and name HN ) ( resid 34 and name HB2 ) 5.0 3.2 2
assign ( resid 39 and name HN ) ( resid 34 and name HE21 ) 5.0 3.2 2.5
assign ( resid 40 and name HN ) ( resid 29 and name HD1# ) 5.0 3.2 2.5
assign ( resid 40 and name HA ) ( resid 33 and name HD2# ) 4.0 2.2 2.5
assign ( resid 40 and name HD1# ) ( resid 33 and name HD1# ) 4.0 2.2 2.5
assign ( resid 40 and name HN ) ( resid 33 and name HB1 ) 5.0 3.2 2
assign ( resid 40 and name HN ) ( resid 33 and name HD1# ) 5.0 3.2 2.5
assign ( resid 40 and name HN ) ( resid 33 and name HD2# ) 4.0 2.2 2.5
assign ( resid 40 and name HN ) ( resid 33 and name HG ) 5.0 3.2 2.5
assign ( resid 41 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 41 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 42 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 42 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 42 and name HN ) ( resid 33 and name HD2# ) 5.0 3.2 2.5
assign ( resid 42 and name HB# ) ( resid 36 and name HB1 ) 4.0 2.2 2.5
!assign ( resid 43 and name HA ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 43 and name HN ) ( resid 32 and name HD1# ) 4.0 2.2 2.5
assign ( resid 43 and name HN ) ( resid 32 and name HD2# ) 4.0 2.2 2.5
assign ( resid 43 and name HB# ) ( resid 33 and name HD2# ) 2.8 1 2.5
assign ( resid 43 and name HN ) ( resid 36 and name HE1 ) 5.0 3.2 2.5
assign ( resid 44 and name HD1# ) ( resid 22 and name HZ ) 5.0 3.2 2.5
assign ( resid 44 and name HD1# ) ( resid 39 and name HB2 ) 5.0 3.2 2.5
assign ( resid 44 and name HA ) ( resid 49 and name HA ) 5.0 3.2 2.5
assign ( resid 44 and name HD1# ) ( resid 49 and name HB1 ) 4.0 2.2 2.5
assign ( resid 44 and name HD1# ) ( resid 49 and name HB2 ) 4.0 2.2 2.5
assign ( resid 46 and name HG1 ) ( resid 28 and name HD1 ) 5.0 3.2 2.5
!assign ( resid 46 and name HG1 ) ( resid 28 and name HE1 ) 4.0 2.2 2.5
!assign ( resid 46 and name HG1 ) ( resid 28 and name HZ2 ) 4.0 2.2 2.5
assign ( resid 46 and name HG1 ) ( resid 32 and name HD1# ) 2.8 1 2.5
assign ( resid 46 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 46 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 47 and name HD1# ) ( resid 22 and name HZ ) 5.0 3.2 2.5
assign ( resid 47 and name HD1# ) ( resid 28 and name HH2 ) 5.0 3.2 2.5
assign ( resid 47 and name HG2# ) ( resid 28 and name HH2 ) 4.0 2.2 2.5
assign ( resid 47 and name HG2# ) ( resid 28 and name HZ3 ) 4.0 2.2 2.5
assign ( resid 47 and name HN ) ( resid 28 and name HZ2 ) 5.0 3.2 2.5
assign ( resid 47 and name HG2# ) ( resid 29 and name HB1 ) 2.8 1 2.5
assign ( resid 47 and name HN ) ( resid 32 and name HD1# ) 5.0 3.2 2.5
assign ( resid 47 and name HN ) ( resid 32 and name HD2# ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 21 and name HA1 ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 21 and name HA2 ) 5.0 3.2 2.5
assign ( resid 48 and name HE22 ) ( resid 22 and name HA ) 5.0 3.2 2.5
assign ( resid 48 and name HN ) ( resid 22 and name HZ ) 5.0 3.2 2.5
assign ( resid 49 and name HN ) ( resid 44 and name HB2 ) 5.0 3.2 2
assign ( resid 49 and name HN ) ( resid 44 and name HD1# ) 5.0 3.2 2.5
!PHI residue 2
assign (resid 1 and name c)   (resid 2 and name n)
       (resid 2 and name ca)  (resid 2 and name c)   1.0 -94.320 30 2
!PSI residue 2
assign (resid 2 and name n)   (resid 2 and name ca)
     (resid 2 and name c)   (resid 3 and name n)  1.0 127.790 30 2

!PHI residue 3
assign (resid 2 and name c)   (resid 3 and name n)
       (resid 3 and name ca)  (resid 3 and name c)   1.0 -64.800 30 2
!PSI residue 3
assign (resid 3 and name n)   (resid 3 and name ca)
     (resid 3 and name c)   (resid 4 and name n)  1.0 148.840 30 2

!PHI residue 7
assign (resid 6 and name c)   (resid 7 and name n)
       (resid 7 and name ca)  (resid 7 and name c)   1.0 -76.790 30 2
!PSI residue 7
assign (resid 7 and name n)   (resid 7 and name ca)
     (resid 7 and name c)   (resid 8 and name n)  1.0 122.530 30 2

!PHI residue 8
assign (resid 7 and name c)   (resid 8 and name n)
       (resid 8 and name ca)  (resid 8 and name c)   1.0 -59.840 30 2
!PSI residue 8
assign (resid 8 and name n)   (resid 8 and name ca)
     (resid 8 and name c)   (resid 9 and name n)  1.0 -31.200 30 2

!PHI residue 9
assign (resid 8 and name c)   (resid 9 and name n)
       (resid 9 and name ca)  (resid 9 and name c)   1.0 -63.000 30 2
!PSI residue 9
assign (resid 9 and name n)   (resid 9 and name ca)
     (resid 9 and name c)   (resid 10 and name n)  1.0 -39.780 30 2

!PHI residue 10
assign (resid 9 and name c)   (resid 10 and name n)
       (resid 10 and name ca)  (resid 10 and name c)   1.0 -67.520 30 2
!PSI residue 10
assign (resid 10 and name n)   (resid 10 and name ca)
     (resid 10 and name c)   (resid 11 and name n)  1.0 -42.150 30 2

!PHI residue 11
assign (resid 10 and name c)   (resid 11 and name n)
       (resid 11 and name ca)  (resid 11 and name c)   1.0 -65.900 30 2
!PSI residue 11
assign (resid 11 and name n)   (resid 11 and name ca)
     (resid 11 and name c)   (resid 12 and name n)  1.0 -38.640 30 2

!PHI residue 12
assign (resid 11 and name c)   (resid 12 and name n)
       (resid 12 and name ca)  (resid 12 and name c)   1.0 -63.600 30 2
!PSI residue 12
assign (resid 12 and name n)   (resid 12 and name ca)
     (resid 12 and name c)   (resid 13 and name n)  1.0 -43.950 30 2

!PHI residue 13
assign (resid 12 and name c)   (resid 13 and name n)
       (resid 13 and name ca)  (resid 13 and name c)   1.0 -64.370 30 2
!PSI residue 13
assign (resid 13 and name n)   (resid 13 and name ca)
     (resid 13 and name c)   (resid 14 and name n)  1.0 -40.570 30 2

!PHI residue 14
assign (resid 13 and name c)   (resid 14 and name n)
       (resid 14 and name ca)  (resid 14 and name c)   1.0 -62.210 30 2
!PSI residue 14
assign (resid 14 and name n)   (resid 14 and name ca)
     (resid 14 and name c)   (resid 15 and name n)  1.0 -46.540 30 2

!PHI residue 15
assign (resid 14 and name c)   (resid 15 and name n)
       (resid 15 and name ca)  (resid 15 and name c)   1.0 -63.260 30 2
!PSI residue 15
assign (resid 15 and name n)   (resid 15 and name ca)
     (resid 15 and name c)   (resid 16 and name n)  1.0 -41.400 30 2

!PHI residue 16
assign (resid 15 and name c)   (resid 16 and name n)
       (resid 16 and name ca)  (resid 16 and name c)   1.0 -65.180 30 2
!PSI residue 16
assign (resid 16 and name n)   (resid 16 and name ca)
     (resid 16 and name c)   (resid 17 and name n)  1.0 -42.720 30 2

!PHI residue 17
assign (resid 16 and name c)   (resid 17 and name n)
       (resid 17 and name ca)  (resid 17 and name c)   1.0 -69.870 30 2
!PSI residue 17
assign (resid 17 and name n)   (resid 17 and name ca)
     (resid 17 and name c)   (resid 18 and name n)  1.0 -38.240 30 2

!PHI residue 18
assign (resid 17 and name c)   (resid 18 and name n)
       (resid 18 and name ca)  (resid 18 and name c)   1.0 -65.190 30 2
!PSI residue 18
assign (resid 18 and name n)   (resid 18 and name ca)
     (resid 18 and name c)   (resid 19 and name n)  1.0 -39.270 30 2

!PHI residue 19
assign (resid 18 and name c)   (resid 19 and name n)
       (resid 19 and name ca)  (resid 19 and name c)   1.0 -68.420 30 2
!PSI residue 19
assign (resid 19 and name n)   (resid 19 and name ca)
     (resid 19 and name c)   (resid 20 and name n)  1.0 -21.000 30 2

!PHI residue 20
assign (resid 19 and name c)   (resid 20 and name n)
       (resid 20 and name ca)  (resid 20 and name c)   1.0 -92.050 30 2
!PSI residue 20
assign (resid 20 and name n)   (resid 20 and name ca)
     (resid 20 and name c)   (resid 21 and name n)  1.0 -1.070 30 2

!PHI residue 21
assign (resid 20 and name c)   (resid 21 and name n)
       (resid 21 and name ca)  (resid 21 and name c)   1.0 83.670 30 2
!PSI residue 21
assign (resid 21 and name n)   (resid 21 and name ca)
     (resid 21 and name c)   (resid 22 and name n)  1.0 16.260 30 2

!PHI residue 22
assign (resid 21 and name c)   (resid 22 and name n)
       (resid 22 and name ca)  (resid 22 and name c)   1.0 -106.530 30 2
!PSI residue 22
assign (resid 22 and name n)   (resid 22 and name ca)
     (resid 22 and name c)   (resid 23 and name n)  1.0 154.230 30 2

!PHI residue 24
assign (resid 23 and name c)   (resid 24 and name n)
       (resid 24 and name ca)  (resid 24 and name c)   1.0 -90.190 30 2
!PSI residue 24
assign (resid 24 and name n)   (resid 24 and name ca)
     (resid 24 and name c)   (resid 25 and name n)  1.0 147.980 30 2

!PHI residue 28
assign (resid 27 and name c)   (resid 28 and name n)
       (resid 28 and name ca)  (resid 28 and name c)   1.0 -65.380 30 2
!PSI residue 28
assign (resid 28 and name n)   (resid 28 and name ca)
     (resid 28 and name c)   (resid 29 and name n)  1.0 -34.340 30 2

!PHI residue 29
assign (resid 28 and name c)   (resid 29 and name n)
       (resid 29 and name ca)  (resid 29 and name c)   1.0 -62.410 30 2
!PSI residue 29
assign (resid 29 and name n)   (resid 29 and name ca)
     (resid 29 and name c)   (resid 30 and name n)  1.0 -40.820 30 2

!PHI residue 30
assign (resid 29 and name c)   (resid 30 and name n)
       (resid 30 and name ca)  (resid 30 and name c)   1.0 -63.570 30 2
!PSI residue 30
assign (resid 30 and name n)   (resid 30 and name ca)
     (resid 30 and name c)   (resid 31 and name n)  1.0 -41.260 30 2

!PHI residue 31
assign (resid 30 and name c)   (resid 31 and name n)
       (resid 31 and name ca)  (resid 31 and name c)   1.0 -64.160 30 2
!PSI residue 31
assign (resid 31 and name n)   (resid 31 and name ca)
     (resid 31 and name c)   (resid 32 and name n)  1.0 -35.730 30 2

!PHI residue 32
assign (resid 31 and name c)   (resid 32 and name n)
       (resid 32 and name ca)  (resid 32 and name c)   1.0 -63.480 30 2
!PSI residue 32
assign (resid 32 and name n)   (resid 32 and name ca)
     (resid 32 and name c)   (resid 33 and name n)  1.0 -45.590 30 2

!PHI residue 33
assign (resid 32 and name c)   (resid 33 and name n)
       (resid 33 and name ca)  (resid 33 and name c)   1.0 -61.820 30 2
!PSI residue 33
assign (resid 33 and name n)   (resid 33 and name ca)
     (resid 33 and name c)   (resid 34 and name n)  1.0 -39.160 30 2

!PHI residue 34
assign (resid 33 and name c)   (resid 34 and name n)
       (resid 34 and name ca)  (resid 34 and name c)   1.0 -63.570 30 2
!PSI residue 34
assign (resid 34 and name n)   (resid 34 and name ca)
     (resid 34 and name c)   (resid 35 and name n)  1.0 -41.300 30 2

!PHI residue 35
assign (resid 34 and name c)   (resid 35 and name n)
       (resid 35 and name ca)  (resid 35 and name c)   1.0 -68.850 30 2
!PSI residue 35
assign (resid 35 and name n)   (resid 35 and name ca)
     (resid 35 and name c)   (resid 36 and name n)  1.0 -33.020 30 2

!PHI residue 36
assign (resid 35 and name c)   (resid 36 and name n)
       (resid 36 and name ca)  (resid 36 and name c)   1.0 -99.210 30 2
!PSI residue 36
assign (resid 36 and name n)   (resid 36 and name ca)
     (resid 36 and name c)   (resid 37 and name n)  1.0 6.470 30 2

!PHI residue 40
assign (resid 39 and name c)   (resid 40 and name n)
       (resid 40 and name ca)  (resid 40 and name c)   1.0 -58.730 30 2
!PSI residue 40
assign (resid 40 and name n)   (resid 40 and name ca)
     (resid 40 and name c)   (resid 41 and name n)  1.0 -34.270 30 2

!PHI residue 41
assign (resid 40 and name c)   (resid 41 and name n)
       (resid 41 and name ca)  (resid 41 and name c)   1.0 -64.020 30 2
!PSI residue 41
assign (resid 41 and name n)   (resid 41 and name ca)
     (resid 41 and name c)   (resid 42 and name n)  1.0 -38.210 30 2

!PHI residue 42
assign (resid 41 and name c)   (resid 42 and name n)
       (resid 42 and name ca)  (resid 42 and name c)   1.0 -68.800 30 2
!PSI residue 42
assign (resid 42 and name n)   (resid 42 and name ca)
     (resid 42 and name c)   (resid 43 and name n)  1.0 -39.470 30 2

!PHI residue 43
assign (resid 42 and name c)   (resid 43 and name n)
       (resid 43 and name ca)  (resid 43 and name c)   1.0 -61.850 30 2
!PSI residue 43
assign (resid 43 and name n)   (resid 43 and name ca)
     (resid 43 and name c)   (resid 44 and name n)  1.0 -43.240 30 2

!PHI residue 44
assign (resid 43 and name c)   (resid 44 and name n)
       (resid 44 and name ca)  (resid 44 and name c)   1.0 -61.460 30 2
!PSI residue 44
assign (resid 44 and name n)   (resid 44 and name ca)
     (resid 44 and name c)   (resid 45 and name n)  1.0 -39.770 30 2

!PHI residue 45
assign (resid 44 and name c)   (resid 45 and name n)
       (resid 45 and name ca)  (resid 45 and name c)   1.0 -65.530 30 2
!PSI residue 45
assign (resid 45 and name n)   (resid 45 and name ca)
     (resid 45 and name c)   (resid 46 and name n)  1.0 -38.030 30 2

!PHI residue 46
assign (resid 45 and name c)   (resid 46 and name n)
       (resid 46 and name ca)  (resid 46 and name c)   1.0 -65.430 30 2
!PSI residue 46
assign (resid 46 and name n)   (resid 46 and name ca)
     (resid 46 and name c)   (resid 47 and name n)  1.0 -36.310 30 2

!PHI residue 47
assign (resid 46 and name c)   (resid 47 and name n)
       (resid 47 and name ca)  (resid 47 and name c)   1.0 -95.100 30 2
!PSI residue 47
assign (resid 47 and name n)   (resid 47 and name ca)
     (resid 47 and name c)   (resid 48 and name n)  1.0 8.320 30 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  19.800   0.240   3.440
    2    H2   GLY   1           2H       GLY   1  20.092  -0.470   1.929
    3    H3   GLY   1           3H       GLY   1  19.753   1.185   2.035
    4    HA2  GLY   1           HA2      GLY   1  21.961   0.562   3.682
    5    HA3  GLY   1           HA3      GLY   1  22.238  -0.037   2.051
    6    H    SER   2           H        SER   2  23.862   1.882   2.968
    7    HA   SER   2           HA       SER   2  22.863   4.465   2.043
    8    HG   SER   2           HG       SER   2  24.574   3.919   5.169
    9    HB2  SER   2           HB2      SER   2  25.530   3.759   3.296
   10    HB3  SER   2           HB3      SER   2  24.883   5.383   3.046
   11    HA   PRO   3           HA       PRO   3  24.678   4.570  -1.958
   12    HB2  PRO   3           HB2      PRO   3  26.229   6.978  -1.124
   13    HB3  PRO   3           HB3      PRO   3  25.158   6.757  -2.512
   14    HG2  PRO   3           HG2      PRO   3  24.350   8.148  -0.394
   15    HG3  PRO   3           HG3      PRO   3  23.236   7.063  -1.249
   16    HD2  PRO   3           HD2      PRO   3  24.623   6.683   1.367
   17    HD3  PRO   3           HD3      PRO   3  23.004   6.163   0.861
   18    HA   PRO   4           HA       PRO   4  28.578   2.537  -1.178
   19    HB2  PRO   4           HB2      PRO   4  28.583   1.864  -4.012
   20    HB3  PRO   4           HB3      PRO   4  28.392   0.804  -2.614
   21    HG2  PRO   4           HG2      PRO   4  26.366   1.338  -4.337
   22    HG3  PRO   4           HG3      PRO   4  26.101   0.994  -2.618
   23    HD2  PRO   4           HD2      PRO   4  26.156   3.634  -4.038
   24    HD3  PRO   4           HD3      PRO   4  25.049   3.061  -2.771
   25    H    GLU   5           H        GLU   5  28.722   5.359  -1.677
   26    HA   GLU   5           HA       GLU   5  31.385   5.458  -2.773
   27    HB2  GLU   5           HB2      GLU   5  30.873   7.238  -4.425
   28    HB3  GLU   5           HB3      GLU   5  30.146   5.690  -4.835
   29    HG2  GLU   5           HG2      GLU   5  28.002   6.445  -4.007
   30    HG3  GLU   5           HG3      GLU   5  28.713   7.977  -3.503
   31    H    ALA   6           H        ALA   6  29.495   6.222  -0.412
   32    HA   ALA   6           HA       ALA   6  31.025   8.388   0.576
   33    HB1  ALA   6           HB1      ALA   6  29.524   9.528  -1.151
   34    HB2  ALA   6           HB2      ALA   6  29.532  10.202   0.478
   35    HB3  ALA   6           HB3      ALA   6  28.193   9.184  -0.045
   36    H    ASP   7           H        ASP   7  29.907   5.777   1.197
   37    HA   ASP   7           HA       ASP   7  28.065   6.111   3.389
   38    HB2  ASP   7           HB2      ASP   7  28.157   4.015   2.069
   39    HB3  ASP   7           HB3      ASP   7  29.838   3.791   2.527
   40    HA   PRO   8           HA       PRO   8  30.949   7.443   6.510
   41    HB2  PRO   8           HB2      PRO   8  30.035   5.054   8.059
   42    HB3  PRO   8           HB3      PRO   8  30.194   6.737   8.575
   43    HG2  PRO   8           HG2      PRO   8  27.802   5.701   8.005
   44    HG3  PRO   8           HG3      PRO   8  28.205   7.374   7.582
   45    HD2  PRO   8           HD2      PRO   8  27.943   4.988   5.826
   46    HD3  PRO   8           HD3      PRO   8  27.660   6.704   5.461
   47    H    ARG   9           H        ARG   9  30.882   4.136   5.422
   48    HA   ARG   9           HA       ARG   9  33.565   3.580   6.421
   49    HE   ARG   9           HE       ARG   9  34.055   0.577   7.277
   50    HB2  ARG   9           HB2      ARG   9  31.558   1.903   4.920
   51    HB3  ARG   9           HB3      ARG   9  33.137   1.321   5.456
   52    HG2  ARG   9           HG2      ARG   9  30.834   2.219   7.173
   53    HG3  ARG   9           HG3      ARG   9  31.503   0.592   7.030
   54    HD2  ARG   9           HD2      ARG   9  32.878   3.014   8.183
   55    HD3  ARG   9           HD3      ARG   9  32.258   1.630   9.083
   56   HH11  ARG   9          HH11      ARG   9  34.166   3.002   9.780
   57   HH12  ARG   9          HH12      ARG   9  35.809   2.669  10.229
   58   HH21  ARG   9          HH21      ARG   9  36.227   0.110   7.857
   59   HH22  ARG   9          HH22      ARG   9  36.968   0.990   9.159
   60    H    LEU  10           H        LEU  10  31.999   4.494   3.467
   61    HA   LEU  10           HA       LEU  10  34.286   3.686   1.870
   62    HG   LEU  10           HG       LEU  10  32.025   2.137   1.738
   63    HB2  LEU  10           HB2      LEU  10  31.508   4.597   1.184
   64    HB3  LEU  10           HB3      LEU  10  32.768   4.455  -0.031
   65   HD11  LEU  10          HD11      LEU  10  29.970   2.572   0.727
   66   HD12  LEU  10          HD12      LEU  10  30.729   1.381  -0.332
   67   HD13  LEU  10          HD13      LEU  10  30.721   3.084  -0.785
   68   HD21  LEU  10          HD21      LEU  10  33.351   2.354  -0.959
   69   HD22  LEU  10          HD22      LEU  10  32.959   0.848  -0.131
   70   HD23  LEU  10          HD23      LEU  10  34.138   1.959   0.568
   71    H    ILE  11           H        ILE  11  32.708   6.513   3.130
   72    HA   ILE  11           HA       ILE  11  34.309   8.335   1.550
   73    HB   ILE  11           HB       ILE  11  32.068   8.969   2.511
   74   HG12  ILE  11          HG12      ILE  11  32.837  11.231   3.254
   75   HG13  ILE  11          HG13      ILE  11  34.486  10.630   3.227
   76   HG21  ILE  11          HG21      ILE  11  32.305   9.853   4.945
   77   HG22  ILE  11          HG22      ILE  11  33.597   8.657   5.060
   78   HG23  ILE  11          HG23      ILE  11  31.955   8.149   4.662
   79   HD11  ILE  11          HD11      ILE  11  32.924  11.683   1.100
   80   HD12  ILE  11          HD12      ILE  11  33.342  10.010   0.729
   81   HD13  ILE  11          HD13      ILE  11  34.614  11.178   1.093
   82    H    GLU  12           H        GLU  12  34.639   6.343   4.250
   83    HA   GLU  12           HA       GLU  12  36.939   7.795   5.328
   84    HB2  GLU  12           HB2      GLU  12  35.047   5.974   6.418
   85    HB3  GLU  12           HB3      GLU  12  36.623   5.198   6.496
   86    HG2  GLU  12           HG2      GLU  12  36.348   6.316   8.535
   87    HG3  GLU  12           HG3      GLU  12  37.465   7.304   7.597
   88    H    SER  13           H        SER  13  36.201   4.557   4.061
   89    HA   SER  13           HA       SER  13  39.028   4.000   3.887
   90    HG   SER  13           HG       SER  13  36.249   2.582   5.226
   91    HB2  SER  13           HB2      SER  13  36.775   2.121   3.195
   92    HB3  SER  13           HB3      SER  13  38.419   1.716   3.690
   93    H    LEU  14           H        LEU  14  36.441   4.703   1.608
   94    HA   LEU  14           HA       LEU  14  38.103   3.711  -0.585
   95    HG   LEU  14           HG       LEU  14  35.119   3.298  -2.713
   96    HB2  LEU  14           HB2      LEU  14  35.572   3.289  -0.411
   97    HB3  LEU  14           HB3      LEU  14  35.376   4.979  -0.826
   98   HD11  LEU  14          HD11      LEU  14  35.320   5.539  -3.348
   99   HD12  LEU  14          HD12      LEU  14  36.522   4.676  -4.308
  100   HD13  LEU  14          HD13      LEU  14  37.023   5.604  -2.895
  101   HD21  LEU  14          HD21      LEU  14  37.113   1.949  -1.975
  102   HD22  LEU  14          HD22      LEU  14  38.120   3.225  -2.655
  103   HD23  LEU  14          HD23      LEU  14  37.025   2.319  -3.697
  104    H    SER  15           H        SER  15  36.628   6.620   0.706
  105    HA   SER  15           HA       SER  15  37.599   8.315  -1.312
  106    HG   SER  15           HG       SER  15  37.428  10.974   0.788
  107    HB2  SER  15           HB2      SER  15  35.724   8.917   0.195
  108    HB3  SER  15           HB3      SER  15  36.879   9.082   1.517
  109    H    GLN  16           H        GLN  16  39.080   6.967   1.518
  110    HA   GLN  16           HA       GLN  16  41.221   8.807   1.793
  111    HB2  GLN  16           HB2      GLN  16  40.798   7.297   3.597
  112    HB3  GLN  16           HB3      GLN  16  40.898   5.897   2.545
  113    HG2  GLN  16           HG2      GLN  16  43.309   7.598   2.793
  114    HG3  GLN  16           HG3      GLN  16  42.863   6.603   4.177
  115   HE21  GLN  16          HE21      GLN  16  44.781   6.653   1.570
  116   HE22  GLN  16          HE22      GLN  16  44.871   4.963   1.205
  117    H    MET  17           H        MET  17  41.026   5.647   0.179
  118    HA   MET  17           HA       MET  17  43.602   5.876  -0.980
  119    HB2  MET  17           HB2      MET  17  42.846   3.884  -2.340
  120    HB3  MET  17           HB3      MET  17  42.792   3.689  -0.593
  121    HG2  MET  17           HG2      MET  17  40.360   4.228  -0.684
  122    HG3  MET  17           HG3      MET  17  40.475   4.200  -2.441
  123    HE1  MET  17           HE1      MET  17  40.999   0.695   0.432
  124    HE2  MET  17           HE2      MET  17  41.341   2.398   0.736
  125    HE3  MET  17           HE3      MET  17  42.503   1.408  -0.148
  126    H    LEU  18           H        LEU  18  40.360   6.676  -2.096
  127    HA   LEU  18           HA       LEU  18  41.065   7.015  -4.831
  128    HG   LEU  18           HG       LEU  18  39.160   9.186  -5.667
  129    HB2  LEU  18           HB2      LEU  18  38.739   6.762  -3.911
  130    HB3  LEU  18           HB3      LEU  18  38.856   8.413  -3.330
  131   HD11  LEU  18          HD11      LEU  18  38.748   7.687  -7.509
  132   HD12  LEU  18          HD12      LEU  18  38.501   6.337  -6.400
  133   HD13  LEU  18          HD13      LEU  18  40.096   7.076  -6.551
  134   HD21  LEU  18          HD21      LEU  18  36.949   9.207  -4.653
  135   HD22  LEU  18          HD22      LEU  18  36.685   7.540  -5.166
  136   HD23  LEU  18          HD23      LEU  18  36.848   8.819  -6.369
  137    H    SER  19           H        SER  19  41.106   9.144  -2.031
  138    HA   SER  19           HA       SER  19  41.701  11.493  -3.575
  139    HG   SER  19           HG       SER  19  41.132  13.507  -1.411
  140    HB2  SER  19           HB2      SER  19  40.464  11.532  -1.400
  141    HB3  SER  19           HB3      SER  19  41.961  11.076  -0.587
  142    H    MET  20           H        MET  20  43.552   9.184  -1.632
  143    HA   MET  20           HA       MET  20  45.944  10.729  -1.701
  144    HB2  MET  20           HB2      MET  20  45.309   9.009   0.045
  145    HB3  MET  20           HB3      MET  20  45.753   7.779  -1.130
  146    HG2  MET  20           HG2      MET  20  47.564   8.184   0.429
  147    HG3  MET  20           HG3      MET  20  48.023   8.648  -1.209
  148    HE1  MET  20           HE1      MET  20  45.719  10.958   1.245
  149    HE2  MET  20           HE2      MET  20  47.052  11.507   2.259
  150    HE3  MET  20           HE3      MET  20  46.667   9.788   2.164
  151    H    GLY  21           H        GLY  21  44.637   8.193  -3.740
  152    HA2  GLY  21           HA2      GLY  21  45.394   8.245  -6.068
  153    HA3  GLY  21           HA3      GLY  21  47.020   8.530  -5.457
  154    H    PHE  22           H        PHE  22  44.534   6.166  -4.528
  155    HA   PHE  22           HA       PHE  22  46.386   4.032  -5.342
  156    HD1  PHE  22           HD1      PHE  22  48.033   3.423  -3.753
  157    HD2  PHE  22           HD2      PHE  22  45.092   5.078  -1.167
  158    HE1  PHE  22           HE1      PHE  22  49.809   4.233  -2.260
  159    HE2  PHE  22           HE2      PHE  22  46.861   5.893   0.334
  160    HZ   PHE  22           HZ       PHE  22  49.223   5.473  -0.217
  161    HB2  PHE  22           HB2      PHE  22  44.412   3.967  -3.041
  162    HB3  PHE  22           HB3      PHE  22  45.447   2.633  -3.550
  163    H    SER  23           H        SER  23  45.064   1.948  -5.779
  164    HA   SER  23           HA       SER  23  42.370   2.532  -6.667
  165    HG   SER  23           HG       SER  23  44.510   3.648  -9.359
  166    HB2  SER  23           HB2      SER  23  44.497   1.649  -8.647
  167    HB3  SER  23           HB3      SER  23  42.777   1.830  -8.996
  168    H    ASP  24           H        ASP  24  42.530   0.159  -8.510
  169    HA   ASP  24           HA       ASP  24  42.421  -1.917  -6.456
  170    HB2  ASP  24           HB2      ASP  24  41.678  -2.125  -9.394
  171    HB3  ASP  24           HB3      ASP  24  41.378  -3.338  -8.156
  172    H    GLU  25           H        GLU  25  44.285  -2.992  -6.112
  173    HA   GLU  25           HA       GLU  25  46.340  -2.986  -8.158
  174    HB2  GLU  25           HB2      GLU  25  46.196  -4.046  -5.345
  175    HB3  GLU  25           HB3      GLU  25  47.548  -4.400  -6.403
  176    HG2  GLU  25           HG2      GLU  25  46.686  -1.586  -5.870
  177    HG3  GLU  25           HG3      GLU  25  47.770  -2.446  -4.777
  178    H    GLY  26           H        GLY  26  44.072  -4.261  -9.078
  179    HA2  GLY  26           HA2      GLY  26  44.689  -6.433 -10.404
  180    HA3  GLY  26           HA3      GLY  26  44.571  -7.137  -8.796
  181    H    GLY  27           H        GLY  27  42.362  -4.931  -8.415
  182    HA2  GLY  27           HA2      GLY  27  40.103  -4.704  -9.239
  183    HA3  GLY  27           HA3      GLY  27  40.228  -6.340  -9.880
  184    H    TRP  28           H        TRP  28  41.662  -6.180  -6.888
  185    HA   TRP  28           HA       TRP  28  39.493  -7.655  -5.678
  186    HD1  TRP  28           HD1      TRP  28  43.824  -7.492  -6.377
  187    HE1  TRP  28           HE1      TRP  28  45.448  -5.640  -5.678
  188    HE3  TRP  28           HE3      TRP  28  41.267  -5.562  -2.406
  189    HZ2  TRP  28           HZ2      TRP  28  45.649  -3.630  -3.734
  190    HZ3  TRP  28           HZ3      TRP  28  42.244  -3.675  -1.174
  191    HH2  TRP  28           HH2      TRP  28  44.392  -2.729  -1.827
  192    HB2  TRP  28           HB2      TRP  28  41.141  -7.868  -3.765
  193    HB3  TRP  28           HB3      TRP  28  41.698  -8.539  -5.301
  194    H    LEU  29           H        LEU  29  40.549  -4.419  -5.769
  195    HA   LEU  29           HA       LEU  29  40.556  -3.559  -3.243
  196    HG   LEU  29           HG       LEU  29  39.051  -0.945  -3.192
  197    HB2  LEU  29           HB2      LEU  29  40.967  -2.123  -5.209
  198    HB3  LEU  29           HB3      LEU  29  39.233  -1.995  -5.453
  199   HD11  LEU  29          HD11      LEU  29  40.918  -1.650  -2.012
  200   HD12  LEU  29          HD12      LEU  29  41.286   0.033  -2.390
  201   HD13  LEU  29          HD13      LEU  29  42.022  -1.264  -3.332
  202   HD21  LEU  29          HD21      LEU  29  39.027   0.894  -4.427
  203   HD22  LEU  29          HD22      LEU  29  40.115   0.165  -5.607
  204   HD23  LEU  29          HD23      LEU  29  40.775   1.015  -4.210
  205    H    THR  30           H        THR  30  37.549  -3.727  -5.150
  206    HA   THR  30           HA       THR  30  35.868  -2.973  -2.998
  207    HB   THR  30           HB       THR  30  34.076  -4.031  -4.444
  208    HG1  THR  30           HG1      THR  30  34.626  -4.988  -6.276
  209   HG21  THR  30          HG21      THR  30  34.033  -1.897  -5.085
  210   HG22  THR  30          HG22      THR  30  34.906  -2.465  -6.509
  211   HG23  THR  30          HG23      THR  30  35.792  -1.778  -5.147
  212    H    ARG  31           H        ARG  31  36.767  -6.132  -4.346
  213    HA   ARG  31           HA       ARG  31  35.235  -7.778  -2.717
  214    HE   ARG  31           HE       ARG  31  39.028  -9.747  -4.835
  215    HB2  ARG  31           HB2      ARG  31  37.983  -8.704  -3.367
  216    HB3  ARG  31           HB3      ARG  31  36.440  -9.524  -3.573
  217    HG2  ARG  31           HG2      ARG  31  36.005  -7.875  -5.472
  218    HG3  ARG  31           HG3      ARG  31  37.715  -7.477  -5.355
  219    HD2  ARG  31           HD2      ARG  31  36.530 -10.189  -5.926
  220    HD3  ARG  31           HD3      ARG  31  37.369  -9.143  -7.070
  221   HH11  ARG  31          HH11      ARG  31  37.702 -11.117  -7.757
  222   HH12  ARG  31          HH12      ARG  31  39.024 -12.215  -8.010
  223   HH21  ARG  31          HH21      ARG  31  40.783 -11.204  -5.134
  224   HH22  ARG  31          HH22      ARG  31  40.783 -12.265  -6.508
  225    H    LEU  32           H        LEU  32  38.601  -6.726  -2.220
  226    HA   LEU  32           HA       LEU  32  39.070  -7.894   0.268
  227    HG   LEU  32           HG       LEU  32  42.274  -5.922   0.193
  228    HB2  LEU  32           HB2      LEU  32  40.658  -6.763  -1.333
  229    HB3  LEU  32           HB3      LEU  32  40.090  -5.226  -0.710
  230   HD11  LEU  32          HD11      LEU  32  40.648  -6.049   2.613
  231   HD12  LEU  32          HD12      LEU  32  40.256  -4.721   1.521
  232   HD13  LEU  32          HD13      LEU  32  41.900  -4.904   2.132
  233   HD21  LEU  32          HD21      LEU  32  41.183  -8.412   0.333
  234   HD22  LEU  32          HD22      LEU  32  41.196  -7.906   2.024
  235   HD23  LEU  32          HD23      LEU  32  42.692  -7.903   1.088
  236    H    LEU  33           H        LEU  33  38.012  -4.557  -0.435
  237    HA   LEU  33           HA       LEU  33  37.765  -3.685   2.176
  238    HG   LEU  33           HG       LEU  33  38.747  -2.372  -0.237
  239    HB2  LEU  33           HB2      LEU  33  36.266  -2.855  -0.302
  240    HB3  LEU  33           HB3      LEU  33  36.132  -2.005   1.230
  241   HD11  LEU  33          HD11      LEU  33  38.119   0.268  -0.445
  242   HD12  LEU  33          HD12      LEU  33  36.545  -0.495  -0.678
  243   HD13  LEU  33          HD13      LEU  33  37.900  -0.931  -1.722
  244   HD21  LEU  33          HD21      LEU  33  39.319  -1.863   1.932
  245   HD22  LEU  33          HD22      LEU  33  37.857  -0.918   2.209
  246   HD23  LEU  33          HD23      LEU  33  39.166  -0.251   1.235
  247    H    GLN  34           H        GLN  34  34.986  -4.548   0.112
  248    HA   GLN  34           HA       GLN  34  33.078  -4.311   2.054
  249    HB2  GLN  34           HB2      GLN  34  33.188  -5.854  -0.487
  250    HB3  GLN  34           HB3      GLN  34  31.805  -6.078   0.578
  251    HG2  GLN  34           HG2      GLN  34  31.074  -4.423  -0.838
  252    HG3  GLN  34           HG3      GLN  34  31.667  -3.493   0.538
  253   HE21  GLN  34          HE21      GLN  34  33.373  -2.129   0.264
  254   HE22  GLN  34          HE22      GLN  34  34.115  -1.822  -1.267
  255    H    THR  35           H        THR  35  34.948  -7.244   1.364
  256    HA   THR  35           HA       THR  35  33.358  -8.909   3.027
  257    HB   THR  35           HB       THR  35  35.280 -10.503   2.832
  258    HG1  THR  35           HG1      THR  35  36.413  -8.533   1.137
  259   HG21  THR  35          HG21      THR  35  33.612 -10.651   1.139
  260   HG22  THR  35          HG22      THR  35  35.192 -10.749   0.359
  261   HG23  THR  35          HG23      THR  35  34.266  -9.249   0.293
  262    H    LYS  36           H        LYS  36  35.658  -6.555   3.803
  263    HA   LYS  36           HA       LYS  36  35.990  -7.705   6.497
  264    HB2  LYS  36           HB2      LYS  36  37.891  -5.834   5.071
  265    HB3  LYS  36           HB3      LYS  36  38.127  -6.551   6.661
  266    HG2  LYS  36           HG2      LYS  36  38.250  -8.767   5.667
  267    HG3  LYS  36           HG3      LYS  36  37.951  -8.080   4.070
  268    HD2  LYS  36           HD2      LYS  36  40.226  -8.229   4.002
  269    HD3  LYS  36           HD3      LYS  36  40.059  -6.615   4.694
  270    HE2  LYS  36           HE2      LYS  36  40.477  -9.155   6.271
  271    HE3  LYS  36           HE3      LYS  36  41.743  -8.002   5.856
  272    HZ1  LYS  36           HZ1      LYS  36  39.548  -7.751   7.793
  273    HZ2  LYS  36           HZ2      LYS  36  40.154  -6.340   7.060
  274    HZ3  LYS  36           HZ3      LYS  36  41.188  -7.341   7.957
  275    H    ASN  37           H        ASN  37  33.770  -6.193   5.729
  276    HA   ASN  37           HA       ASN  37  32.552  -4.313   6.032
  277    HB2  ASN  37           HB2      ASN  37  32.477  -3.419   8.317
  278    HB3  ASN  37           HB3      ASN  37  32.459  -5.179   8.298
  279   HD21  ASN  37          HD21      ASN  37  33.910  -2.409   9.542
  280   HD22  ASN  37          HD22      ASN  37  35.235  -3.165  10.360
  281    H    TYR  38           H        TYR  38  34.558  -3.719   4.430
  282    HA   TYR  38           HA       TYR  38  35.643  -1.990   3.461
  283    HD1  TYR  38           HD1      TYR  38  34.093  -0.600   1.807
  284    HD2  TYR  38           HD2      TYR  38  31.937  -0.993   5.448
  285    HE1  TYR  38           HE1      TYR  38  32.021  -0.971   0.536
  286    HE2  TYR  38           HE2      TYR  38  29.860  -1.366   4.188
  287    HH   TYR  38           HH       TYR  38  29.852  -1.385   0.621
  288    HB2  TYR  38           HB2      TYR  38  34.179  -0.327   5.519
  289    HB3  TYR  38           HB3      TYR  38  34.960   0.293   4.067
  290    H    ASP  39           H        ASP  39  37.559  -3.019   4.327
  291    HA   ASP  39           HA       ASP  39  38.759  -1.597   6.601
  292    HB2  ASP  39           HB2      ASP  39  38.454  -3.980   6.946
  293    HB3  ASP  39           HB3      ASP  39  39.319  -4.339   5.454
  294    H    ILE  40           H        ILE  40  40.417  -0.293   6.240
  295    HA   ILE  40           HA       ILE  40  41.811  -0.415   3.686
  296    HB   ILE  40           HB       ILE  40  43.032   1.631   4.642
  297   HG12  ILE  40          HG12      ILE  40  41.802   1.025   6.978
  298   HG13  ILE  40          HG13      ILE  40  42.340   2.647   6.558
  299   HG21  ILE  40          HG21      ILE  40  41.653   2.881   3.395
  300   HG22  ILE  40          HG22      ILE  40  40.222   2.405   4.311
  301   HG23  ILE  40          HG23      ILE  40  40.860   1.342   3.057
  302   HD11  ILE  40          HD11      ILE  40  40.005   3.016   5.629
  303   HD12  ILE  40          HD12      ILE  40  40.167   2.902   7.382
  304   HD13  ILE  40          HD13      ILE  40  39.558   1.525   6.462
  305    H    GLY  41           H        GLY  41  42.047  -1.694   6.750
  306    HA2  GLY  41           HA2      GLY  41  44.806  -1.530   7.228
  307    HA3  GLY  41           HA3      GLY  41  43.738  -2.746   7.894
  308    H    ALA  42           H        ALA  42  42.872  -3.933   5.577
  309    HA   ALA  42           HA       ALA  42  45.285  -5.358   4.760
  310    HB1  ALA  42           HB1      ALA  42  43.520  -6.901   3.663
  311    HB2  ALA  42           HB2      ALA  42  42.368  -6.021   4.673
  312    HB3  ALA  42           HB3      ALA  42  43.694  -6.915   5.418
  313    H    ALA  43           H        ALA  43  43.076  -3.053   3.606
  314    HA   ALA  43           HA       ALA  43  43.384  -3.553   0.810
  315    HB1  ALA  43           HB1      ALA  43  41.607  -2.102   2.126
  316    HB2  ALA  43           HB2      ALA  43  42.059  -1.726   0.462
  317    HB3  ALA  43           HB3      ALA  43  42.770  -0.818   1.796
  318    H    LEU  44           H        LEU  44  44.808  -1.181   3.051
  319    HA   LEU  44           HA       LEU  44  46.542   0.003   1.181
  320    HG   LEU  44           HG       LEU  44  46.707   2.257   2.220
  321    HB2  LEU  44           HB2      LEU  44  46.373  -0.049   4.148
  322    HB3  LEU  44           HB3      LEU  44  47.884   0.484   3.424
  323   HD11  LEU  44          HD11      LEU  44  44.279   1.034   3.485
  324   HD12  LEU  44          HD12      LEU  44  44.564   1.439   1.790
  325   HD13  LEU  44          HD13      LEU  44  44.315   2.723   2.973
  326   HD21  LEU  44          HD21      LEU  44  47.186   3.467   4.010
  327   HD22  LEU  44          HD22      LEU  44  47.007   2.055   5.052
  328   HD23  LEU  44          HD23      LEU  44  45.606   3.058   4.678
  329    H    ASP  45           H        ASP  45  46.803  -2.895   3.060
  330    HA   ASP  45           HA       ASP  45  49.524  -3.357   3.087
  331    HB2  ASP  45           HB2      ASP  45  48.018  -4.825   4.249
  332    HB3  ASP  45           HB3      ASP  45  47.221  -5.280   2.747
  333    H    THR  46           H        THR  46  47.226  -4.050   0.455
  334    HA   THR  46           HA       THR  46  49.467  -4.914  -1.190
  335    HB   THR  46           HB       THR  46  47.469  -5.402  -2.820
  336    HG1  THR  46           HG1      THR  46  45.801  -4.465  -1.752
  337   HG21  THR  46          HG21      THR  46  48.888  -6.982  -1.185
  338   HG22  THR  46          HG22      THR  46  47.549  -7.559  -2.177
  339   HG23  THR  46          HG23      THR  46  47.286  -7.174  -0.475
  340    H    ILE  47           H        ILE  47  47.373  -2.143  -0.876
  341    HA   ILE  47           HA       ILE  47  47.940  -1.213  -3.550
  342    HB   ILE  47           HB       ILE  47  46.820   0.907  -2.909
  343   HG12  ILE  47          HG12      ILE  47  46.209  -0.569  -0.348
  344   HG13  ILE  47          HG13      ILE  47  47.233   0.858  -0.501
  345   HG21  ILE  47          HG21      ILE  47  45.588  -1.746  -3.037
  346   HG22  ILE  47          HG22      ILE  47  45.271  -0.293  -3.984
  347   HG23  ILE  47          HG23      ILE  47  44.552  -0.478  -2.383
  348   HD11  ILE  47          HD11      ILE  47  44.818   1.154   0.300
  349   HD12  ILE  47          HD12      ILE  47  44.380   0.913  -1.392
  350   HD13  ILE  47          HD13      ILE  47  45.436   2.252  -0.934
  351    H    GLN  48           H        GLN  48  50.311  -1.655  -2.382
  352    HA   GLN  48           HA       GLN  48  52.357  -0.696  -2.611
  353    HB2  GLN  48           HB2      GLN  48  50.955   1.978  -2.554
  354    HB3  GLN  48           HB3      GLN  48  52.661   1.727  -2.898
  355    HG2  GLN  48           HG2      GLN  48  52.243   1.279  -5.033
  356    HG3  GLN  48           HG3      GLN  48  50.997   0.100  -4.613
  357   HE21  GLN  48          HE21      GLN  48  49.011   0.564  -5.196
  358   HE22  GLN  48          HE22      GLN  48  48.390   2.137  -5.564
  359    H    TYR  49           H        TYR  49  50.754  -1.025   0.021
  360    HA   TYR  49           HA       TYR  49  52.956   0.095   1.602
  361    HD1  TYR  49           HD1      TYR  49  53.158   2.180   2.312
  362    HD2  TYR  49           HD2      TYR  49  48.912   2.041   2.079
  363    HE1  TYR  49           HE1      TYR  49  53.108   4.593   1.833
  364    HE2  TYR  49           HE2      TYR  49  48.850   4.445   1.594
  365    HH   TYR  49           HH       TYR  49  50.591   6.484   2.187
  366    HB2  TYR  49           HB2      TYR  49  50.050   0.089   2.435
  367    HB3  TYR  49           HB3      TYR  49  51.386   0.339   3.558
  368    H    SER  50           H        SER  50  53.803  -2.065   1.166
  369    HA   SER  50           HA       SER  50  52.413  -4.357   2.169
  370    HG   SER  50           HG       SER  50  55.093  -6.359   1.025
  371    HB2  SER  50           HB2      SER  50  54.095  -4.314   0.256
  372    HB3  SER  50           HB3      SER  50  55.352  -4.200   1.491
  373    H    LYS  51           H        LYS  51  53.168  -2.091   4.039
  374    HA   LYS  51           HA       LYS  51  53.642  -3.716   6.305
  375    HB2  LYS  51           HB2      LYS  51  55.981  -3.492   5.355
  376    HB3  LYS  51           HB3      LYS  51  55.873  -1.768   5.686
  377    HG2  LYS  51           HG2      LYS  51  55.594  -2.226   8.061
  378    HG3  LYS  51           HG3      LYS  51  55.657  -3.962   7.738
  379    HD2  LYS  51           HD2      LYS  51  57.942  -3.628   6.780
  380    HD3  LYS  51           HD3      LYS  51  57.863  -1.945   7.312
  381    HE2  LYS  51           HE2      LYS  51  59.083  -3.343   8.906
  382    HE3  LYS  51           HE3      LYS  51  57.619  -2.661   9.618
  383    HZ1  LYS  51           HZ1      LYS  51  58.081  -5.094  10.070
  384    HZ2  LYS  51           HZ2      LYS  51  57.685  -5.385   8.443
  385    HZ3  LYS  51           HZ3      LYS  51  56.525  -4.723   9.496
  386    H    HIS  52           H        HIS  52  52.336  -2.779   7.753
  387    HA   HIS  52           HA       HIS  52  51.567  -0.019   7.467
  388    HD1  HIS  52           HD1      HIS  52  49.832  -2.104   6.265
  389    HD2  HIS  52           HD2      HIS  52  47.938   0.071   9.261
  390    HE1  HIS  52           HE1      HIS  52  47.559  -1.470   5.355
  391    HB2  HIS  52           HB2      HIS  52  50.656  -2.326   9.084
  392    HB3  HIS  52           HB3      HIS  52  50.414  -0.737   9.802
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  19.035   1.623  -2.420
    2    H2   GLY   1           2H       GLY   1  20.560   1.839  -3.130
    3    H3   GLY   1           3H       GLY   1  19.416   3.091  -3.177
    4    HA2  GLY   1           HA2      GLY   1  19.532   3.358  -0.795
    5    HA3  GLY   1           HA3      GLY   1  20.662   2.011  -0.706
    6    H    SER   2           H        SER   2  22.376   3.161   0.148
    7    HA   SER   2           HA       SER   2  23.291   5.589  -1.127
    8    HG   SER   2           HG       SER   2  26.112   5.373   0.343
    9    HB2  SER   2           HB2      SER   2  23.488   5.221   1.337
   10    HB3  SER   2           HB3      SER   2  24.646   3.928   1.018
   11    HA   PRO   3           HA       PRO   3  25.759   3.489  -4.181
   12    HB2  PRO   3           HB2      PRO   3  27.350   5.623  -4.842
   13    HB3  PRO   3           HB3      PRO   3  25.709   5.393  -5.450
   14    HG2  PRO   3           HG2      PRO   3  26.677   7.115  -3.205
   15    HG3  PRO   3           HG3      PRO   3  25.469   7.475  -4.453
   16    HD2  PRO   3           HD2      PRO   3  24.772   6.774  -1.944
   17    HD3  PRO   3           HD3      PRO   3  23.804   6.302  -3.356
   18    HA   PRO   4           HA       PRO   4  29.308   2.318  -1.798
   19    HB2  PRO   4           HB2      PRO   4  30.381   1.066  -4.209
   20    HB3  PRO   4           HB3      PRO   4  29.781   0.310  -2.733
   21    HG2  PRO   4           HG2      PRO   4  28.461   0.150  -5.091
   22    HG3  PRO   4           HG3      PRO   4  27.625   0.163  -3.527
   23    HD2  PRO   4           HD2      PRO   4  28.011   2.398  -5.489
   24    HD3  PRO   4           HD3      PRO   4  26.570   1.966  -4.540
   25    H    GLU   5           H        GLU   5  29.412   4.937  -3.152
   26    HA   GLU   5           HA       GLU   5  32.323   5.127  -3.316
   27    HB2  GLU   5           HB2      GLU   5  31.219   5.049  -5.638
   28    HB3  GLU   5           HB3      GLU   5  30.546   6.622  -5.242
   29    HG2  GLU   5           HG2      GLU   5  32.791   7.532  -5.003
   30    HG3  GLU   5           HG3      GLU   5  33.475   5.950  -5.380
   31    H    ALA   6           H        ALA   6  29.824   5.794  -1.639
   32    HA   ALA   6           HA       ALA   6  30.815   8.099  -0.336
   33    HB1  ALA   6           HB1      ALA   6  28.178   8.886  -1.318
   34    HB2  ALA   6           HB2      ALA   6  29.393   8.795  -2.595
   35    HB3  ALA   6           HB3      ALA   6  29.664   9.828  -1.192
   36    H    ASP   7           H        ASP   7  29.822   5.400  -0.039
   37    HA   ASP   7           HA       ASP   7  27.366   5.526   1.471
   38    HB2  ASP   7           HB2      ASP   7  27.890   3.538   0.132
   39    HB3  ASP   7           HB3      ASP   7  29.415   3.336   0.984
   40    HA   PRO   8           HA       PRO   8  28.947   6.765   5.415
   41    HB2  PRO   8           HB2      PRO   8  27.807   4.176   6.393
   42    HB3  PRO   8           HB3      PRO   8  27.672   5.796   7.088
   43    HG2  PRO   8           HG2      PRO   8  25.675   4.719   5.660
   44    HG3  PRO   8           HG3      PRO   8  26.042   6.451   5.595
   45    HD2  PRO   8           HD2      PRO   8  26.466   4.363   3.551
   46    HD3  PRO   8           HD3      PRO   8  26.326   6.121   3.359
   47    H    ARG   9           H        ARG   9  29.611   3.514   4.271
   48    HA   ARG   9           HA       ARG   9  31.841   3.179   6.118
   49    HE   ARG   9           HE       ARG   9  29.027  -1.277   5.632
   50    HB2  ARG   9           HB2      ARG   9  30.721   1.370   3.975
   51    HB3  ARG   9           HB3      ARG   9  32.022   0.937   5.088
   52    HG2  ARG   9           HG2      ARG   9  30.449   0.130   6.435
   53    HG3  ARG   9           HG3      ARG   9  29.975   1.802   6.748
   54    HD2  ARG   9           HD2      ARG   9  27.976   1.188   5.956
   55    HD3  ARG   9           HD3      ARG   9  28.739   1.303   4.370
   56   HH11  ARG   9          HH11      ARG   9  27.213   0.710   3.424
   57   HH12  ARG   9          HH12      ARG   9  26.249  -0.605   2.815
   58   HH21  ARG   9          HH21      ARG   9  27.748  -3.020   4.877
   59   HH22  ARG   9          HH22      ARG   9  26.532  -2.729   3.667
   60    H    LEU  10           H        LEU  10  31.267   3.594   2.646
   61    HA   LEU  10           HA       LEU  10  34.088   3.298   2.121
   62    HG   LEU  10           HG       LEU  10  31.761   1.388   1.395
   63    HB2  LEU  10           HB2      LEU  10  31.725   3.562   0.271
   64    HB3  LEU  10           HB3      LEU  10  33.383   3.329  -0.258
   65   HD11  LEU  10          HD11      LEU  10  32.675   1.335  -1.472
   66   HD12  LEU  10          HD12      LEU  10  31.014   1.374  -0.876
   67   HD13  LEU  10          HD13      LEU  10  32.014  -0.056  -0.610
   68   HD21  LEU  10          HD21      LEU  10  33.631  -0.106   1.233
   69   HD22  LEU  10          HD22      LEU  10  34.175   1.411   1.952
   70   HD23  LEU  10          HD23      LEU  10  34.531   1.056   0.260
   71    H    ILE  11           H        ILE  11  31.875   5.849   2.589
   72    HA   ILE  11           HA       ILE  11  33.314   7.788   1.007
   73    HB   ILE  11           HB       ILE  11  30.905   8.087   1.714
   74   HG12  ILE  11          HG12      ILE  11  32.800  10.290   2.551
   75   HG13  ILE  11          HG13      ILE  11  32.317   9.951   0.893
   76   HG21  ILE  11          HG21      ILE  11  30.345   7.928   3.851
   77   HG22  ILE  11          HG22      ILE  11  31.320   9.355   4.202
   78   HG23  ILE  11          HG23      ILE  11  32.040   7.748   4.305
   79   HD11  ILE  11          HD11      ILE  11  30.303  10.574   3.014
   80   HD12  ILE  11          HD12      ILE  11  30.133  10.673   1.263
   81   HD13  ILE  11          HD13      ILE  11  31.136  11.843   2.120
   82    H    GLU  12           H        GLU  12  33.681   6.181   3.965
   83    HA   GLU  12           HA       GLU  12  35.673   8.087   4.960
   84    HB2  GLU  12           HB2      GLU  12  34.632   5.528   6.185
   85    HB3  GLU  12           HB3      GLU  12  35.786   6.617   6.938
   86    HG2  GLU  12           HG2      GLU  12  34.080   8.383   6.956
   87    HG3  GLU  12           HG3      GLU  12  32.928   7.254   6.243
   88    H    SER  13           H        SER  13  35.388   4.631   4.156
   89    HA   SER  13           HA       SER  13  38.248   4.363   4.404
   90    HG   SER  13           HG       SER  13  36.852   1.865   6.211
   91    HB2  SER  13           HB2      SER  13  36.148   2.259   3.862
   92    HB3  SER  13           HB3      SER  13  37.833   1.956   4.287
   93    H    LEU  14           H        LEU  14  35.950   4.343   1.712
   94    HA   LEU  14           HA       LEU  14  38.046   3.347  -0.065
   95    HG   LEU  14           HG       LEU  14  37.258   2.991  -2.433
   96    HB2  LEU  14           HB2      LEU  14  35.766   2.419  -0.278
   97    HB3  LEU  14           HB3      LEU  14  35.146   4.023  -0.606
   98   HD11  LEU  14          HD11      LEU  14  36.117   1.254  -3.219
   99   HD12  LEU  14          HD12      LEU  14  34.649   2.219  -3.363
  100   HD13  LEU  14          HD13      LEU  14  35.025   1.409  -1.842
  101   HD21  LEU  14          HD21      LEU  14  35.045   4.047  -3.787
  102   HD22  LEU  14          HD22      LEU  14  36.601   4.827  -3.500
  103   HD23  LEU  14          HD23      LEU  14  35.272   5.065  -2.366
  104    H    SER  15           H        SER  15  36.045   6.135   0.575
  105    HA   SER  15           HA       SER  15  36.993   7.686  -1.554
  106    HG   SER  15           HG       SER  15  35.528  10.531  -0.178
  107    HB2  SER  15           HB2      SER  15  34.878   8.051  -0.159
  108    HB3  SER  15           HB3      SER  15  35.932   8.832   1.019
  109    H    GLN  16           H        GLN  16  38.282   6.985   1.596
  110    HA   GLN  16           HA       GLN  16  40.157   9.169   1.593
  111    HB2  GLN  16           HB2      GLN  16  41.027   8.310   3.575
  112    HB3  GLN  16           HB3      GLN  16  39.335   7.847   3.653
  113    HG2  GLN  16           HG2      GLN  16  40.213   5.868   4.256
  114    HG3  GLN  16           HG3      GLN  16  40.338   5.640   2.513
  115   HE21  GLN  16          HE21      GLN  16  42.234   4.947   1.841
  116   HE22  GLN  16          HE22      GLN  16  43.754   5.214   2.614
  117    H    MET  17           H        MET  17  40.002   5.948   0.304
  118    HA   MET  17           HA       MET  17  42.768   5.645  -0.301
  119    HB2  MET  17           HB2      MET  17  40.343   4.467  -1.686
  120    HB3  MET  17           HB3      MET  17  42.006   3.953  -1.930
  121    HG2  MET  17           HG2      MET  17  40.603   3.823   0.726
  122    HG3  MET  17           HG3      MET  17  40.635   2.494  -0.430
  123    HE1  MET  17           HE1      MET  17  42.530   1.365  -1.275
  124    HE2  MET  17           HE2      MET  17  44.003   1.032  -0.359
  125    HE3  MET  17           HE3      MET  17  43.929   2.425  -1.439
  126    H    LEU  18           H        LEU  18  39.954   6.988  -1.979
  127    HA   LEU  18           HA       LEU  18  41.353   7.605  -4.384
  128    HG   LEU  18           HG       LEU  18  37.816   7.696  -5.360
  129    HB2  LEU  18           HB2      LEU  18  38.738   8.400  -3.202
  130    HB3  LEU  18           HB3      LEU  18  39.376   9.361  -4.521
  131   HD11  LEU  18          HD11      LEU  18  40.165   6.393  -6.405
  132   HD12  LEU  18          HD12      LEU  18  40.394   8.139  -6.298
  133   HD13  LEU  18          HD13      LEU  18  39.029   7.482  -7.203
  134   HD21  LEU  18          HD21      LEU  18  38.632   5.259  -5.274
  135   HD22  LEU  18          HD22      LEU  18  37.836   5.927  -3.849
  136   HD23  LEU  18          HD23      LEU  18  39.592   5.784  -3.891
  137    H    SER  19           H        SER  19  40.870   9.392  -1.384
  138    HA   SER  19           HA       SER  19  41.886  11.825  -2.538
  139    HG   SER  19           HG       SER  19  40.030  10.370   0.169
  140    HB2  SER  19           HB2      SER  19  41.726  12.605  -0.079
  141    HB3  SER  19           HB3      SER  19  40.235  12.227  -0.943
  142    H    MET  20           H        MET  20  43.187   9.290  -0.451
  143    HA   MET  20           HA       MET  20  45.552  10.795   0.176
  144    HB2  MET  20           HB2      MET  20  44.888   7.876   0.571
  145    HB3  MET  20           HB3      MET  20  46.377   8.623   1.122
  146    HG2  MET  20           HG2      MET  20  43.630   9.480   1.997
  147    HG3  MET  20           HG3      MET  20  44.644   8.337   2.873
  148    HE1  MET  20           HE1      MET  20  45.649  12.655   1.933
  149    HE2  MET  20           HE2      MET  20  44.106  12.506   2.773
  150    HE3  MET  20           HE3      MET  20  44.366  11.655   1.251
  151    H    GLY  21           H        GLY  21  44.571   8.957  -2.508
  152    HA2  GLY  21           HA2      GLY  21  45.831   8.986  -4.523
  153    HA3  GLY  21           HA3      GLY  21  47.300   9.136  -3.566
  154    H    PHE  22           H        PHE  22  44.635   6.809  -3.308
  155    HA   PHE  22           HA       PHE  22  46.516   4.684  -4.074
  156    HD1  PHE  22           HD1      PHE  22  48.061   4.149  -2.370
  157    HD2  PHE  22           HD2      PHE  22  44.809   5.298   0.119
  158    HE1  PHE  22           HE1      PHE  22  49.647   4.824  -0.620
  159    HE2  PHE  22           HE2      PHE  22  46.393   5.980   1.877
  160    HZ   PHE  22           HZ       PHE  22  48.813   5.741   1.511
  161    HB2  PHE  22           HB2      PHE  22  44.359   4.464  -1.950
  162    HB3  PHE  22           HB3      PHE  22  45.461   3.183  -2.449
  163    H    SER  23           H        SER  23  44.920   2.602  -4.383
  164    HA   SER  23           HA       SER  23  42.364   3.324  -5.448
  165    HG   SER  23           HG       SER  23  43.638   4.781  -6.810
  166    HB2  SER  23           HB2      SER  23  44.454   2.231  -7.365
  167    HB3  SER  23           HB3      SER  23  42.754   2.495  -7.743
  168    H    ASP  24           H        ASP  24  42.887   0.778  -7.221
  169    HA   ASP  24           HA       ASP  24  42.990  -1.173  -5.044
  170    HB2  ASP  24           HB2      ASP  24  41.449  -2.648  -6.306
  171    HB3  ASP  24           HB3      ASP  24  40.677  -1.150  -5.799
  172    H    GLU  25           H        GLU  25  44.527  -2.716  -5.335
  173    HA   GLU  25           HA       GLU  25  45.932  -2.640  -7.908
  174    HB2  GLU  25           HB2      GLU  25  47.150  -2.389  -5.658
  175    HB3  GLU  25           HB3      GLU  25  46.870  -4.114  -5.453
  176    HG2  GLU  25           HG2      GLU  25  48.086  -4.558  -7.523
  177    HG3  GLU  25           HG3      GLU  25  48.360  -2.829  -7.730
  178    H    GLY  26           H        GLY  26  43.643  -3.794  -8.365
  179    HA2  GLY  26           HA2      GLY  26  43.899  -6.098  -9.595
  180    HA3  GLY  26           HA3      GLY  26  43.927  -6.685  -7.936
  181    H    GLY  27           H        GLY  27  41.917  -4.069  -7.902
  182    HA2  GLY  27           HA2      GLY  27  39.630  -3.793  -8.330
  183    HA3  GLY  27           HA3      GLY  27  39.564  -5.449  -8.919
  184    H    TRP  28           H        TRP  28  41.234  -5.206  -6.014
  185    HA   TRP  28           HA       TRP  28  39.099  -6.600  -4.665
  186    HD1  TRP  28           HD1      TRP  28  43.484  -6.748  -5.458
  187    HE1  TRP  28           HE1      TRP  28  45.230  -4.955  -4.866
  188    HE3  TRP  28           HE3      TRP  28  41.003  -4.387  -1.658
  189    HZ2  TRP  28           HZ2      TRP  28  45.512  -2.831  -3.056
  190    HZ3  TRP  28           HZ3      TRP  28  42.079  -2.473  -0.556
  191    HH2  TRP  28           HH2      TRP  28  44.292  -1.713  -1.243
  192    HB2  TRP  28           HB2      TRP  28  40.827  -6.853  -2.834
  193    HB3  TRP  28           HB3      TRP  28  41.270  -7.557  -4.391
  194    H    LEU  29           H        LEU  29  39.897  -3.353  -4.928
  195    HA   LEU  29           HA       LEU  29  39.817  -2.470  -2.292
  196    HG   LEU  29           HG       LEU  29  37.975   0.100  -2.866
  197    HB2  LEU  29           HB2      LEU  29  40.540  -0.996  -4.020
  198    HB3  LEU  29           HB3      LEU  29  38.991  -1.078  -4.834
  199   HD11  LEU  29          HD11      LEU  29  39.294  -0.143  -1.032
  200   HD12  LEU  29          HD12      LEU  29  39.888   1.417  -1.602
  201   HD13  LEU  29          HD13      LEU  29  40.794  -0.054  -1.957
  202   HD21  LEU  29          HD21      LEU  29  39.641   1.133  -4.940
  203   HD22  LEU  29          HD22      LEU  29  39.803   2.146  -3.505
  204   HD23  LEU  29          HD23      LEU  29  38.209   1.852  -4.202
  205    H    THR  30           H        THR  30  37.205  -3.511  -4.327
  206    HA   THR  30           HA       THR  30  35.225  -2.567  -2.390
  207    HB   THR  30           HB       THR  30  33.559  -3.419  -4.006
  208    HG1  THR  30           HG1      THR  30  34.494  -5.047  -5.062
  209   HG21  THR  30          HG21      THR  30  35.331  -1.248  -4.476
  210   HG22  THR  30          HG22      THR  30  33.648  -1.435  -4.970
  211   HG23  THR  30          HG23      THR  30  34.946  -2.005  -6.020
  212    H    ARG  31           H        ARG  31  37.157  -5.254  -2.988
  213    HA   ARG  31           HA       ARG  31  35.292  -7.213  -1.874
  214    HE   ARG  31           HE       ARG  31  35.930  -9.899  -3.912
  215    HB2  ARG  31           HB2      ARG  31  38.155  -7.793  -2.562
  216    HB3  ARG  31           HB3      ARG  31  36.772  -8.870  -2.614
  217    HG2  ARG  31           HG2      ARG  31  37.117  -6.568  -4.516
  218    HG3  ARG  31           HG3      ARG  31  37.745  -8.184  -4.833
  219    HD2  ARG  31           HD2      ARG  31  34.865  -7.386  -4.439
  220    HD3  ARG  31           HD3      ARG  31  35.633  -7.936  -5.934
  221   HH11  ARG  31          HH11      ARG  31  33.533  -8.536  -6.071
  222   HH12  ARG  31          HH12      ARG  31  32.535  -9.960  -6.059
  223   HH21  ARG  31          HH21      ARG  31  34.617 -11.772  -3.899
  224   HH22  ARG  31          HH22      ARG  31  33.149 -11.791  -4.830
  225    H    LEU  32           H        LEU  32  38.661  -6.321  -1.359
  226    HA   LEU  32           HA       LEU  32  39.255  -7.576   0.968
  227    HG   LEU  32           HG       LEU  32  42.444  -5.624   0.900
  228    HB2  LEU  32           HB2      LEU  32  40.718  -6.204  -0.586
  229    HB3  LEU  32           HB3      LEU  32  40.165  -4.781   0.269
  230   HD11  LEU  32          HD11      LEU  32  40.274  -5.222   2.906
  231   HD12  LEU  32          HD12      LEU  32  41.584  -4.139   2.432
  232   HD13  LEU  32          HD13      LEU  32  41.927  -5.558   3.421
  233   HD21  LEU  32          HD21      LEU  32  42.254  -7.504   2.681
  234   HD22  LEU  32          HD22      LEU  32  42.386  -7.905   0.968
  235   HD23  LEU  32          HD23      LEU  32  40.814  -7.954   1.769
  236    H    LEU  33           H        LEU  33  38.600  -4.089   0.996
  237    HA   LEU  33           HA       LEU  33  38.297  -3.810   3.707
  238    HG   LEU  33           HG       LEU  33  39.540  -1.757   3.063
  239    HB2  LEU  33           HB2      LEU  33  37.003  -2.209   1.496
  240    HB3  LEU  33           HB3      LEU  33  36.989  -1.731   3.184
  241   HD11  LEU  33          HD11      LEU  33  38.843  -2.153   0.186
  242   HD12  LEU  33          HD12      LEU  33  40.138  -2.874   1.144
  243   HD13  LEU  33          HD13      LEU  33  40.256  -1.193   0.624
  244   HD21  LEU  33          HD21      LEU  33  37.639   0.186   1.936
  245   HD22  LEU  33          HD22      LEU  33  39.332   0.433   1.504
  246   HD23  LEU  33          HD23      LEU  33  38.854   0.377   3.201
  247    H    GLN  34           H        GLN  34  35.714  -4.232   1.322
  248    HA   GLN  34           HA       GLN  34  33.493  -3.962   2.872
  249    HB2  GLN  34           HB2      GLN  34  34.131  -5.005   0.341
  250    HB3  GLN  34           HB3      GLN  34  33.097  -6.193   1.121
  251    HG2  GLN  34           HG2      GLN  34  31.658  -4.792  -0.080
  252    HG3  GLN  34           HG3      GLN  34  31.498  -4.299   1.603
  253   HE21  GLN  34          HE21      GLN  34  34.420  -3.193   0.696
  254   HE22  GLN  34          HE22      GLN  34  33.998  -1.612   0.149
  255    H    THR  35           H        THR  35  35.572  -6.803   2.734
  256    HA   THR  35           HA       THR  35  33.675  -8.293   4.368
  257    HB   THR  35           HB       THR  35  36.272  -9.346   3.259
  258    HG1  THR  35           HG1      THR  35  35.444  -8.712   1.404
  259   HG21  THR  35          HG21      THR  35  33.762 -10.902   3.204
  260   HG22  THR  35          HG22      THR  35  34.505 -10.640   4.783
  261   HG23  THR  35          HG23      THR  35  35.420 -11.426   3.495
  262    H    LYS  36           H        LYS  36  36.209  -6.244   4.987
  263    HA   LYS  36           HA       LYS  36  36.927  -7.711   7.447
  264    HB2  LYS  36           HB2      LYS  36  38.698  -5.850   5.852
  265    HB3  LYS  36           HB3      LYS  36  39.144  -6.693   7.327
  266    HG2  LYS  36           HG2      LYS  36  39.006  -8.821   6.228
  267    HG3  LYS  36           HG3      LYS  36  38.364  -8.068   4.766
  268    HD2  LYS  36           HD2      LYS  36  40.582  -8.323   4.204
  269    HD3  LYS  36           HD3      LYS  36  40.577  -6.682   4.848
  270    HE2  LYS  36           HE2      LYS  36  41.333  -9.160   6.399
  271    HE3  LYS  36           HE3      LYS  36  42.479  -8.050   5.652
  272    HZ1  LYS  36           HZ1      LYS  36  42.457  -7.192   7.726
  273    HZ2  LYS  36           HZ2      LYS  36  40.894  -7.740   8.076
  274    HZ3  LYS  36           HZ3      LYS  36  41.110  -6.336   7.138
  275    H    ASN  37           H        ASN  37  34.757  -5.844   7.319
  276    HA   ASN  37           HA       ASN  37  33.874  -4.162   8.578
  277    HB2  ASN  37           HB2      ASN  37  35.178  -5.104  10.442
  278    HB3  ASN  37           HB3      ASN  37  36.576  -4.151   9.955
  279   HD21  ASN  37          HD21      ASN  37  36.892  -2.424  11.131
  280   HD22  ASN  37          HD22      ASN  37  35.681  -1.479  11.921
  281    H    TYR  38           H        TYR  38  35.383  -3.742   6.085
  282    HA   TYR  38           HA       TYR  38  36.078  -2.087   4.711
  283    HD1  TYR  38           HD1      TYR  38  33.001  -2.367   6.981
  284    HD2  TYR  38           HD2      TYR  38  33.543  -0.551   3.174
  285    HE1  TYR  38           HE1      TYR  38  30.968  -3.475   6.174
  286    HE2  TYR  38           HE2      TYR  38  31.499  -1.649   2.359
  287    HH   TYR  38           HH       TYR  38  29.677  -3.897   4.430
  288    HB2  TYR  38           HB2      TYR  38  34.510  -0.335   6.617
  289    HB3  TYR  38           HB3      TYR  38  34.950   0.071   4.960
  290    H    ASP  39           H        ASP  39  38.174  -2.700   5.781
  291    HA   ASP  39           HA       ASP  39  39.237  -0.532   7.421
  292    HB2  ASP  39           HB2      ASP  39  41.083  -2.127   7.940
  293    HB3  ASP  39           HB3      ASP  39  39.488  -2.673   8.442
  294    H    ILE  40           H        ILE  40  40.835   0.742   6.873
  295    HA   ILE  40           HA       ILE  40  42.062   0.390   4.242
  296    HB   ILE  40           HB       ILE  40  43.145   2.646   4.772
  297   HG12  ILE  40          HG12      ILE  40  42.288   2.428   7.256
  298   HG13  ILE  40          HG13      ILE  40  42.349   3.998   6.466
  299   HG21  ILE  40          HG21      ILE  40  40.695   1.897   3.636
  300   HG22  ILE  40          HG22      ILE  40  41.655   3.337   3.296
  301   HG23  ILE  40          HG23      ILE  40  40.398   3.386   4.532
  302   HD11  ILE  40          HD11      ILE  40  40.032   4.085   6.206
  303   HD12  ILE  40          HD12      ILE  40  40.267   3.403   7.817
  304   HD13  ILE  40          HD13      ILE  40  39.845   2.352   6.465
  305    H    GLY  41           H        GLY  41  42.487  -0.540   7.341
  306    HA2  GLY  41           HA2      GLY  41  45.280  -0.161   7.678
  307    HA3  GLY  41           HA3      GLY  41  44.289  -1.308   8.556
  308    H    ALA  42           H        ALA  42  43.300  -2.629   6.252
  309    HA   ALA  42           HA       ALA  42  45.674  -4.173   5.507
  310    HB1  ALA  42           HB1      ALA  42  43.950  -5.548   6.423
  311    HB2  ALA  42           HB2      ALA  42  44.005  -5.858   4.687
  312    HB3  ALA  42           HB3      ALA  42  42.737  -4.833   5.359
  313    H    ALA  43           H        ALA  43  43.463  -1.907   4.310
  314    HA   ALA  43           HA       ALA  43  43.488  -2.603   1.563
  315    HB1  ALA  43           HB1      ALA  43  41.889  -1.017   2.806
  316    HB2  ALA  43           HB2      ALA  43  42.374  -0.602   1.161
  317    HB3  ALA  43           HB3      ALA  43  43.129   0.209   2.532
  318    H    LEU  44           H        LEU  44  45.414  -0.296   3.469
  319    HA   LEU  44           HA       LEU  44  46.970   0.656   1.310
  320    HG   LEU  44           HG       LEU  44  47.502   2.877   2.201
  321    HB2  LEU  44           HB2      LEU  44  47.225   0.697   4.275
  322    HB3  LEU  44           HB3      LEU  44  48.672   1.011   3.333
  323   HD11  LEU  44          HD11      LEU  44  45.252   1.880   3.842
  324   HD12  LEU  44          HD12      LEU  44  45.255   2.616   2.237
  325   HD13  LEU  44          HD13      LEU  44  45.424   3.627   3.673
  326   HD21  LEU  44          HD21      LEU  44  47.224   3.378   5.121
  327   HD22  LEU  44          HD22      LEU  44  47.949   4.380   3.866
  328   HD23  LEU  44          HD23      LEU  44  48.810   2.964   4.468
  329    H    ASP  45           H        ASP  45  47.248  -2.117   3.411
  330    HA   ASP  45           HA       ASP  45  49.880  -2.879   2.881
  331    HB2  ASP  45           HB2      ASP  45  48.589  -3.885   4.666
  332    HB3  ASP  45           HB3      ASP  45  47.449  -4.561   3.508
  333    H    THR  46           H        THR  46  46.911  -3.526   1.055
  334    HA   THR  46           HA       THR  46  48.420  -5.255  -0.705
  335    HB   THR  46           HB       THR  46  46.077  -5.618  -1.723
  336    HG1  THR  46           HG1      THR  46  44.787  -4.126  -0.913
  337   HG21  THR  46          HG21      THR  46  45.384  -6.894   0.469
  338   HG22  THR  46          HG22      THR  46  47.044  -6.516   0.934
  339   HG23  THR  46          HG23      THR  46  46.728  -7.443  -0.534
  340    H    ILE  47           H        ILE  47  47.764  -1.926  -0.822
  341    HA   ILE  47           HA       ILE  47  47.601  -2.023  -3.758
  342    HB   ILE  47           HB       ILE  47  47.549   0.597  -3.424
  343   HG12  ILE  47          HG12      ILE  47  45.994   0.986  -1.374
  344   HG13  ILE  47          HG13      ILE  47  46.734  -0.483  -0.749
  345   HG21  ILE  47          HG21      ILE  47  45.098  -1.045  -2.872
  346   HG22  ILE  47          HG22      ILE  47  45.823  -0.834  -4.465
  347   HG23  ILE  47          HG23      ILE  47  45.177   0.559  -3.598
  348   HD11  ILE  47          HD11      ILE  47  48.493   0.664  -0.072
  349   HD12  ILE  47          HD12      ILE  47  47.699   2.145  -0.608
  350   HD13  ILE  47          HD13      ILE  47  48.771   1.274  -1.704
  351    H    GLN  48           H        GLN  48  49.798  -1.194  -1.201
  352    HA   GLN  48           HA       GLN  48  51.976  -0.981  -3.081
  353    HB2  GLN  48           HB2      GLN  48  51.031   1.445  -1.551
  354    HB3  GLN  48           HB3      GLN  48  52.706   1.275  -2.049
  355    HG2  GLN  48           HG2      GLN  48  52.178   2.151  -4.009
  356    HG3  GLN  48           HG3      GLN  48  51.139   0.761  -4.328
  357   HE21  GLN  48          HE21      GLN  48  49.147   1.238  -4.817
  358   HE22  GLN  48          HE22      GLN  48  48.262   2.637  -4.303
  359    H    TYR  49           H        TYR  49  50.797  -0.730   0.223
  360    HA   TYR  49           HA       TYR  49  53.412  -1.007   1.378
  361    HD1  TYR  49           HD1      TYR  49  50.752   1.122   0.940
  362    HD2  TYR  49           HD2      TYR  49  52.899   0.633   4.580
  363    HE1  TYR  49           HE1      TYR  49  50.969   3.563   1.133
  364    HE2  TYR  49           HE2      TYR  49  53.123   3.069   4.781
  365    HH   TYR  49           HH       TYR  49  53.063   5.039   3.440
  366    HB2  TYR  49           HB2      TYR  49  50.634  -1.039   2.569
  367    HB3  TYR  49           HB3      TYR  49  52.092  -1.238   3.536
  368    H    SER  50           H        SER  50  52.716  -3.156  -0.405
  369    HA   SER  50           HA       SER  50  52.117  -5.431   1.258
  370    HG   SER  50           HG       SER  50  51.527  -7.257  -0.042
  371    HB2  SER  50           HB2      SER  50  51.443  -5.213  -1.192
  372    HB3  SER  50           HB3      SER  50  53.140  -5.489  -1.586
  373    H    LYS  51           H        LYS  51  54.678  -3.547   0.863
  374    HA   LYS  51           HA       LYS  51  56.591  -5.673   1.568
  375    HB2  LYS  51           HB2      LYS  51  57.182  -3.059   0.153
  376    HB3  LYS  51           HB3      LYS  51  58.371  -4.276   0.605
  377    HG2  LYS  51           HG2      LYS  51  57.548  -5.821  -0.976
  378    HG3  LYS  51           HG3      LYS  51  56.070  -4.891  -1.228
  379    HD2  LYS  51           HD2      LYS  51  57.533  -4.579  -3.115
  380    HD3  LYS  51           HD3      LYS  51  57.429  -3.071  -2.205
  381    HE2  LYS  51           HE2      LYS  51  59.567  -3.580  -1.125
  382    HE3  LYS  51           HE3      LYS  51  59.673  -5.082  -2.045
  383    HZ1  LYS  51           HZ1      LYS  51  60.379  -4.000  -3.848
  384    HZ2  LYS  51           HZ2      LYS  51  60.677  -2.683  -2.816
  385    HZ3  LYS  51           HZ3      LYS  51  59.225  -2.764  -3.691
  386    H    HIS  52           H        HIS  52  54.695  -3.864   3.048
  387    HA   HIS  52           HA       HIS  52  56.474  -2.158   4.586
  388    HD1  HIS  52           HD1      HIS  52  56.027   0.185   5.542
  389    HD2  HIS  52           HD2      HIS  52  52.628  -1.593   7.146
  390    HE1  HIS  52           HE1      HIS  52  55.503   1.446   7.674
  391    HB2  HIS  52           HB2      HIS  52  54.241  -1.347   3.863
  392    HB3  HIS  52           HB3      HIS  52  53.489  -2.602   4.839
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1  20.767   5.535   4.401
    2    H2   GLY   1           2H       GLY   1  19.494   4.422   4.530
    3    H3   GLY   1           3H       GLY   1  19.174   6.028   4.098
    4    HA2  GLY   1           HA2      GLY   1  19.872   3.830   2.446
    5    HA3  GLY   1           HA3      GLY   1  19.259   5.415   1.990
    6    H    SER   2           H        SER   2  22.206   3.693   2.949
    7    HA   SER   2           HA       SER   2  23.859   5.794   1.789
    8    HG   SER   2           HG       SER   2  24.911   4.437   4.966
    9    HB2  SER   2           HB2      SER   2  24.641   3.206   3.157
   10    HB3  SER   2           HB3      SER   2  25.746   4.499   2.695
   11    HA   PRO   3           HA       PRO   3  23.984   3.577  -2.066
   12    HB2  PRO   3           HB2      PRO   3  25.726   5.204  -3.350
   13    HB3  PRO   3           HB3      PRO   3  24.045   5.660  -3.051
   14    HG2  PRO   3           HG2      PRO   3  26.517   6.465  -1.570
   15    HG3  PRO   3           HG3      PRO   3  25.113   7.448  -2.024
   16    HD2  PRO   3           HD2      PRO   3  25.489   6.417   0.478
   17    HD3  PRO   3           HD3      PRO   3  23.890   6.754  -0.213
   18    HA   PRO   4           HA       PRO   4  27.657   1.113  -1.870
   19    HB2  PRO   4           HB2      PRO   4  27.682   0.627  -4.722
   20    HB3  PRO   4           HB3      PRO   4  27.158  -0.453  -3.428
   21    HG2  PRO   4           HG2      PRO   4  25.458   0.661  -5.259
   22    HG3  PRO   4           HG3      PRO   4  24.965   0.169  -3.630
   23    HD2  PRO   4           HD2      PRO   4  25.611   2.899  -4.673
   24    HD3  PRO   4           HD3      PRO   4  24.334   2.393  -3.545
   25    H    GLU   5           H        GLU   5  27.774   4.046  -2.878
   26    HA   GLU   5           HA       GLU   5  30.627   4.072  -3.203
   27    HB2  GLU   5           HB2      GLU   5  29.920   3.844  -5.544
   28    HB3  GLU   5           HB3      GLU   5  28.831   5.210  -5.367
   29    HG2  GLU   5           HG2      GLU   5  31.693   5.680  -4.780
   30    HG3  GLU   5           HG3      GLU   5  31.241   5.417  -6.464
   31    H    ALA   6           H        ALA   6  31.136   5.423  -1.660
   32    HA   ALA   6           HA       ALA   6  31.291   7.355  -0.419
   33    HB1  ALA   6           HB1      ALA   6  30.655   9.192  -1.490
   34    HB2  ALA   6           HB2      ALA   6  29.026   8.899  -0.880
   35    HB3  ALA   6           HB3      ALA   6  29.492   8.300  -2.472
   36    H    ASP   7           H        ASP   7  30.430   5.088   0.459
   37    HA   ASP   7           HA       ASP   7  28.016   5.463   2.069
   38    HB2  ASP   7           HB2      ASP   7  28.378   3.251   1.054
   39    HB3  ASP   7           HB3      ASP   7  29.987   3.165   1.751
   40    HA   PRO   8           HA       PRO   8  30.173   7.272   5.510
   41    HB2  PRO   8           HB2      PRO   8  29.144   4.955   7.106
   42    HB3  PRO   8           HB3      PRO   8  29.131   6.681   7.493
   43    HG2  PRO   8           HG2      PRO   8  26.921   5.481   6.619
   44    HG3  PRO   8           HG3      PRO   8  27.337   7.119   6.080
   45    HD2  PRO   8           HD2      PRO   8  27.496   4.541   4.603
   46    HD3  PRO   8           HD3      PRO   8  27.199   6.182   3.992
   47    H    ARG   9           H        ARG   9  30.558   3.868   4.835
   48    HA   ARG   9           HA       ARG   9  33.032   3.618   6.347
   49    HE   ARG   9           HE       ARG   9  29.965  -0.762   8.186
   50    HB2  ARG   9           HB2      ARG   9  31.705   1.693   4.437
   51    HB3  ARG   9           HB3      ARG   9  32.997   1.316   5.580
   52    HG2  ARG   9           HG2      ARG   9  31.497   1.813   7.444
   53    HG3  ARG   9           HG3      ARG   9  30.201   2.182   6.303
   54    HD2  ARG   9           HD2      ARG   9  30.343  -0.121   5.440
   55    HD3  ARG   9           HD3      ARG   9  31.598  -0.473   6.629
   56   HH11  ARG   9          HH11      ARG   9  28.646   1.160   5.577
   57   HH12  ARG   9          HH12      ARG   9  27.028   1.135   6.208
   58   HH21  ARG   9          HH21      ARG   9  27.876  -0.770   9.045
   59   HH22  ARG   9          HH22      ARG   9  26.581   0.029   8.192
   60    H    LEU  10           H        LEU  10  31.968   3.803   2.985
   61    HA   LEU  10           HA       LEU  10  34.586   3.344   1.935
   62    HG   LEU  10           HG       LEU  10  31.889   1.900   1.458
   63    HB2  LEU  10           HB2      LEU  10  32.030   4.208   0.577
   64    HB3  LEU  10           HB3      LEU  10  33.516   3.786  -0.256
   65   HD11  LEU  10          HD11      LEU  10  30.583   1.781  -0.346
   66   HD12  LEU  10          HD12      LEU  10  31.924   0.920  -1.100
   67   HD13  LEU  10          HD13      LEU  10  31.735   2.655  -1.354
   68   HD21  LEU  10          HD21      LEU  10  33.835   0.789  -0.402
   69   HD22  LEU  10          HD22      LEU  10  33.540   0.407   1.294
   70   HD23  LEU  10          HD23      LEU  10  34.569   1.771   0.864
   71    H    ILE  11           H        ILE  11  32.640   6.074   2.801
   72    HA   ILE  11           HA       ILE  11  34.185   8.025   1.377
   73    HB   ILE  11           HB       ILE  11  31.781   8.154   2.547
   74   HG12  ILE  11          HG12      ILE  11  32.822   9.840   1.032
   75   HG13  ILE  11          HG13      ILE  11  31.841  10.550   2.308
   76   HG21  ILE  11          HG21      ILE  11  33.545   9.433   4.623
   77   HG22  ILE  11          HG22      ILE  11  32.713   7.888   4.817
   78   HG23  ILE  11          HG23      ILE  11  31.782   9.371   4.611
   79   HD11  ILE  11          HD11      ILE  11  33.562  11.688   3.132
   80   HD12  ILE  11          HD12      ILE  11  34.377  11.307   1.616
   81   HD13  ILE  11          HD13      ILE  11  34.644  10.299   3.039
   82    H    GLU  12           H        GLU  12  34.563   6.114   4.156
   83    HA   GLU  12           HA       GLU  12  36.723   7.746   5.250
   84    HB2  GLU  12           HB2      GLU  12  35.479   5.144   6.121
   85    HB3  GLU  12           HB3      GLU  12  36.948   5.771   6.848
   86    HG2  GLU  12           HG2      GLU  12  35.714   7.812   7.489
   87    HG3  GLU  12           HG3      GLU  12  34.241   7.080   6.849
   88    H    SER  13           H        SER  13  36.396   4.332   4.319
   89    HA   SER  13           HA       SER  13  39.244   4.129   4.186
   90    HG   SER  13           HG       SER  13  37.292   1.567   5.840
   91    HB2  SER  13           HB2      SER  13  37.190   1.990   3.632
   92    HB3  SER  13           HB3      SER  13  38.876   1.758   4.099
   93    H    LEU  14           H        LEU  14  36.722   4.295   1.748
   94    HA   LEU  14           HA       LEU  14  38.583   3.345  -0.289
   95    HG   LEU  14           HG       LEU  14  37.550   2.646  -2.398
   96    HB2  LEU  14           HB2      LEU  14  36.141   2.642  -0.203
   97    HB3  LEU  14           HB3      LEU  14  35.733   4.287  -0.652
   98   HD11  LEU  14          HD11      LEU  14  35.049   2.494  -3.549
   99   HD12  LEU  14          HD12      LEU  14  34.741   2.154  -1.846
  100   HD13  LEU  14          HD13      LEU  14  35.908   1.182  -2.743
  101   HD21  LEU  14          HD21      LEU  14  35.864   5.096  -2.681
  102   HD22  LEU  14          HD22      LEU  14  36.189   4.092  -4.095
  103   HD23  LEU  14          HD23      LEU  14  37.527   4.807  -3.194
  104    H    SER  15           H        SER  15  36.732   6.164   0.682
  105    HA   SER  15           HA       SER  15  37.501   7.753  -1.474
  106    HG   SER  15           HG       SER  15  37.018  10.544   0.171
  107    HB2  SER  15           HB2      SER  15  35.544   8.200   0.005
  108    HB3  SER  15           HB3      SER  15  36.667   8.748   1.250
  109    H    GLN  16           H        GLN  16  39.104   7.140   1.599
  110    HA   GLN  16           HA       GLN  16  40.830   9.375   1.490
  111    HB2  GLN  16           HB2      GLN  16  42.144   8.301   3.202
  112    HB3  GLN  16           HB3      GLN  16  40.440   8.080   3.560
  113    HG2  GLN  16           HG2      GLN  16  41.209   6.001   4.031
  114    HG3  GLN  16           HG3      GLN  16  40.833   5.783   2.324
  115   HE21  GLN  16          HE21      GLN  16  42.314   4.386   1.618
  116   HE22  GLN  16          HE22      GLN  16  44.023   4.566   1.798
  117    H    MET  17           H        MET  17  41.006   6.187   0.037
  118    HA   MET  17           HA       MET  17  43.693   6.737  -0.933
  119    HB2  MET  17           HB2      MET  17  43.398   4.482  -2.086
  120    HB3  MET  17           HB3      MET  17  43.482   4.485  -0.333
  121    HG2  MET  17           HG2      MET  17  41.060   4.275  -0.208
  122    HG3  MET  17           HG3      MET  17  40.964   4.298  -1.969
  123    HE1  MET  17           HE1      MET  17  41.778   1.599  -3.452
  124    HE2  MET  17           HE2      MET  17  43.372   1.361  -2.738
  125    HE3  MET  17           HE3      MET  17  42.836   2.983  -3.177
  126    H    LEU  18           H        LEU  18  40.391   6.752  -2.042
  127    HA   LEU  18           HA       LEU  18  40.832   6.826  -4.819
  128    HG   LEU  18           HG       LEU  18  38.718   8.965  -5.560
  129    HB2  LEU  18           HB2      LEU  18  38.622   6.535  -3.768
  130    HB3  LEU  18           HB3      LEU  18  38.683   8.188  -3.187
  131   HD11  LEU  18          HD11      LEU  18  39.585   7.106  -6.729
  132   HD12  LEU  18          HD12      LEU  18  37.906   7.269  -7.242
  133   HD13  LEU  18          HD13      LEU  18  38.355   6.024  -6.074
  134   HD21  LEU  18          HD21      LEU  18  36.411   7.311  -4.568
  135   HD22  LEU  18          HD22      LEU  18  36.322   8.329  -6.005
  136   HD23  LEU  18          HD23      LEU  18  36.644   9.054  -4.432
  137    H    SER  19           H        SER  19  40.804   9.373  -2.372
  138    HA   SER  19           HA       SER  19  41.233  11.424  -4.356
  139    HG   SER  19           HG       SER  19  39.195  11.087  -1.637
  140    HB2  SER  19           HB2      SER  19  41.216  11.687  -1.344
  141    HB3  SER  19           HB3      SER  19  41.017  12.982  -2.526
  142    H    MET  20           H        MET  20  43.150   9.897  -1.768
  143    HA   MET  20           HA       MET  20  45.292  11.734  -2.005
  144    HB2  MET  20           HB2      MET  20  45.080   9.044  -0.683
  145    HB3  MET  20           HB3      MET  20  46.586   9.953  -0.703
  146    HG2  MET  20           HG2      MET  20  43.971  10.854   0.482
  147    HG3  MET  20           HG3      MET  20  45.399  10.320   1.368
  148    HE1  MET  20           HE1      MET  20  47.648  11.243   0.058
  149    HE2  MET  20           HE2      MET  20  47.837  12.293   1.462
  150    HE3  MET  20           HE3      MET  20  47.924  12.970  -0.164
  151    H    GLY  21           H        GLY  21  44.575   8.787  -3.718
  152    HA2  GLY  21           HA2      GLY  21  45.652   8.622  -5.913
  153    HA3  GLY  21           HA3      GLY  21  47.138   9.165  -5.143
  154    H    PHE  22           H        PHE  22  44.791   6.667  -4.208
  155    HA   PHE  22           HA       PHE  22  46.886   4.660  -4.646
  156    HD1  PHE  22           HD1      PHE  22  48.457   3.961  -3.177
  157    HD2  PHE  22           HD2      PHE  22  45.721   5.822  -0.499
  158    HE1  PHE  22           HE1      PHE  22  50.330   4.644  -1.742
  159    HE2  PHE  22           HE2      PHE  22  47.594   6.512   0.939
  160    HZ   PHE  22           HZ       PHE  22  49.903   5.915   0.319
  161    HB2  PHE  22           HB2      PHE  22  44.904   4.788  -2.363
  162    HB3  PHE  22           HB3      PHE  22  45.786   3.325  -2.792
  163    H    SER  23           H        SER  23  45.911   2.503  -5.192
  164    HA   SER  23           HA       SER  23  43.137   2.658  -6.032
  165    HG   SER  23           HG       SER  23  43.849   4.274  -8.207
  166    HB2  SER  23           HB2      SER  23  45.247   1.835  -8.040
  167    HB3  SER  23           HB3      SER  23  43.533   2.125  -8.328
  168    H    ASP  24           H        ASP  24  42.652   0.421  -7.219
  169    HA   ASP  24           HA       ASP  24  43.639  -1.654  -5.436
  170    HB2  ASP  24           HB2      ASP  24  42.004  -3.116  -6.723
  171    HB3  ASP  24           HB3      ASP  24  41.301  -1.817  -5.762
  172    H    GLU  25           H        GLU  25  45.126  -3.076  -5.950
  173    HA   GLU  25           HA       GLU  25  46.695  -2.679  -8.259
  174    HB2  GLU  25           HB2      GLU  25  47.670  -3.417  -6.151
  175    HB3  GLU  25           HB3      GLU  25  46.745  -4.909  -6.220
  176    HG2  GLU  25           HG2      GLU  25  48.988  -5.375  -6.846
  177    HG3  GLU  25           HG3      GLU  25  47.972  -5.517  -8.278
  178    H    GLY  26           H        GLY  26  44.045  -4.772  -7.583
  179    HA2  GLY  26           HA2      GLY  26  44.228  -5.817 -10.316
  180    HA3  GLY  26           HA3      GLY  26  44.161  -6.981  -8.998
  181    H    GLY  27           H        GLY  27  42.348  -4.123  -8.453
  182    HA2  GLY  27           HA2      GLY  27  40.091  -3.639  -8.903
  183    HA3  GLY  27           HA3      GLY  27  39.926  -5.219  -9.658
  184    H    TRP  28           H        TRP  28  41.462  -5.002  -6.595
  185    HA   TRP  28           HA       TRP  28  39.283  -6.551  -5.443
  186    HD1  TRP  28           HD1      TRP  28  43.646  -6.734  -6.215
  187    HE1  TRP  28           HE1      TRP  28  45.416  -4.990  -5.545
  188    HE3  TRP  28           HE3      TRP  28  41.209  -4.547  -2.298
  189    HZ2  TRP  28           HZ2      TRP  28  45.733  -2.956  -3.616
  190    HZ3  TRP  28           HZ3      TRP  28  42.306  -2.716  -1.091
  191    HH2  TRP  28           HH2      TRP  28  44.519  -1.945  -1.738
  192    HB2  TRP  28           HB2      TRP  28  40.985  -6.914  -3.585
  193    HB3  TRP  28           HB3      TRP  28  41.418  -7.565  -5.168
  194    H    LEU  29           H        LEU  29  40.141  -3.321  -5.488
  195    HA   LEU  29           HA       LEU  29  40.292  -2.522  -2.907
  196    HG   LEU  29           HG       LEU  29  37.798  -0.206  -3.801
  197    HB2  LEU  29           HB2      LEU  29  40.720  -0.791  -4.265
  198    HB3  LEU  29           HB3      LEU  29  39.456  -1.201  -5.399
  199   HD11  LEU  29          HD11      LEU  29  38.885  -0.311  -1.717
  200   HD12  LEU  29          HD12      LEU  29  38.808   1.401  -2.134
  201   HD13  LEU  29          HD13      LEU  29  40.319   0.512  -2.333
  202   HD21  LEU  29          HD21      LEU  29  38.292   2.059  -4.415
  203   HD22  LEU  29          HD22      LEU  29  38.754   0.995  -5.744
  204   HD23  LEU  29          HD23      LEU  29  39.990   1.663  -4.676
  205    H    THR  30           H        THR  30  37.231  -3.205  -4.579
  206    HA   THR  30           HA       THR  30  35.737  -2.509  -2.193
  207    HB   THR  30           HB       THR  30  33.791  -3.445  -3.432
  208    HG1  THR  30           HG1      THR  30  34.129  -4.688  -5.066
  209   HG21  THR  30          HG21      THR  30  35.127  -1.092  -4.004
  210   HG22  THR  30          HG22      THR  30  33.479  -1.514  -4.464
  211   HG23  THR  30          HG23      THR  30  34.809  -1.813  -5.581
  212    H    ARG  31           H        ARG  31  36.701  -5.416  -3.935
  213    HA   ARG  31           HA       ARG  31  35.518  -7.396  -2.420
  214    HE   ARG  31           HE       ARG  31  34.499  -6.574  -6.804
  215    HB2  ARG  31           HB2      ARG  31  38.188  -7.387  -3.835
  216    HB3  ARG  31           HB3      ARG  31  37.445  -8.834  -3.176
  217    HG2  ARG  31           HG2      ARG  31  37.063  -8.738  -5.529
  218    HG3  ARG  31           HG3      ARG  31  35.527  -8.512  -4.696
  219    HD2  ARG  31           HD2      ARG  31  35.820  -6.044  -5.037
  220    HD3  ARG  31           HD3      ARG  31  37.234  -6.403  -6.026
  221   HH11  ARG  31          HH11      ARG  31  37.654  -7.969  -7.352
  222   HH12  ARG  31          HH12      ARG  31  37.269  -8.564  -8.935
  223   HH21  ARG  31          HH21      ARG  31  33.976  -7.338  -8.886
  224   HH22  ARG  31          HH22      ARG  31  35.169  -8.205  -9.807
  225    H    LEU  32           H        LEU  32  38.922  -6.499  -2.141
  226    HA   LEU  32           HA       LEU  32  39.617  -7.921   0.090
  227    HG   LEU  32           HG       LEU  32  42.905  -6.118  -0.090
  228    HB2  LEU  32           HB2      LEU  32  41.120  -6.710  -1.477
  229    HB3  LEU  32           HB3      LEU  32  40.641  -5.197  -0.735
  230   HD11  LEU  32          HD11      LEU  32  41.073  -4.680   1.371
  231   HD12  LEU  32          HD12      LEU  32  42.789  -4.865   1.732
  232   HD13  LEU  32          HD13      LEU  32  41.608  -5.932   2.491
  233   HD21  LEU  32          HD21      LEU  32  41.291  -8.010   1.593
  234   HD22  LEU  32          HD22      LEU  32  43.047  -7.861   1.521
  235   HD23  LEU  32          HD23      LEU  32  42.156  -8.467   0.124
  236    H    LEU  33           H        LEU  33  38.836  -4.445   0.104
  237    HA   LEU  33           HA       LEU  33  38.998  -4.032   2.796
  238    HG   LEU  33           HG       LEU  33  39.544  -1.684   2.570
  239    HB2  LEU  33           HB2      LEU  33  37.447  -2.689   0.635
  240    HB3  LEU  33           HB3      LEU  33  37.129  -2.237   2.303
  241   HD11  LEU  33          HD11      LEU  33  39.599  -2.484  -0.308
  242   HD12  LEU  33          HD12      LEU  33  40.720  -2.892   0.992
  243   HD13  LEU  33          HD13      LEU  33  40.715  -1.265   0.309
  244   HD21  LEU  33          HD21      LEU  33  37.981  -0.262   0.428
  245   HD22  LEU  33          HD22      LEU  33  39.462   0.367   1.152
  246   HD23  LEU  33          HD23      LEU  33  38.034   0.105   2.154
  247    H    GLN  34           H        GLN  34  36.037  -4.966   1.019
  248    HA   GLN  34           HA       GLN  34  34.370  -4.728   3.250
  249    HB2  GLN  34           HB2      GLN  34  33.955  -6.479   0.833
  250    HB3  GLN  34           HB3      GLN  34  32.708  -5.995   1.979
  251    HG2  GLN  34           HG2      GLN  34  33.500  -3.586   1.347
  252    HG3  GLN  34           HG3      GLN  34  34.116  -4.391  -0.092
  253   HE21  GLN  34          HE21      GLN  34  31.627  -2.742   1.106
  254   HE22  GLN  34          HE22      GLN  34  30.344  -3.321   0.093
  255    H    THR  35           H        THR  35  36.455  -7.373   2.351
  256    HA   THR  35           HA       THR  35  35.074  -9.292   3.964
  257    HB   THR  35           HB       THR  35  37.038 -10.728   3.628
  258    HG1  THR  35           HG1      THR  35  38.156  -8.353   2.566
  259   HG21  THR  35          HG21      THR  35  36.864 -11.074   1.328
  260   HG22  THR  35          HG22      THR  35  36.489  -9.381   1.012
  261   HG23  THR  35          HG23      THR  35  35.303 -10.412   1.812
  262    H    LYS  36           H        LYS  36  37.188  -6.715   4.681
  263    HA   LYS  36           HA       LYS  36  37.534  -7.800   7.400
  264    HB2  LYS  36           HB2      LYS  36  39.413  -5.897   5.987
  265    HB3  LYS  36           HB3      LYS  36  39.591  -6.493   7.630
  266    HG2  LYS  36           HG2      LYS  36  40.928  -8.027   6.720
  267    HG3  LYS  36           HG3      LYS  36  39.433  -8.818   6.214
  268    HD2  LYS  36           HD2      LYS  36  39.529  -7.662   4.070
  269    HD3  LYS  36           HD3      LYS  36  40.991  -6.814   4.581
  270    HE2  LYS  36           HE2      LYS  36  41.600  -8.665   3.162
  271    HE3  LYS  36           HE3      LYS  36  42.129  -8.997   4.812
  272    HZ1  LYS  36           HZ1      LYS  36  40.978 -10.852   3.515
  273    HZ2  LYS  36           HZ2      LYS  36  39.538 -10.000   3.811
  274    HZ3  LYS  36           HZ3      LYS  36  40.468 -10.571   5.115
  275    H    ASN  37           H        ASN  37  35.271  -6.330   6.520
  276    HA   ASN  37           HA       ASN  37  33.897  -4.692   7.279
  277    HB2  ASN  37           HB2      ASN  37  34.617  -5.361   9.495
  278    HB3  ASN  37           HB3      ASN  37  36.074  -4.377   9.363
  279   HD21  ASN  37          HD21      ASN  37  36.004  -2.520  10.345
  280   HD22  ASN  37          HD22      ASN  37  34.600  -1.580  10.685
  281    H    TYR  38           H        TYR  38  35.139  -3.944   5.079
  282    HA   TYR  38           HA       TYR  38  35.924  -2.195   3.803
  283    HD1  TYR  38           HD1      TYR  38  33.042  -3.024   5.771
  284    HD2  TYR  38           HD2      TYR  38  33.043  -0.023   2.760
  285    HE1  TYR  38           HE1      TYR  38  30.859  -3.829   4.977
  286    HE2  TYR  38           HE2      TYR  38  30.866  -0.821   1.955
  287    HH   TYR  38           HH       TYR  38  28.899  -2.065   2.917
  288    HB2  TYR  38           HB2      TYR  38  34.366  -0.599   5.849
  289    HB3  TYR  38           HB3      TYR  38  34.787  -0.071   4.231
  290    H    ASP  39           H        ASP  39  38.098  -2.804   5.169
  291    HA   ASP  39           HA       ASP  39  38.809  -0.388   6.668
  292    HB2  ASP  39           HB2      ASP  39  40.356  -1.626   7.974
  293    HB3  ASP  39           HB3      ASP  39  38.836  -2.514   7.947
  294    H    ILE  40           H        ILE  40  40.801   0.516   6.644
  295    HA   ILE  40           HA       ILE  40  42.216   0.257   4.092
  296    HB   ILE  40           HB       ILE  40  43.583   2.228   5.014
  297   HG12  ILE  40          HG12      ILE  40  42.342   1.841   7.346
  298   HG13  ILE  40          HG13      ILE  40  42.878   3.434   6.827
  299   HG21  ILE  40          HG21      ILE  40  42.412   3.264   3.460
  300   HG22  ILE  40          HG22      ILE  40  41.090   3.502   4.602
  301   HG23  ILE  40          HG23      ILE  40  41.138   2.052   3.601
  302   HD11  ILE  40          HD11      ILE  40  40.149   2.638   6.034
  303   HD12  ILE  40          HD12      ILE  40  40.774   4.202   6.558
  304   HD13  ILE  40          HD13      ILE  40  40.426   2.946   7.749
  305    H    GLY  41           H        GLY  41  42.241  -1.110   7.052
  306    HA2  GLY  41           HA2      GLY  41  44.983  -1.084   7.725
  307    HA3  GLY  41           HA3      GLY  41  43.800  -2.237   8.313
  308    H    ALA  42           H        ALA  42  43.018  -3.170   5.770
  309    HA   ALA  42           HA       ALA  42  45.370  -4.770   5.074
  310    HB1  ALA  42           HB1      ALA  42  42.504  -5.311   5.144
  311    HB2  ALA  42           HB2      ALA  42  43.870  -6.426   5.219
  312    HB3  ALA  42           HB3      ALA  42  43.285  -5.853   3.658
  313    H    ALA  43           H        ALA  43  43.336  -2.275   3.944
  314    HA   ALA  43           HA       ALA  43  43.695  -2.564   1.155
  315    HB1  ALA  43           HB1      ALA  43  43.423   0.108   2.486
  316    HB2  ALA  43           HB2      ALA  43  42.071  -1.025   2.419
  317    HB3  ALA  43           HB3      ALA  43  42.798  -0.429   0.926
  318    H    LEU  44           H        LEU  44  45.508  -0.687   3.572
  319    HA   LEU  44           HA       LEU  44  47.348   0.470   1.790
  320    HG   LEU  44           HG       LEU  44  48.902   2.061   2.993
  321    HB2  LEU  44           HB2      LEU  44  46.911   0.437   4.587
  322    HB3  LEU  44           HB3      LEU  44  48.590  -0.004   4.323
  323   HD11  LEU  44          HD11      LEU  44  46.341   2.121   2.511
  324   HD12  LEU  44          HD12      LEU  44  47.263   3.619   2.640
  325   HD13  LEU  44          HD13      LEU  44  46.287   3.063   4.001
  326   HD21  LEU  44          HD21      LEU  44  47.978   3.448   5.256
  327   HD22  LEU  44          HD22      LEU  44  49.611   2.863   4.934
  328   HD23  LEU  44          HD23      LEU  44  48.468   1.848   5.813
  329    H    ASP  45           H        ASP  45  47.188  -2.683   3.199
  330    HA   ASP  45           HA       ASP  45  49.904  -3.412   2.919
  331    HB2  ASP  45           HB2      ASP  45  48.368  -4.629   4.381
  332    HB3  ASP  45           HB3      ASP  45  47.402  -5.120   2.993
  333    H    THR  46           H        THR  46  47.079  -3.883   0.826
  334    HA   THR  46           HA       THR  46  48.759  -5.215  -1.111
  335    HB   THR  46           HB       THR  46  46.534  -5.662  -2.230
  336    HG1  THR  46           HG1      THR  46  45.201  -4.129  -1.448
  337   HG21  THR  46          HG21      THR  46  47.296  -6.610   0.475
  338   HG22  THR  46          HG22      THR  46  47.141  -7.501  -1.040
  339   HG23  THR  46          HG23      THR  46  45.698  -7.031  -0.141
  340    H    ILE  47           H        ILE  47  47.329  -2.023  -0.847
  341    HA   ILE  47           HA       ILE  47  46.804  -1.582  -3.559
  342    HB   ILE  47           HB       ILE  47  47.192   0.895  -3.010
  343   HG12  ILE  47          HG12      ILE  47  47.527  -0.308  -0.257
  344   HG13  ILE  47          HG13      ILE  47  48.709   0.647  -1.147
  345   HG21  ILE  47          HG21      ILE  47  45.204  -0.342  -1.155
  346   HG22  ILE  47          HG22      ILE  47  44.995  -0.457  -2.908
  347   HG23  ILE  47          HG23      ILE  47  45.071   1.122  -2.126
  348   HD11  ILE  47          HD11      ILE  47  47.656   1.959   0.590
  349   HD12  ILE  47          HD12      ILE  47  46.068   1.627  -0.104
  350   HD13  ILE  47          HD13      ILE  47  47.241   2.589  -1.003
  351    H    GLN  48           H        GLN  48  49.833  -1.343  -1.836
  352    HA   GLN  48           HA       GLN  48  51.358  -1.393  -4.245
  353    HB2  GLN  48           HB2      GLN  48  51.089   1.205  -2.768
  354    HB3  GLN  48           HB3      GLN  48  52.654   0.783  -3.442
  355    HG2  GLN  48           HG2      GLN  48  52.011   1.561  -5.402
  356    HG3  GLN  48           HG3      GLN  48  50.723   0.358  -5.459
  357   HE21  GLN  48          HE21      GLN  48  48.784   1.148  -5.717
  358   HE22  GLN  48          HE22      GLN  48  48.232   2.710  -5.221
  359    H    TYR  49           H        TYR  49  51.267  -0.650  -0.820
  360    HA   TYR  49           HA       TYR  49  53.996  -1.268  -0.329
  361    HD1  TYR  49           HD1      TYR  49  54.595   0.979   0.417
  362    HD2  TYR  49           HD2      TYR  49  50.512   0.875   1.616
  363    HE1  TYR  49           HE1      TYR  49  54.427   3.404   0.042
  364    HE2  TYR  49           HE2      TYR  49  50.333   3.297   1.241
  365    HH   TYR  49           HH       TYR  49  51.998   5.290   1.226
  366    HB2  TYR  49           HB2      TYR  49  51.712  -1.076   1.655
  367    HB3  TYR  49           HB3      TYR  49  53.432  -0.909   2.010
  368    H    SER  50           H        SER  50  53.726  -2.730   2.092
  369    HA   SER  50           HA       SER  50  52.413  -5.221   1.576
  370    HG   SER  50           HG       SER  50  54.323  -7.132   2.407
  371    HB2  SER  50           HB2      SER  50  54.478  -5.397   0.155
  372    HB3  SER  50           HB3      SER  50  55.444  -5.233   1.621
  373    H    LYS  51           H        LYS  51  52.816  -3.019   3.593
  374    HA   LYS  51           HA       LYS  51  52.951  -4.730   5.917
  375    HB2  LYS  51           HB2      LYS  51  55.302  -4.138   5.651
  376    HB3  LYS  51           HB3      LYS  51  54.886  -2.436   5.493
  377    HG2  LYS  51           HG2      LYS  51  54.071  -2.437   7.812
  378    HG3  LYS  51           HG3      LYS  51  54.553  -4.129   7.963
  379    HD2  LYS  51           HD2      LYS  51  56.856  -3.577   7.669
  380    HD3  LYS  51           HD3      LYS  51  56.461  -1.917   7.221
  381    HE2  LYS  51           HE2      LYS  51  55.938  -3.161   9.923
  382    HE3  LYS  51           HE3      LYS  51  57.303  -2.113   9.532
  383    HZ1  LYS  51           HZ1      LYS  51  54.672  -1.389  10.272
  384    HZ2  LYS  51           HZ2      LYS  51  55.007  -0.767   8.723
  385    HZ3  LYS  51           HZ3      LYS  51  56.027  -0.393  10.027
  386    H    HIS  52           H        HIS  52  51.999  -3.743   7.761
  387    HA   HIS  52           HA       HIS  52  50.637  -1.205   7.178
  388    HD1  HIS  52           HD1      HIS  52  48.317  -0.416   6.965
  389    HD2  HIS  52           HD2      HIS  52  47.805  -2.258  10.655
  390    HE1  HIS  52           HE1      HIS  52  46.548   0.919   8.179
  391    HB2  HIS  52           HB2      HIS  52  49.100  -3.198   7.364
  392    HB3  HIS  52           HB3      HIS  52  49.618  -3.361   9.041
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1  21.118   2.551   3.670
    2    H2   GLY   1           2H       GLY   1  21.250   0.922   4.123
    3    H3   GLY   1           3H       GLY   1  19.751   1.551   3.644
    4    HA2  GLY   1           HA2      GLY   1  20.595   0.282   1.839
    5    HA3  GLY   1           HA3      GLY   1  20.686   1.986   1.414
    6    H    SER   2           H        SER   2  22.284   1.172  -0.149
    7    HA   SER   2           HA       SER   2  24.828   0.308   0.945
    8    HG   SER   2           HG       SER   2  23.287  -1.109  -1.981
    9    HB2  SER   2           HB2      SER   2  24.033   0.871  -1.923
   10    HB3  SER   2           HB3      SER   2  25.510   0.066  -1.393
   11    HA   PRO   3           HA       PRO   3  26.474   4.390   1.474
   12    HB2  PRO   3           HB2      PRO   3  29.134   3.608   1.161
   13    HB3  PRO   3           HB3      PRO   3  28.229   3.605   2.677
   14    HG2  PRO   3           HG2      PRO   3  28.797   1.351   0.800
   15    HG3  PRO   3           HG3      PRO   3  28.738   1.353   2.573
   16    HD2  PRO   3           HD2      PRO   3  26.726   0.355   1.130
   17    HD3  PRO   3           HD3      PRO   3  26.424   1.270   2.622
   18    HA   PRO   4           HA       PRO   4  26.960   5.447  -2.850
   19    HB2  PRO   4           HB2      PRO   4  26.916   8.128  -2.560
   20    HB3  PRO   4           HB3      PRO   4  25.460   7.135  -2.420
   21    HG2  PRO   4           HG2      PRO   4  27.183   8.284  -0.257
   22    HG3  PRO   4           HG3      PRO   4  25.414   8.217  -0.360
   23    HD2  PRO   4           HD2      PRO   4  26.885   6.465   1.118
   24    HD3  PRO   4           HD3      PRO   4  25.330   6.040   0.376
   25    H    GLU   5           H        GLU   5  29.322   5.009  -0.987
   26    HA   GLU   5           HA       GLU   5  31.582   5.092  -1.177
   27    HB2  GLU   5           HB2      GLU   5  31.327   6.906  -3.573
   28    HB3  GLU   5           HB3      GLU   5  32.665   5.846  -3.156
   29    HG2  GLU   5           HG2      GLU   5  29.923   4.847  -3.874
   30    HG3  GLU   5           HG3      GLU   5  31.215   5.078  -5.047
   31    H    ALA   6           H        ALA   6  29.638   7.417  -0.375
   32    HA   ALA   6           HA       ALA   6  31.798   9.099   0.662
   33    HB1  ALA   6           HB1      ALA   6  30.768  11.121   0.120
   34    HB2  ALA   6           HB2      ALA   6  29.215  10.352  -0.209
   35    HB3  ALA   6           HB3      ALA   6  30.555  10.153  -1.337
   36    H    ASP   7           H        ASP   7  30.012   6.900   1.543
   37    HA   ASP   7           HA       ASP   7  28.554   8.162   3.748
   38    HB2  ASP   7           HB2      ASP   7  28.260   5.694   2.282
   39    HB3  ASP   7           HB3      ASP   7  28.481   5.346   3.993
   40    HA   PRO   8           HA       PRO   8  31.668   7.900   6.751
   41    HB2  PRO   8           HB2      PRO   8  29.868   5.983   8.199
   42    HB3  PRO   8           HB3      PRO   8  30.773   7.367   8.832
   43    HG2  PRO   8           HG2      PRO   8  28.191   7.624   8.321
   44    HG3  PRO   8           HG3      PRO   8  29.310   8.923   7.867
   45    HD2  PRO   8           HD2      PRO   8  27.946   6.912   6.146
   46    HD3  PRO   8           HD3      PRO   8  28.407   8.580   5.765
   47    H    ARG   9           H        ARG   9  30.491   4.838   5.505
   48    HA   ARG   9           HA       ARG   9  32.775   3.375   6.539
   49    HE   ARG   9           HE       ARG   9  31.392  -0.321   6.832
   50    HB2  ARG   9           HB2      ARG   9  30.609   2.526   4.611
   51    HB3  ARG   9           HB3      ARG   9  31.865   1.468   5.247
   52    HG2  ARG   9           HG2      ARG   9  31.005   1.923   7.536
   53    HG3  ARG   9           HG3      ARG   9  29.679   2.831   6.808
   54    HD2  ARG   9           HD2      ARG   9  28.855   0.649   7.244
   55    HD3  ARG   9           HD3      ARG   9  29.111   0.758   5.503
   56   HH11  ARG   9          HH11      ARG   9  28.205  -1.109   5.631
   57   HH12  ARG   9          HH12      ARG   9  28.529  -2.815   5.506
   58   HH21  ARG   9          HH21      ARG   9  31.827  -2.558   6.667
   59   HH22  ARG   9          HH22      ARG   9  30.599  -3.640   6.085
   60    H    LEU  10           H        LEU  10  31.692   4.608   3.372
   61    HA   LEU  10           HA       LEU  10  34.156   3.631   2.188
   62    HG   LEU  10           HG       LEU  10  31.629   2.243   1.679
   63    HB2  LEU  10           HB2      LEU  10  31.582   4.623   1.003
   64    HB3  LEU  10           HB3      LEU  10  33.017   4.359   0.029
   65   HD11  LEU  10          HD11      LEU  10  31.014   1.296  -0.509
   66   HD12  LEU  10          HD12      LEU  10  31.656   2.742  -1.290
   67   HD13  LEU  10          HD13      LEU  10  30.265   2.865  -0.210
   68   HD21  LEU  10          HD21      LEU  10  34.074   1.947   1.424
   69   HD22  LEU  10          HD22      LEU  10  33.861   1.980  -0.327
   70   HD23  LEU  10          HD23      LEU  10  33.130   0.688   0.627
   71    H    ILE  11           H        ILE  11  32.783   6.582   3.282
   72    HA   ILE  11           HA       ILE  11  34.344   8.319   1.623
   73    HB   ILE  11           HB       ILE  11  32.236   8.882   3.053
   74   HG12  ILE  11          HG12      ILE  11  33.750  10.478   1.714
   75   HG13  ILE  11          HG13      ILE  11  32.708  11.173   2.949
   76   HG21  ILE  11          HG21      ILE  11  34.331   8.720   5.121
   77   HG22  ILE  11          HG22      ILE  11  32.591   8.461   5.235
   78   HG23  ILE  11          HG23      ILE  11  33.238  10.102   5.222
   79   HD11  ILE  11          HD11      ILE  11  35.047  10.661   4.308
   80   HD12  ILE  11          HD12      ILE  11  34.527  12.222   3.671
   81   HD13  ILE  11          HD13      ILE  11  35.597  11.193   2.720
   82    H    GLU  12           H        GLU  12  34.885   6.352   4.354
   83    HA   GLU  12           HA       GLU  12  37.449   7.621   4.965
   84    HB2  GLU  12           HB2      GLU  12  36.049   5.296   6.292
   85    HB3  GLU  12           HB3      GLU  12  37.567   6.004   6.826
   86    HG2  GLU  12           HG2      GLU  12  34.932   7.452   6.693
   87    HG3  GLU  12           HG3      GLU  12  35.643   6.753   8.147
   88    H    SER  13           H        SER  13  36.128   4.617   3.665
   89    HA   SER  13           HA       SER  13  38.789   3.486   3.507
   90    HG   SER  13           HG       SER  13  35.740   2.358   4.737
   91    HB2  SER  13           HB2      SER  13  36.189   2.201   2.678
   92    HB3  SER  13           HB3      SER  13  37.710   1.400   3.071
   93    H    LEU  14           H        LEU  14  36.235   4.439   1.236
   94    HA   LEU  14           HA       LEU  14  37.892   3.629  -1.013
   95    HG   LEU  14           HG       LEU  14  34.860   3.414  -3.135
   96    HB2  LEU  14           HB2      LEU  14  35.464   3.045  -0.925
   97    HB3  LEU  14           HB3      LEU  14  35.081   4.751  -0.955
   98   HD11  LEU  14          HD11      LEU  14  34.600   5.682  -3.428
   99   HD12  LEU  14          HD12      LEU  14  36.007   5.353  -4.442
  100   HD13  LEU  14          HD13      LEU  14  36.220   6.053  -2.838
  101   HD21  LEU  14          HD21      LEU  14  37.852   3.734  -3.031
  102   HD22  LEU  14          HD22      LEU  14  36.932   3.282  -4.467
  103   HD23  LEU  14          HD23      LEU  14  36.949   2.219  -3.058
  104    H    SER  15           H        SER  15  36.201   6.451   0.284
  105    HA   SER  15           HA       SER  15  37.104   8.202  -1.676
  106    HG   SER  15           HG       SER  15  35.853  10.495  -1.151
  107    HB2  SER  15           HB2      SER  15  35.180   8.666  -0.191
  108    HB3  SER  15           HB3      SER  15  36.305   8.920   1.144
  109    H    GLN  16           H        GLN  16  38.646   7.026   1.185
  110    HA   GLN  16           HA       GLN  16  40.694   8.977   1.436
  111    HB2  GLN  16           HB2      GLN  16  40.151   7.242   3.164
  112    HB3  GLN  16           HB3      GLN  16  40.839   6.023   2.104
  113    HG2  GLN  16           HG2      GLN  16  42.518   8.351   2.835
  114    HG3  GLN  16           HG3      GLN  16  42.212   7.130   4.064
  115   HE21  GLN  16          HE21      GLN  16  42.044   5.269   1.525
  116   HE22  GLN  16          HE22      GLN  16  43.703   4.860   1.267
  117    H    MET  17           H        MET  17  40.455   5.916  -0.311
  118    HA   MET  17           HA       MET  17  43.044   6.077  -1.477
  119    HB2  MET  17           HB2      MET  17  40.619   4.453  -2.277
  120    HB3  MET  17           HB3      MET  17  42.238   4.228  -2.921
  121    HG2  MET  17           HG2      MET  17  43.064   3.539  -0.786
  122    HG3  MET  17           HG3      MET  17  41.538   3.956  -0.009
  123    HE1  MET  17           HE1      MET  17  42.907   0.772  -2.643
  124    HE2  MET  17           HE2      MET  17  42.645   2.436  -3.163
  125    HE3  MET  17           HE3      MET  17  41.422   1.207  -3.486
  126    H    LEU  18           H        LEU  18  39.772   6.819  -2.587
  127    HA   LEU  18           HA       LEU  18  40.395   7.392  -5.252
  128    HG   LEU  18           HG       LEU  18  38.334   9.520  -5.910
  129    HB2  LEU  18           HB2      LEU  18  38.127   7.000  -4.265
  130    HB3  LEU  18           HB3      LEU  18  38.187   8.623  -3.610
  131   HD11  LEU  18          HD11      LEU  18  38.261   6.613  -6.571
  132   HD12  LEU  18          HD12      LEU  18  39.253   7.900  -7.259
  133   HD13  LEU  18          HD13      LEU  18  37.542   7.784  -7.679
  134   HD21  LEU  18          HD21      LEU  18  36.133   8.616  -4.547
  135   HD22  LEU  18          HD22      LEU  18  35.930   7.895  -6.142
  136   HD23  LEU  18          HD23      LEU  18  36.107   9.641  -5.982
  137    H    SER  19           H        SER  19  40.586   9.420  -2.387
  138    HA   SER  19           HA       SER  19  41.047  11.773  -4.037
  139    HG   SER  19           HG       SER  19  41.313  13.719  -1.343
  140    HB2  SER  19           HB2      SER  19  39.516  11.771  -2.005
  141    HB3  SER  19           HB3      SER  19  40.975  11.669  -1.019
  142    H    MET  20           H        MET  20  42.936   9.388  -2.556
  143    HA   MET  20           HA       MET  20  45.188  11.235  -2.187
  144    HB2  MET  20           HB2      MET  20  44.556   9.623  -0.354
  145    HB3  MET  20           HB3      MET  20  45.067   8.315  -1.412
  146    HG2  MET  20           HG2      MET  20  46.805   8.875   0.179
  147    HG3  MET  20           HG3      MET  20  47.322   9.227  -1.471
  148    HE1  MET  20           HE1      MET  20  49.125  12.034   0.564
  149    HE2  MET  20           HE2      MET  20  49.317  10.725  -0.603
  150    HE3  MET  20           HE3      MET  20  48.856  10.364   1.061
  151    H    GLY  21           H        GLY  21  44.143   8.490  -4.110
  152    HA2  GLY  21           HA2      GLY  21  45.091   8.363  -6.383
  153    HA3  GLY  21           HA3      GLY  21  46.653   8.727  -5.652
  154    H    PHE  22           H        PHE  22  44.099   6.501  -4.630
  155    HA   PHE  22           HA       PHE  22  45.912   4.255  -5.126
  156    HD1  PHE  22           HD1      PHE  22  47.605   3.609  -3.725
  157    HD2  PHE  22           HD2      PHE  22  45.251   5.911  -1.029
  158    HE1  PHE  22           HE1      PHE  22  49.647   4.344  -2.571
  159    HE2  PHE  22           HE2      PHE  22  47.292   6.654   0.125
  160    HZ   PHE  22           HZ       PHE  22  49.495   5.864  -0.647
  161    HB2  PHE  22           HB2      PHE  22  44.204   4.703  -2.665
  162    HB3  PHE  22           HB3      PHE  22  44.991   3.177  -3.062
  163    H    SER  23           H        SER  23  44.856   2.377  -5.782
  164    HA   SER  23           HA       SER  23  41.965   2.489  -5.982
  165    HG   SER  23           HG       SER  23  42.592   4.313  -7.413
  166    HB2  SER  23           HB2      SER  23  43.666   1.965  -8.437
  167    HB3  SER  23           HB3      SER  23  41.908   2.048  -8.368
  168    H    ASP  24           H        ASP  24  41.674   0.264  -7.677
  169    HA   ASP  24           HA       ASP  24  42.559  -1.891  -5.969
  170    HB2  ASP  24           HB2      ASP  24  41.417  -3.344  -7.670
  171    HB3  ASP  24           HB3      ASP  24  40.364  -2.129  -6.947
  172    H    GLU  25           H        GLU  25  44.556  -2.708  -6.123
  173    HA   GLU  25           HA       GLU  25  45.908  -2.485  -8.731
  174    HB2  GLU  25           HB2      GLU  25  47.014  -1.588  -6.582
  175    HB3  GLU  25           HB3      GLU  25  47.256  -3.275  -6.148
  176    HG2  GLU  25           HG2      GLU  25  48.644  -3.652  -8.035
  177    HG3  GLU  25           HG3      GLU  25  48.232  -2.087  -8.730
  178    H    GLY  26           H        GLY  26  44.259  -4.192  -9.220
  179    HA2  GLY  26           HA2      GLY  26  45.041  -6.582  -9.963
  180    HA3  GLY  26           HA3      GLY  26  44.971  -6.848  -8.223
  181    H    GLY  27           H        GLY  27  42.628  -4.664  -8.663
  182    HA2  GLY  27           HA2      GLY  27  40.369  -4.754  -9.268
  183    HA3  GLY  27           HA3      GLY  27  40.578  -6.445  -9.707
  184    H    TRP  28           H        TRP  28  41.892  -5.552  -6.702
  185    HA   TRP  28           HA       TRP  28  39.939  -7.235  -5.386
  186    HD1  TRP  28           HD1      TRP  28  44.236  -6.532  -6.017
  187    HE1  TRP  28           HE1      TRP  28  45.587  -4.436  -5.427
  188    HE3  TRP  28           HE3      TRP  28  41.293  -4.672  -2.279
  189    HZ2  TRP  28           HZ2      TRP  28  45.431  -2.267  -3.637
  190    HZ3  TRP  28           HZ3      TRP  28  41.961  -2.580  -1.182
  191    HH2  TRP  28           HH2      TRP  28  43.989  -1.403  -1.845
  192    HB2  TRP  28           HB2      TRP  28  41.543  -7.065  -3.446
  193    HB3  TRP  28           HB3      TRP  28  42.226  -7.764  -4.919
  194    H    LEU  29           H        LEU  29  40.437  -3.859  -5.696
  195    HA   LEU  29           HA       LEU  29  40.062  -2.995  -3.120
  196    HG   LEU  29           HG       LEU  29  37.704  -0.867  -4.448
  197    HB2  LEU  29           HB2      LEU  29  40.688  -1.266  -4.415
  198    HB3  LEU  29           HB3      LEU  29  39.694  -1.748  -5.770
  199   HD11  LEU  29          HD11      LEU  29  39.955   0.176  -2.744
  200   HD12  LEU  29          HD12      LEU  29  38.563  -0.784  -2.241
  201   HD13  LEU  29          HD13      LEU  29  38.341   0.886  -2.762
  202   HD21  LEU  29          HD21      LEU  29  39.429   1.463  -4.841
  203   HD22  LEU  29          HD22      LEU  29  37.892   1.043  -5.599
  204   HD23  LEU  29          HD23      LEU  29  39.394   0.340  -6.199
  205    H    THR  30           H        THR  30  37.532  -4.043  -5.337
  206    HA   THR  30           HA       THR  30  35.496  -3.291  -3.392
  207    HB   THR  30           HB       THR  30  33.868  -3.945  -4.969
  208    HG1  THR  30           HG1      THR  30  34.447  -5.869  -5.711
  209   HG21  THR  30          HG21      THR  30  34.298  -2.695  -6.885
  210   HG22  THR  30          HG22      THR  30  36.033  -3.015  -6.821
  211   HG23  THR  30          HG23      THR  30  35.287  -1.937  -5.638
  212    H    ARG  31           H        ARG  31  37.593  -5.874  -3.916
  213    HA   ARG  31           HA       ARG  31  35.758  -7.877  -2.835
  214    HE   ARG  31           HE       ARG  31  36.761 -10.600  -5.201
  215    HB2  ARG  31           HB2      ARG  31  38.627  -8.472  -3.408
  216    HB3  ARG  31           HB3      ARG  31  37.217  -9.501  -3.596
  217    HG2  ARG  31           HG2      ARG  31  36.553  -8.059  -5.555
  218    HG3  ARG  31           HG3      ARG  31  38.125  -7.278  -5.410
  219    HD2  ARG  31           HD2      ARG  31  38.155  -9.063  -7.087
  220    HD3  ARG  31           HD3      ARG  31  39.246  -9.406  -5.743
  221   HH11  ARG  31          HH11      ARG  31  39.424 -10.900  -7.450
  222   HH12  ARG  31          HH12      ARG  31  39.217 -12.609  -7.664
  223   HH21  ARG  31          HH21      ARG  31  36.467 -12.835  -5.490
  224   HH22  ARG  31          HH22      ARG  31  37.529 -13.716  -6.550
  225    H    LEU  32           H        LEU  32  39.022  -6.693  -2.193
  226    HA   LEU  32           HA       LEU  32  39.634  -7.945   0.157
  227    HG   LEU  32           HG       LEU  32  42.648  -5.743   0.169
  228    HB2  LEU  32           HB2      LEU  32  41.019  -6.447  -1.360
  229    HB3  LEU  32           HB3      LEU  32  40.325  -5.084  -0.510
  230   HD11  LEU  32          HD11      LEU  32  41.438  -4.323   1.611
  231   HD12  LEU  32          HD12      LEU  32  42.184  -5.566   2.615
  232   HD13  LEU  32          HD13      LEU  32  40.465  -5.660   2.225
  233   HD21  LEU  32          HD21      LEU  32  42.582  -7.643   1.931
  234   HD22  LEU  32          HD22      LEU  32  42.752  -8.024   0.217
  235   HD23  LEU  32          HD23      LEU  32  41.183  -8.194   1.008
  236    H    LEU  33           H        LEU  33  38.153  -4.723  -0.122
  237    HA   LEU  33           HA       LEU  33  38.083  -4.271   2.627
  238    HG   LEU  33           HG       LEU  33  38.836  -1.996   2.213
  239    HB2  LEU  33           HB2      LEU  33  36.687  -2.965   0.320
  240    HB3  LEU  33           HB3      LEU  33  36.375  -2.455   1.971
  241   HD11  LEU  33          HD11      LEU  33  39.840  -3.293   0.520
  242   HD12  LEU  33          HD12      LEU  33  40.039  -1.612   0.025
  243   HD13  LEU  33          HD13      LEU  33  38.796  -2.610  -0.730
  244   HD21  LEU  33          HD21      LEU  33  38.023   0.043   1.909
  245   HD22  LEU  33          HD22      LEU  33  36.854  -0.522   0.715
  246   HD23  LEU  33          HD23      LEU  33  38.495  -0.112   0.218
  247    H    GLN  34           H        GLN  34  35.432  -5.270   0.480
  248    HA   GLN  34           HA       GLN  34  33.232  -4.939   1.892
  249    HB2  GLN  34           HB2      GLN  34  33.939  -7.505   0.496
  250    HB3  GLN  34           HB3      GLN  34  32.311  -7.074   0.999
  251    HG2  GLN  34           HG2      GLN  34  33.987  -5.508  -0.946
  252    HG3  GLN  34           HG3      GLN  34  32.763  -6.687  -1.392
  253   HE21  GLN  34          HE21      GLN  34  31.479  -5.369   1.240
  254   HE22  GLN  34          HE22      GLN  34  30.608  -4.049   0.542
  255    H    THR  35           H        THR  35  34.699  -8.175   2.247
  256    HA   THR  35           HA       THR  35  33.119  -8.869   4.411
  257    HB   THR  35           HB       THR  35  34.817 -10.707   4.770
  258    HG1  THR  35           HG1      THR  35  36.732 -10.077   4.093
  259   HG21  THR  35          HG21      THR  35  34.604 -11.058   1.975
  260   HG22  THR  35          HG22      THR  35  33.127 -10.275   2.535
  261   HG23  THR  35          HG23      THR  35  33.642 -11.801   3.255
  262    H    LYS  36           H        LYS  36  36.162  -7.171   4.372
  263    HA   LYS  36           HA       LYS  36  36.460  -7.376   7.258
  264    HB2  LYS  36           HB2      LYS  36  38.094  -5.993   5.130
  265    HB3  LYS  36           HB3      LYS  36  38.471  -5.915   6.847
  266    HG2  LYS  36           HG2      LYS  36  38.867  -8.261   6.945
  267    HG3  LYS  36           HG3      LYS  36  38.256  -8.486   5.304
  268    HD2  LYS  36           HD2      LYS  36  40.119  -7.315   4.374
  269    HD3  LYS  36           HD3      LYS  36  40.659  -6.793   5.974
  270    HE2  LYS  36           HE2      LYS  36  41.975  -8.686   5.030
  271    HE3  LYS  36           HE3      LYS  36  41.229  -9.033   6.590
  272    HZ1  LYS  36           HZ1      LYS  36  40.450 -10.025   3.910
  273    HZ2  LYS  36           HZ2      LYS  36  39.356 -10.056   5.211
  274    HZ3  LYS  36           HZ3      LYS  36  40.815 -10.915   5.312
  275    H    ASN  37           H        ASN  37  34.087  -6.153   6.356
  276    HA   ASN  37           HA       ASN  37  32.759  -4.327   6.504
  277    HB2  ASN  37           HB2      ASN  37  32.829  -3.179   8.656
  278    HB3  ASN  37           HB3      ASN  37  33.070  -4.910   8.863
  279   HD21  ASN  37          HD21      ASN  37  34.825  -5.595   9.925
  280   HD22  ASN  37          HD22      ASN  37  36.116  -4.578  10.464
  281    H    TYR  38           H        TYR  38  34.938  -3.904   4.762
  282    HA   TYR  38           HA       TYR  38  35.855  -2.272   3.497
  283    HD1  TYR  38           HD1      TYR  38  34.778  -1.665   1.724
  284    HD2  TYR  38           HD2      TYR  38  31.931  -0.372   4.608
  285    HE1  TYR  38           HE1      TYR  38  32.965  -2.108   0.124
  286    HE2  TYR  38           HE2      TYR  38  30.110  -0.815   3.018
  287    HH   TYR  38           HH       TYR  38  29.559  -1.675   1.035
  288    HB2  TYR  38           HB2      TYR  38  34.163  -0.443   5.203
  289    HB3  TYR  38           HB3      TYR  38  35.175   0.129   3.881
  290    H    ASP  39           H        ASP  39  37.739  -3.121   4.595
  291    HA   ASP  39           HA       ASP  39  38.833  -1.394   6.695
  292    HB2  ASP  39           HB2      ASP  39  38.773  -3.960   6.823
  293    HB3  ASP  39           HB3      ASP  39  40.087  -3.929   5.655
  294    H    ILE  40           H        ILE  40  40.348   0.056   6.286
  295    HA   ILE  40           HA       ILE  40  41.803  -0.076   3.755
  296    HB   ILE  40           HB       ILE  40  42.870   2.108   4.666
  297   HG12  ILE  40          HG12      ILE  40  41.583   1.668   6.934
  298   HG13  ILE  40          HG13      ILE  40  41.828   3.304   6.336
  299   HG21  ILE  40          HG21      ILE  40  41.631   2.337   2.746
  300   HG22  ILE  40          HG22      ILE  40  40.738   3.367   3.868
  301   HG23  ILE  40          HG23      ILE  40  40.151   1.745   3.503
  302   HD11  ILE  40          HD11      ILE  40  39.321   1.659   6.069
  303   HD12  ILE  40          HD12      ILE  40  39.559   3.273   5.395
  304   HD13  ILE  40          HD13      ILE  40  39.575   3.036   7.144
  305    H    GLY  41           H        GLY  41  42.008  -0.992   6.988
  306    HA2  GLY  41           HA2      GLY  41  44.756  -0.707   7.474
  307    HA3  GLY  41           HA3      GLY  41  43.712  -1.876   8.253
  308    H    ALA  42           H        ALA  42  42.921  -3.196   5.891
  309    HA   ALA  42           HA       ALA  42  45.365  -4.687   5.298
  310    HB1  ALA  42           HB1      ALA  42  43.813  -6.426   4.409
  311    HB2  ALA  42           HB2      ALA  42  42.462  -5.418   4.932
  312    HB3  ALA  42           HB3      ALA  42  43.589  -6.072   6.123
  313    H    ALA  43           H        ALA  43  43.171  -2.491   3.925
  314    HA   ALA  43           HA       ALA  43  43.525  -3.184   1.180
  315    HB1  ALA  43           HB1      ALA  43  42.270  -1.320   0.665
  316    HB2  ALA  43           HB2      ALA  43  42.873  -0.400   2.043
  317    HB3  ALA  43           HB3      ALA  43  41.698  -1.692   2.291
  318    H    LEU  44           H        LEU  44  45.157  -1.066   3.450
  319    HA   LEU  44           HA       LEU  44  46.781   0.320   1.634
  320    HG   LEU  44           HG       LEU  44  47.476   2.333   3.023
  321    HB2  LEU  44           HB2      LEU  44  46.808  -0.194   4.543
  322    HB3  LEU  44           HB3      LEU  44  48.355   0.231   3.825
  323   HD11  LEU  44          HD11      LEU  44  44.843   1.273   4.008
  324   HD12  LEU  44          HD12      LEU  44  45.257   1.923   2.417
  325   HD13  LEU  44          HD13      LEU  44  45.140   3.002   3.806
  326   HD21  LEU  44          HD21      LEU  44  46.818   1.783   5.906
  327   HD22  LEU  44          HD22      LEU  44  46.896   3.395   5.190
  328   HD23  LEU  44          HD23      LEU  44  48.341   2.383   5.246
  329    H    ASP  45           H        ASP  45  47.158  -2.804   3.182
  330    HA   ASP  45           HA       ASP  45  49.812  -3.364   2.632
  331    HB2  ASP  45           HB2      ASP  45  48.315  -4.802   3.973
  332    HB3  ASP  45           HB3      ASP  45  47.471  -5.283   2.506
  333    H    THR  46           H        THR  46  47.000  -3.676   0.486
  334    HA   THR  46           HA       THR  46  48.761  -4.594  -1.636
  335    HB   THR  46           HB       THR  46  46.478  -4.797  -2.859
  336    HG1  THR  46           HG1      THR  46  44.961  -3.951  -1.665
  337   HG21  THR  46          HG21      THR  46  47.649  -6.762  -2.196
  338   HG22  THR  46          HG22      THR  46  45.964  -6.926  -1.702
  339   HG23  THR  46          HG23      THR  46  47.201  -6.524  -0.509
  340    H    ILE  47           H        ILE  47  47.695  -1.588  -0.595
  341    HA   ILE  47           HA       ILE  47  47.843  -0.534  -3.337
  342    HB   ILE  47           HB       ILE  47  47.142   1.687  -2.374
  343   HG12  ILE  47          HG12      ILE  47  46.351  -0.036  -0.024
  344   HG13  ILE  47          HG13      ILE  47  47.569   1.238  -0.017
  345   HG21  ILE  47          HG21      ILE  47  44.683   0.674  -1.989
  346   HG22  ILE  47          HG22      ILE  47  45.464  -0.696  -2.773
  347   HG23  ILE  47          HG23      ILE  47  45.424   0.871  -3.578
  348   HD11  ILE  47          HD11      ILE  47  45.506   2.013   0.982
  349   HD12  ILE  47          HD12      ILE  47  44.618   1.597  -0.483
  350   HD13  ILE  47          HD13      ILE  47  45.823   2.885  -0.518
  351    H    GLN  48           H        GLN  48  50.132  -1.465  -2.364
  352    HA   GLN  48           HA       GLN  48  52.325  -0.937  -2.500
  353    HB2  GLN  48           HB2      GLN  48  51.546   1.979  -2.482
  354    HB3  GLN  48           HB3      GLN  48  53.080   1.296  -2.996
  355    HG2  GLN  48           HG2      GLN  48  52.317   1.156  -5.071
  356    HG3  GLN  48           HG3      GLN  48  51.033   0.071  -4.530
  357   HE21  GLN  48          HE21      GLN  48  49.083   0.731  -5.082
  358   HE22  GLN  48          HE22      GLN  48  48.546   2.383  -5.201
  359    H    TYR  49           H        TYR  49  50.863  -1.157   0.058
  360    HA   TYR  49           HA       TYR  49  53.040  -0.067   1.693
  361    HD1  TYR  49           HD1      TYR  49  53.190   2.144   2.700
  362    HD2  TYR  49           HD2      TYR  49  49.112   1.907   1.521
  363    HE1  TYR  49           HE1      TYR  49  53.233   4.526   2.099
  364    HE2  TYR  49           HE2      TYR  49  49.141   4.287   0.918
  365    HH   TYR  49           HH       TYR  49  51.884   6.035   0.462
  366    HB2  TYR  49           HB2      TYR  49  50.106   0.045   2.421
  367    HB3  TYR  49           HB3      TYR  49  51.415   0.315   3.571
  368    H    SER  50           H        SER  50  53.475  -2.442   0.942
  369    HA   SER  50           HA       SER  50  52.069  -4.462   2.446
  370    HG   SER  50           HG       SER  50  51.820  -4.903   0.132
  371    HB2  SER  50           HB2      SER  50  54.580  -4.712   0.773
  372    HB3  SER  50           HB3      SER  50  53.576  -6.040   1.354
  373    H    LYS  51           H        LYS  51  53.022  -2.706   4.235
  374    HA   LYS  51           HA       LYS  51  54.556  -4.381   5.946
  375    HB2  LYS  51           HB2      LYS  51  56.178  -2.940   4.319
  376    HB3  LYS  51           HB3      LYS  51  55.944  -1.778   5.617
  377    HG2  LYS  51           HG2      LYS  51  57.131  -4.537   5.806
  378    HG3  LYS  51           HG3      LYS  51  57.929  -2.991   6.097
  379    HD2  LYS  51           HD2      LYS  51  56.297  -2.653   8.000
  380    HD3  LYS  51           HD3      LYS  51  55.819  -4.337   7.776
  381    HE2  LYS  51           HE2      LYS  51  57.444  -4.320   9.503
  382    HE3  LYS  51           HE3      LYS  51  58.243  -4.951   8.063
  383    HZ1  LYS  51           HZ1      LYS  51  59.706  -3.397   9.063
  384    HZ2  LYS  51           HZ2      LYS  51  58.484  -2.226   9.210
  385    HZ3  LYS  51           HZ3      LYS  51  59.080  -2.641   7.674
  386    H    HIS  52           H        HIS  52  52.477  -3.965   6.988
  387    HA   HIS  52           HA       HIS  52  52.517  -1.416   8.451
  388    HD1  HIS  52           HD1      HIS  52  49.203  -3.831   9.182
  389    HD2  HIS  52           HD2      HIS  52  49.574  -3.088   5.109
  390    HE1  HIS  52           HE1      HIS  52  47.813  -5.590   8.010
  391    HB2  HIS  52           HB2      HIS  52  50.079  -1.302   8.361
  392    HB3  HIS  52           HB3      HIS  52  50.754  -1.322   6.737
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1  21.139   4.154   3.560
    2    H2   GLY   1           2H       GLY   1  21.526   2.948   4.688
    3    H3   GLY   1           3H       GLY   1  20.320   2.669   3.532
    4    HA2  GLY   1           HA2      GLY   1  23.160   2.361   3.322
    5    HA3  GLY   1           HA3      GLY   1  21.880   1.664   2.338
    6    H    SER   2           H        SER   2  24.547   3.274   1.954
    7    HA   SER   2           HA       SER   2  23.457   5.131  -0.067
    8    HG   SER   2           HG       SER   2  26.443   7.050   0.240
    9    HB2  SER   2           HB2      SER   2  24.648   6.191   1.881
   10    HB3  SER   2           HB3      SER   2  26.106   5.326   1.400
   11    HA   PRO   3           HA       PRO   3  25.435   2.866  -3.326
   12    HB2  PRO   3           HB2      PRO   3  26.650   5.459  -4.167
   13    HB3  PRO   3           HB3      PRO   3  25.710   4.299  -5.113
   14    HG2  PRO   3           HG2      PRO   3  24.618   6.583  -4.290
   15    HG3  PRO   3           HG3      PRO   3  23.682   5.078  -4.290
   16    HD2  PRO   3           HD2      PRO   3  24.922   6.537  -2.002
   17    HD3  PRO   3           HD3      PRO   3  23.397   5.630  -2.070
   18    HA   PRO   4           HA       PRO   4  29.439   1.994  -1.742
   19    HB2  PRO   4           HB2      PRO   4  30.055   0.720  -4.321
   20    HB3  PRO   4           HB3      PRO   4  29.922   0.004  -2.713
   21    HG2  PRO   4           HG2      PRO   4  28.056  -0.430  -4.588
   22    HG3  PRO   4           HG3      PRO   4  27.630  -0.269  -2.874
   23    HD2  PRO   4           HD2      PRO   4  27.410   1.754  -5.079
   24    HD3  PRO   4           HD3      PRO   4  26.252   1.367  -3.786
   25    H    GLU   5           H        GLU   5  29.260   4.591  -3.052
   26    HA   GLU   5           HA       GLU   5  32.093   4.881  -3.627
   27    HB2  GLU   5           HB2      GLU   5  29.945   5.793  -5.545
   28    HB3  GLU   5           HB3      GLU   5  31.583   6.425  -5.571
   29    HG2  GLU   5           HG2      GLU   5  32.453   4.224  -6.077
   30    HG3  GLU   5           HG3      GLU   5  30.834   3.536  -5.963
   31    H    ALA   6           H        ALA   6  29.752   5.651  -1.739
   32    HA   ALA   6           HA       ALA   6  30.808   8.053  -0.762
   33    HB1  ALA   6           HB1      ALA   6  29.720   8.867  -2.922
   34    HB2  ALA   6           HB2      ALA   6  29.313   9.722  -1.435
   35    HB3  ALA   6           HB3      ALA   6  28.179   8.558  -2.119
   36    H    ASP   7           H        ASP   7  30.047   5.636   0.241
   37    HA   ASP   7           HA       ASP   7  27.609   6.119   1.786
   38    HB2  ASP   7           HB2      ASP   7  27.885   3.871   0.821
   39    HB3  ASP   7           HB3      ASP   7  29.458   3.714   1.589
   40    HA   PRO   8           HA       PRO   8  29.687   7.907   5.271
   41    HB2  PRO   8           HB2      PRO   8  28.529   5.633   6.830
   42    HB3  PRO   8           HB3      PRO   8  28.520   7.362   7.194
   43    HG2  PRO   8           HG2      PRO   8  26.353   6.125   6.206
   44    HG3  PRO   8           HG3      PRO   8  26.760   7.793   5.772
   45    HD2  PRO   8           HD2      PRO   8  26.928   5.331   4.138
   46    HD3  PRO   8           HD3      PRO   8  26.785   7.023   3.626
   47    H    ARG   9           H        ARG   9  29.888   4.441   4.768
   48    HA   ARG   9           HA       ARG   9  32.293   4.124   6.349
   49    HE   ARG   9           HE       ARG   9  29.597  -0.403   4.990
   50    HB2  ARG   9           HB2      ARG   9  30.752   2.266   4.536
   51    HB3  ARG   9           HB3      ARG   9  32.182   1.782   5.459
   52    HG2  ARG   9           HG2      ARG   9  30.986   2.434   7.540
   53    HG3  ARG   9           HG3      ARG   9  29.546   2.728   6.562
   54    HD2  ARG   9           HD2      ARG   9  31.013   0.098   6.695
   55    HD3  ARG   9           HD3      ARG   9  29.602   0.498   7.670
   56   HH11  ARG   9          HH11      ARG   9  27.971   1.860   7.098
   57   HH12  ARG   9          HH12      ARG   9  26.467   1.784   6.232
   58   HH21  ARG   9          HH21      ARG   9  27.616  -0.525   3.858
   59   HH22  ARG   9          HH22      ARG   9  26.270   0.447   4.378
   60    H    LEU  10           H        LEU  10  31.478   4.561   2.970
   61    HA   LEU  10           HA       LEU  10  34.156   3.817   2.164
   62    HG   LEU  10           HG       LEU  10  31.868   2.126   1.750
   63    HB2  LEU  10           HB2      LEU  10  31.642   4.365   0.608
   64    HB3  LEU  10           HB3      LEU  10  33.195   4.057  -0.153
   65   HD11  LEU  10          HD11      LEU  10  31.396   0.818  -0.332
   66   HD12  LEU  10          HD12      LEU  10  31.767   2.279  -1.248
   67   HD13  LEU  10          HD13      LEU  10  30.416   2.269  -0.111
   68   HD21  LEU  10          HD21      LEU  10  34.337   1.986   1.472
   69   HD22  LEU  10          HD22      LEU  10  34.077   1.694  -0.249
   70   HD23  LEU  10          HD23      LEU  10  33.468   0.545   0.943
   71    H    ILE  11           H        ILE  11  32.299   6.670   2.710
   72    HA   ILE  11           HA       ILE  11  34.105   8.370   1.197
   73    HB   ILE  11           HB       ILE  11  33.122  10.235   2.555
   74   HG12  ILE  11          HG12      ILE  11  31.372   8.006   3.617
   75   HG13  ILE  11          HG13      ILE  11  32.459   9.031   4.552
   76   HG21  ILE  11          HG21      ILE  11  32.174   9.996   0.452
   77   HG22  ILE  11          HG22      ILE  11  30.777   9.944   1.527
   78   HG23  ILE  11          HG23      ILE  11  31.427   8.450   0.854
   79   HD11  ILE  11          HD11      ILE  11  30.839  10.494   4.864
   80   HD12  ILE  11          HD12      ILE  11  29.737   9.431   3.988
   81   HD13  ILE  11          HD13      ILE  11  30.633  10.681   3.123
   82    H    GLU  12           H        GLU  12  34.122   6.564   3.989
   83    HA   GLU  12           HA       GLU  12  36.268   8.110   5.250
   84    HB2  GLU  12           HB2      GLU  12  34.481   7.258   6.715
   85    HB3  GLU  12           HB3      GLU  12  34.824   5.618   6.187
   86    HG2  GLU  12           HG2      GLU  12  37.073   5.795   7.164
   87    HG3  GLU  12           HG3      GLU  12  36.672   7.413   7.742
   88    H    SER  13           H        SER  13  35.583   4.786   4.154
   89    HA   SER  13           HA       SER  13  38.377   4.111   4.395
   90    HG   SER  13           HG       SER  13  37.829   0.996   4.880
   91    HB2  SER  13           HB2      SER  13  36.590   2.639   5.261
   92    HB3  SER  13           HB3      SER  13  36.024   2.377   3.612
   93    H    LEU  14           H        LEU  14  36.119   4.576   1.676
   94    HA   LEU  14           HA       LEU  14  38.142   3.524  -0.152
   95    HG   LEU  14           HG       LEU  14  37.339   2.978  -2.401
   96    HB2  LEU  14           HB2      LEU  14  35.676   2.975  -0.378
   97    HB3  LEU  14           HB3      LEU  14  35.417   4.651  -0.814
   98   HD11  LEU  14          HD11      LEU  14  35.115   1.792  -2.136
   99   HD12  LEU  14          HD12      LEU  14  35.629   2.142  -3.784
  100   HD13  LEU  14          HD13      LEU  14  34.401   3.145  -3.013
  101   HD21  LEU  14          HD21      LEU  14  36.488   4.476  -4.219
  102   HD22  LEU  14          HD22      LEU  14  37.355   5.307  -2.927
  103   HD23  LEU  14          HD23      LEU  14  35.593   5.365  -2.986
  104    H    SER  15           H        SER  15  36.445   6.460   0.717
  105    HA   SER  15           HA       SER  15  37.594   8.006  -1.319
  106    HG   SER  15           HG       SER  15  37.237  10.759   0.185
  107    HB2  SER  15           HB2      SER  15  35.487   8.574  -0.080
  108    HB3  SER  15           HB3      SER  15  36.494   9.052   1.288
  109    H    GLN  16           H        GLN  16  38.812   7.010   1.770
  110    HA   GLN  16           HA       GLN  16  40.644   9.122   2.173
  111    HB2  GLN  16           HB2      GLN  16  41.770   7.672   3.768
  112    HB3  GLN  16           HB3      GLN  16  40.032   7.603   3.989
  113    HG2  GLN  16           HG2      GLN  16  40.534   5.402   4.180
  114    HG3  GLN  16           HG3      GLN  16  40.270   5.479   2.441
  115   HE21  GLN  16          HE21      GLN  16  41.667   4.151   1.519
  116   HE22  GLN  16          HE22      GLN  16  43.358   4.054   1.865
  117    H    MET  17           H        MET  17  40.736   6.339   0.101
  118    HA   MET  17           HA       MET  17  43.542   6.909  -0.547
  119    HB2  MET  17           HB2      MET  17  43.385   4.829  -1.964
  120    HB3  MET  17           HB3      MET  17  43.228   4.574  -0.233
  121    HG2  MET  17           HG2      MET  17  40.901   4.224  -0.399
  122    HG3  MET  17           HG3      MET  17  40.860   4.811  -2.061
  123    HE1  MET  17           HE1      MET  17  42.047   2.045  -4.216
  124    HE2  MET  17           HE2      MET  17  43.342   3.052  -3.571
  125    HE3  MET  17           HE3      MET  17  41.787   3.775  -3.987
  126    H    LEU  18           H        LEU  18  40.302   7.206  -1.695
  127    HA   LEU  18           HA       LEU  18  40.782   7.473  -4.452
  128    HG   LEU  18           HG       LEU  18  38.732   9.608  -5.180
  129    HB2  LEU  18           HB2      LEU  18  38.551   7.198  -3.367
  130    HB3  LEU  18           HB3      LEU  18  38.657   8.856  -2.808
  131   HD11  LEU  18          HD11      LEU  18  39.595   7.745  -6.331
  132   HD12  LEU  18          HD12      LEU  18  37.918   7.892  -6.857
  133   HD13  LEU  18          HD13      LEU  18  38.365   6.668  -5.669
  134   HD21  LEU  18          HD21      LEU  18  36.474   8.311  -3.841
  135   HD22  LEU  18          HD22      LEU  18  36.278   8.503  -5.582
  136   HD23  LEU  18          HD23      LEU  18  36.597   9.912  -4.569
  137    H    SER  19           H        SER  19  40.848   9.836  -1.823
  138    HA   SER  19           HA       SER  19  41.517  11.969  -3.681
  139    HG   SER  19           HG       SER  19  40.528  12.336   0.254
  140    HB2  SER  19           HB2      SER  19  41.465  13.387  -1.605
  141    HB3  SER  19           HB3      SER  19  39.952  12.544  -1.942
  142    H    MET  20           H        MET  20  43.086   9.854  -1.420
  143    HA   MET  20           HA       MET  20  45.379  11.473  -0.983
  144    HB2  MET  20           HB2      MET  20  44.575   9.618   0.525
  145    HB3  MET  20           HB3      MET  20  45.194   8.475  -0.659
  146    HG2  MET  20           HG2      MET  20  47.442   9.368  -0.359
  147    HG3  MET  20           HG3      MET  20  46.828  10.524   0.820
  148    HE1  MET  20           HE1      MET  20  45.656   8.154   3.721
  149    HE2  MET  20           HE2      MET  20  44.639   8.571   2.340
  150    HE3  MET  20           HE3      MET  20  45.662   9.799   3.087
  151    H    GLY  21           H        GLY  21  44.539   9.057  -3.383
  152    HA2  GLY  21           HA2      GLY  21  45.620   9.136  -5.536
  153    HA3  GLY  21           HA3      GLY  21  47.086   9.679  -4.726
  154    H    PHE  22           H        PHE  22  44.912   6.941  -4.071
  155    HA   PHE  22           HA       PHE  22  47.202   5.149  -4.502
  156    HD1  PHE  22           HD2      PHE  22  48.296   5.820  -3.246
  157    HD2  PHE  22           HD1      PHE  22  45.757   4.258  -0.208
  158    HE1  PHE  22           HE2      PHE  22  49.972   6.404  -1.548
  159    HE2  PHE  22           HE1      PHE  22  47.431   4.837   1.494
  160    HZ   PHE  22           HZ       PHE  22  49.544   5.909   0.824
  161    HB2  PHE  22           HB2      PHE  22  44.923   4.973  -2.530
  162    HB3  PHE  22           HB3      PHE  22  45.877   3.559  -2.978
  163    H    SER  23           H        SER  23  46.199   2.809  -5.017
  164    HA   SER  23           HA       SER  23  43.859   3.154  -6.714
  165    HG   SER  23           HG       SER  23  46.978   3.878  -8.434
  166    HB2  SER  23           HB2      SER  23  46.416   1.963  -7.814
  167    HB3  SER  23           HB3      SER  23  44.922   2.274  -8.693
  168    H    ASP  24           H        ASP  24  42.982   1.121  -7.500
  169    HA   ASP  24           HA       ASP  24  43.111  -1.024  -5.602
  170    HB2  ASP  24           HB2      ASP  24  41.125  -0.346  -7.094
  171    HB3  ASP  24           HB3      ASP  24  41.966  -1.194  -8.390
  172    H    GLU  25           H        GLU  25  44.356  -2.844  -5.683
  173    HA   GLU  25           HA       GLU  25  46.453  -2.837  -7.685
  174    HB2  GLU  25           HB2      GLU  25  46.887  -3.064  -5.205
  175    HB3  GLU  25           HB3      GLU  25  46.201  -4.679  -5.309
  176    HG2  GLU  25           HG2      GLU  25  48.262  -4.287  -7.288
  177    HG3  GLU  25           HG3      GLU  25  48.849  -3.958  -5.657
  178    H    GLY  26           H        GLY  26  43.531  -4.553  -7.182
  179    HA2  GLY  26           HA2      GLY  26  43.984  -6.060  -9.569
  180    HA3  GLY  26           HA3      GLY  26  44.134  -7.088  -8.151
  181    H    GLY  27           H        GLY  27  41.856  -4.478  -8.007
  182    HA2  GLY  27           HA2      GLY  27  39.549  -4.467  -8.407
  183    HA3  GLY  27           HA3      GLY  27  39.654  -6.137  -8.946
  184    H    TRP  28           H        TRP  28  41.102  -5.230  -5.944
  185    HA   TRP  28           HA       TRP  28  39.176  -6.911  -4.543
  186    HD1  TRP  28           HD1      TRP  28  43.461  -6.391  -5.359
  187    HE1  TRP  28           HE1      TRP  28  44.909  -4.336  -4.857
  188    HE3  TRP  28           HE3      TRP  28  40.760  -4.393  -1.521
  189    HZ2  TRP  28           HZ2      TRP  28  44.906  -2.140  -3.086
  190    HZ3  TRP  28           HZ3      TRP  28  41.546  -2.318  -0.474
  191    HH2  TRP  28           HH2      TRP  28  43.580  -1.216  -1.238
  192    HB2  TRP  28           HB2      TRP  28  40.861  -6.782  -2.670
  193    HB3  TRP  28           HB3      TRP  28  41.459  -7.532  -4.153
  194    H    LEU  29           H        LEU  29  39.863  -3.578  -4.949
  195    HA   LEU  29           HA       LEU  29  39.667  -2.558  -2.443
  196    HG   LEU  29           HG       LEU  29  37.471  -0.218  -3.304
  197    HB2  LEU  29           HB2      LEU  29  40.243  -1.073  -4.137
  198    HB3  LEU  29           HB3      LEU  29  38.801  -1.400  -5.065
  199   HD11  LEU  29          HD11      LEU  29  40.071   0.852  -2.279
  200   HD12  LEU  29          HD12      LEU  29  39.325  -0.577  -1.563
  201   HD13  LEU  29          HD13      LEU  29  38.464   0.961  -1.566
  202   HD21  LEU  29          HD21      LEU  29  39.618   1.594  -4.337
  203   HD22  LEU  29          HD22      LEU  29  37.890   1.898  -4.167
  204   HD23  LEU  29          HD23      LEU  29  38.475   0.818  -5.433
  205    H    THR  30           H        THR  30  37.041  -3.935  -4.205
  206    HA   THR  30           HA       THR  30  35.137  -3.014  -2.186
  207    HB   THR  30           HB       THR  30  33.519  -4.471  -3.517
  208    HG1  THR  30           HG1      THR  30  34.166  -5.272  -5.425
  209   HG21  THR  30          HG21      THR  30  34.161  -2.754  -5.644
  210   HG22  THR  30          HG22      THR  30  34.571  -1.896  -4.159
  211   HG23  THR  30          HG23      THR  30  32.940  -2.528  -4.392
  212    H    ARG  31           H        ARG  31  36.131  -6.133  -3.578
  213    HA   ARG  31           HA       ARG  31  35.068  -7.856  -1.747
  214    HE   ARG  31           HE       ARG  31  34.821  -9.477  -5.649
  215    HB2  ARG  31           HB2      ARG  31  37.584  -8.964  -2.439
  216    HB3  ARG  31           HB3      ARG  31  36.016  -9.318  -3.137
  217    HG2  ARG  31           HG2      ARG  31  37.618  -6.975  -4.078
  218    HG3  ARG  31           HG3      ARG  31  37.924  -8.603  -4.688
  219    HD2  ARG  31           HD2      ARG  31  35.161  -7.428  -4.708
  220    HD3  ARG  31           HD3      ARG  31  36.311  -7.072  -5.996
  221   HH11  ARG  31          HH11      ARG  31  37.871  -8.213  -6.808
  222   HH12  ARG  31          HH12      ARG  31  38.163  -9.549  -7.882
  223   HH21  ARG  31          HH21      ARG  31  35.191 -11.224  -7.066
  224   HH22  ARG  31          HH22      ARG  31  36.625 -11.249  -8.046
  225    H    LEU  32           H        LEU  32  38.440  -6.675  -1.610
  226    HA   LEU  32           HA       LEU  32  39.217  -7.919   0.739
  227    HG   LEU  32           HG       LEU  32  42.387  -5.974   0.441
  228    HB2  LEU  32           HB2      LEU  32  40.585  -6.590  -0.961
  229    HB3  LEU  32           HB3      LEU  32  40.087  -5.152  -0.093
  230   HD11  LEU  32          HD11      LEU  32  40.390  -5.806   2.680
  231   HD12  LEU  32          HD12      LEU  32  41.373  -4.505   2.005
  232   HD13  LEU  32          HD13      LEU  32  42.139  -5.810   2.915
  233   HD21  LEU  32          HD21      LEU  32  42.629  -7.897   1.915
  234   HD22  LEU  32          HD22      LEU  32  41.974  -8.356   0.344
  235   HD23  LEU  32          HD23      LEU  32  40.907  -8.246   1.746
  236    H    LEU  33           H        LEU  33  37.723  -4.716   0.343
  237    HA   LEU  33           HA       LEU  33  37.780  -4.102   3.108
  238    HG   LEU  33           HG       LEU  33  38.198  -1.697   2.859
  239    HB2  LEU  33           HB2      LEU  33  36.456  -2.923   0.711
  240    HB3  LEU  33           HB3      LEU  33  35.894  -2.435   2.301
  241   HD11  LEU  33          HD11      LEU  33  39.357  -3.214   1.271
  242   HD12  LEU  33          HD12      LEU  33  39.895  -1.536   1.179
  243   HD13  LEU  33          HD13      LEU  33  38.805  -2.183  -0.050
  244   HD21  LEU  33          HD21      LEU  33  37.573  -0.291   0.333
  245   HD22  LEU  33          HD22      LEU  33  37.877   0.351   1.949
  246   HD23  LEU  33          HD23      LEU  33  36.308  -0.353   1.558
  247    H    GLN  34           H        GLN  34  35.130  -5.147   0.982
  248    HA   GLN  34           HA       GLN  34  33.006  -5.071   2.640
  249    HB2  GLN  34           HB2      GLN  34  33.750  -6.628   0.328
  250    HB3  GLN  34           HB3      GLN  34  32.653  -7.522   1.374
  251    HG2  GLN  34           HG2      GLN  34  31.081  -6.464   0.170
  252    HG3  GLN  34           HG3      GLN  34  31.389  -5.153   1.304
  253   HE21  GLN  34          HE21      GLN  34  31.967  -3.245   0.500
  254   HE22  GLN  34          HE22      GLN  34  32.466  -2.953  -1.126
  255    H    THR  35           H        THR  35  35.086  -7.980   2.410
  256    HA   THR  35           HA       THR  35  33.681  -9.243   4.539
  257    HB   THR  35           HB       THR  35  35.439 -10.998   4.332
  258    HG1  THR  35           HG1      THR  35  37.023 -10.768   2.783
  259   HG21  THR  35          HG21      THR  35  34.752 -10.411   1.522
  260   HG22  THR  35          HG22      THR  35  33.413 -10.583   2.657
  261   HG23  THR  35          HG23      THR  35  34.571 -11.897   2.456
  262    H    LYS  36           H        LYS  36  35.875  -6.780   4.699
  263    HA   LYS  36           HA       LYS  36  36.802  -7.674   7.351
  264    HB2  LYS  36           HB2      LYS  36  38.209  -6.110   5.221
  265    HB3  LYS  36           HB3      LYS  36  38.657  -5.905   6.907
  266    HG2  LYS  36           HG2      LYS  36  39.105  -8.334   7.042
  267    HG3  LYS  36           HG3      LYS  36  38.747  -8.460   5.316
  268    HD2  LYS  36           HD2      LYS  36  40.581  -7.037   4.756
  269    HD3  LYS  36           HD3      LYS  36  40.852  -6.631   6.453
  270    HE2  LYS  36           HE2      LYS  36  42.508  -8.237   5.705
  271    HE3  LYS  36           HE3      LYS  36  41.443  -8.974   6.900
  272    HZ1  LYS  36           HZ1      LYS  36  40.785 -10.503   5.444
  273    HZ2  LYS  36           HZ2      LYS  36  42.046  -9.979   4.433
  274    HZ3  LYS  36           HZ3      LYS  36  40.478  -9.353   4.229
  275    H    ASN  37           H        ASN  37  34.332  -6.141   6.675
  276    HA   ASN  37           HA       ASN  37  33.134  -4.410   7.569
  277    HB2  ASN  37           HB2      ASN  37  34.043  -5.188   9.698
  278    HB3  ASN  37           HB3      ASN  37  35.525  -4.279   9.431
  279   HD21  ASN  37          HD21      ASN  37  35.665  -2.495  10.529
  280   HD22  ASN  37          HD22      ASN  37  34.356  -1.500  11.056
  281    H    TYR  38           H        TYR  38  34.960  -3.998   5.366
  282    HA   TYR  38           HA       TYR  38  35.841  -2.384   4.044
  283    HD1  TYR  38           HD2      TYR  38  33.859  -3.185   3.750
  284    HD2  TYR  38           HD1      TYR  38  32.713   0.896   4.093
  285    HE1  TYR  38           HE2      TYR  38  31.903  -3.617   2.325
  286    HE2  TYR  38           HE1      TYR  38  30.756   0.474   2.670
  287    HH   TYR  38           HH       TYR  38  29.461  -1.127   1.748
  288    HB2  TYR  38           HB2      TYR  38  34.271  -0.569   5.882
  289    HB3  TYR  38           HB3      TYR  38  35.160   0.011   4.480
  290    H    ASP  39           H        ASP  39  37.727  -3.342   5.322
  291    HA   ASP  39           HA       ASP  39  38.897  -1.455   7.207
  292    HB2  ASP  39           HB2      ASP  39  38.831  -3.818   7.800
  293    HB3  ASP  39           HB3      ASP  39  39.792  -4.221   6.382
  294    H    ILE  40           H        ILE  40  40.426  -0.071   6.741
  295    HA   ILE  40           HA       ILE  40  41.886  -0.362   4.226
  296    HB   ILE  40           HB       ILE  40  42.929   1.875   4.910
  297   HG12  ILE  40          HG12      ILE  40  41.813   1.587   7.299
  298   HG13  ILE  40          HG13      ILE  40  42.016   3.179   6.576
  299   HG21  ILE  40          HG21      ILE  40  41.422   1.712   3.079
  300   HG22  ILE  40          HG22      ILE  40  40.945   3.114   4.038
  301   HG23  ILE  40          HG23      ILE  40  40.029   1.611   4.155
  302   HD11  ILE  40          HD11      ILE  40  39.674   3.061   5.779
  303   HD12  ILE  40          HD12      ILE  40  39.830   3.018   7.536
  304   HD13  ILE  40          HD13      ILE  40  39.498   1.534   6.645
  305    H    GLY  41           H        GLY  41  42.113  -1.316   7.373
  306    HA2  GLY  41           HA2      GLY  41  44.826  -0.892   7.960
  307    HA3  GLY  41           HA3      GLY  41  43.834  -2.168   8.637
  308    H    ALA  42           H        ALA  42  43.161  -3.435   6.269
  309    HA   ALA  42           HA       ALA  42  45.717  -4.659   5.528
  310    HB1  ALA  42           HB1      ALA  42  42.899  -5.693   5.262
  311    HB2  ALA  42           HB2      ALA  42  44.126  -6.238   6.407
  312    HB3  ALA  42           HB3      ALA  42  44.336  -6.538   4.681
  313    H    ALA  43           H        ALA  43  43.162  -2.729   4.337
  314    HA   ALA  43           HA       ALA  43  43.429  -3.289   1.563
  315    HB1  ALA  43           HB1      ALA  43  42.633  -0.567   2.438
  316    HB2  ALA  43           HB2      ALA  43  41.602  -1.921   2.907
  317    HB3  ALA  43           HB3      ALA  43  41.932  -1.609   1.201
  318    H    LEU  44           H        LEU  44  44.978  -1.001   3.750
  319    HA   LEU  44           HA       LEU  44  46.351   0.538   1.872
  320    HG   LEU  44           HG       LEU  44  47.084   2.578   3.252
  321    HB2  LEU  44           HB2      LEU  44  46.597  -0.002   4.753
  322    HB3  LEU  44           HB3      LEU  44  48.087   0.505   3.967
  323   HD11  LEU  44          HD11      LEU  44  44.885   2.065   2.667
  324   HD12  LEU  44          HD12      LEU  44  44.724   3.091   4.095
  325   HD13  LEU  44          HD13      LEU  44  44.536   1.341   4.242
  326   HD21  LEU  44          HD21      LEU  44  46.202   3.352   5.613
  327   HD22  LEU  44          HD22      LEU  44  47.903   2.972   5.343
  328   HD23  LEU  44          HD23      LEU  44  46.844   1.784   6.101
  329    H    ASP  45           H        ASP  45  47.131  -2.563   3.304
  330    HA   ASP  45           HA       ASP  45  49.768  -2.911   2.596
  331    HB2  ASP  45           HB2      ASP  45  48.375  -4.484   3.921
  332    HB3  ASP  45           HB3      ASP  45  47.574  -4.990   2.440
  333    H    THR  46           H        THR  46  46.905  -3.505   0.563
  334    HA   THR  46           HA       THR  46  48.612  -4.201  -1.659
  335    HB   THR  46           HB       THR  46  46.185  -4.273  -2.752
  336    HG1  THR  46           HG1      THR  46  44.895  -3.602  -1.179
  337   HG21  THR  46          HG21      THR  46  47.502  -6.253  -0.946
  338   HG22  THR  46          HG22      THR  46  47.298  -6.292  -2.699
  339   HG23  THR  46          HG23      THR  46  45.915  -6.585  -1.644
  340    H    ILE  47           H        ILE  47  46.984  -1.337  -0.557
  341    HA   ILE  47           HA       ILE  47  47.244  -0.112  -3.193
  342    HB   ILE  47           HB       ILE  47  46.423   2.000  -2.080
  343   HG12  ILE  47          HG12      ILE  47  45.830   0.062   0.157
  344   HG13  ILE  47          HG13      ILE  47  46.860   1.493   0.233
  345   HG21  ILE  47          HG21      ILE  47  44.777  -0.473  -2.409
  346   HG22  ILE  47          HG22      ILE  47  44.874   0.952  -3.438
  347   HG23  ILE  47          HG23      ILE  47  44.028   1.038  -1.893
  348   HD11  ILE  47          HD11      ILE  47  43.893   1.519  -0.276
  349   HD12  ILE  47          HD12      ILE  47  44.943   2.924  -0.092
  350   HD13  ILE  47          HD13      ILE  47  44.669   1.844   1.275
  351    H    GLN  48           H        GLN  48  49.596  -0.983  -2.264
  352    HA   GLN  48           HA       GLN  48  51.737  -0.312  -2.496
  353    HB2  GLN  48           HB2      GLN  48  50.705   2.509  -2.187
  354    HB3  GLN  48           HB3      GLN  48  52.373   2.084  -2.550
  355    HG2  GLN  48           HG2      GLN  48  51.870   2.101  -4.702
  356    HG3  GLN  48           HG3      GLN  48  50.789   0.735  -4.438
  357   HE21  GLN  48          HE21      GLN  48  48.725   1.023  -4.898
  358   HE22  GLN  48          HE22      GLN  48  47.926   2.549  -5.069
  359    H    TYR  49           H        TYR  49  50.720  -1.202  -0.063
  360    HA   TYR  49           HA       TYR  49  52.852  -0.125   1.616
  361    HD1  TYR  49           HD1      TYR  49  49.889   1.661   1.113
  362    HD2  TYR  49           HD2      TYR  49  52.041   1.267   4.759
  363    HE1  TYR  49           HE1      TYR  49  49.820   4.098   1.410
  364    HE2  TYR  49           HE2      TYR  49  51.979   3.699   5.070
  365    HH   TYR  49           HH       TYR  49  51.311   5.643   4.261
  366    HB2  TYR  49           HB2      TYR  49  50.013  -0.545   2.545
  367    HB3  TYR  49           HB3      TYR  49  51.368  -0.639   3.667
  368    H    SER  50           H        SER  50  52.857  -2.336  -0.080
  369    HA   SER  50           HA       SER  50  52.234  -4.705   1.388
  370    HG   SER  50           HG       SER  50  53.417  -4.181  -2.415
  371    HB2  SER  50           HB2      SER  50  53.459  -5.796  -0.599
  372    HB3  SER  50           HB3      SER  50  51.972  -4.911  -0.942
  373    H    LYS  51           H        LYS  51  54.548  -2.604   1.899
  374    HA   LYS  51           HA       LYS  51  56.582  -4.624   2.566
  375    HB2  LYS  51           HB2      LYS  51  57.057  -1.650   2.408
  376    HB3  LYS  51           HB3      LYS  51  58.251  -2.938   2.408
  377    HG2  LYS  51           HG2      LYS  51  56.278  -2.428   0.190
  378    HG3  LYS  51           HG3      LYS  51  57.954  -1.880   0.204
  379    HD2  LYS  51           HD2      LYS  51  58.758  -4.147   0.204
  380    HD3  LYS  51           HD3      LYS  51  57.120  -4.775   0.402
  381    HE2  LYS  51           HE2      LYS  51  58.041  -4.894  -1.938
  382    HE3  LYS  51           HE3      LYS  51  56.490  -4.067  -1.778
  383    HZ1  LYS  51           HZ1      LYS  51  58.719  -2.277  -1.505
  384    HZ2  LYS  51           HZ2      LYS  51  57.362  -2.174  -2.526
  385    HZ3  LYS  51           HZ3      LYS  51  58.719  -3.072  -3.005
  386    H    HIS  52           H        HIS  52  54.088  -3.467   3.934
  387    HA   HIS  52           HA       HIS  52  53.356  -3.103   6.045
  388    HD1  HIS  52           HD1      HIS  52  54.705  -1.764   8.815
  389    HD2  HIS  52           HD2      HIS  52  54.005  -5.862   8.839
  390    HE1  HIS  52           HE1      HIS  52  53.648  -2.291  11.055
  391    HB2  HIS  52           HB2      HIS  52  55.098  -4.874   6.612
  392    HB3  HIS  52           HB3      HIS  52  56.178  -3.548   7.030
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1  19.784   5.881   1.586
    2    H2   GLY   1           2H       GLY   1  20.801   4.673   2.199
    3    H3   GLY   1           3H       GLY   1  19.165   4.335   1.908
    4    HA2  GLY   1           HA2      GLY   1  20.572   3.390   0.185
    5    HA3  GLY   1           HA3      GLY   1  19.467   4.600  -0.449
    6    H    SER   2           H        SER   2  22.796   4.006   0.543
    7    HA   SER   2           HA       SER   2  23.612   6.288  -1.135
    8    HG   SER   2           HG       SER   2  24.694   7.542   1.763
    9    HB2  SER   2           HB2      SER   2  25.036   5.093   1.260
   10    HB3  SER   2           HB3      SER   2  25.667   6.396   0.252
   11    HA   PRO   3           HA       PRO   3  25.725   3.410  -3.755
   12    HB2  PRO   3           HB2      PRO   3  27.816   5.409  -4.229
   13    HB3  PRO   3           HB3      PRO   3  26.613   4.767  -5.350
   14    HG2  PRO   3           HG2      PRO   3  26.514   7.305  -4.429
   15    HG3  PRO   3           HG3      PRO   3  25.055   6.371  -4.812
   16    HD2  PRO   3           HD2      PRO   3  26.297   6.941  -2.145
   17    HD3  PRO   3           HD3      PRO   3  24.582   6.932  -2.611
   18    HA   PRO   4           HA       PRO   4  28.982   1.667  -1.295
   19    HB2  PRO   4           HB2      PRO   4  29.990   0.280  -3.662
   20    HB3  PRO   4           HB3      PRO   4  29.183  -0.384  -2.239
   21    HG2  PRO   4           HG2      PRO   4  28.006  -0.309  -4.677
   22    HG3  PRO   4           HG3      PRO   4  27.087  -0.180  -3.165
   23    HD2  PRO   4           HD2      PRO   4  27.948   1.983  -5.055
   24    HD3  PRO   4           HD3      PRO   4  26.398   1.776  -4.210
   25    H    GLU   5           H        GLU   5  29.581   4.238  -2.362
   26    HA   GLU   5           HA       GLU   5  32.468   4.067  -2.325
   27    HB2  GLU   5           HB2      GLU   5  30.982   5.278  -4.657
   28    HB3  GLU   5           HB3      GLU   5  32.640   5.707  -4.271
   29    HG2  GLU   5           HG2      GLU   5  33.360   3.440  -4.652
   30    HG3  GLU   5           HG3      GLU   5  31.694   2.920  -4.907
   31    H    ALA   6           H        ALA   6  29.904   5.201  -0.997
   32    HA   ALA   6           HA       ALA   6  31.130   7.639  -0.054
   33    HB1  ALA   6           HB1      ALA   6  29.007   7.689  -2.048
   34    HB2  ALA   6           HB2      ALA   6  30.069   8.983  -1.493
   35    HB3  ALA   6           HB3      ALA   6  28.604   8.596  -0.590
   36    H    ASP   7           H        ASP   7  30.081   4.961   0.803
   37    HA   ASP   7           HA       ASP   7  27.916   5.550   2.611
   38    HB2  ASP   7           HB2      ASP   7  29.625   3.150   2.048
   39    HB3  ASP   7           HB3      ASP   7  28.728   3.228   3.561
   40    HA   PRO   8           HA       PRO   8  30.054   7.120   6.158
   41    HB2  PRO   8           HB2      PRO   8  29.061   4.716   7.613
   42    HB3  PRO   8           HB3      PRO   8  28.935   6.423   8.046
   43    HG2  PRO   8           HG2      PRO   8  26.842   5.052   7.061
   44    HG3  PRO   8           HG3      PRO   8  27.094   6.769   6.705
   45    HD2  PRO   8           HD2      PRO   8  27.444   4.407   4.942
   46    HD3  PRO   8           HD3      PRO   8  27.090   6.093   4.522
   47    H    ARG   9           H        ARG   9  30.395   3.773   5.247
   48    HA   ARG   9           HA       ARG   9  32.855   3.405   6.757
   49    HE   ARG   9           HE       ARG   9  29.926  -0.495   4.730
   50    HB2  ARG   9           HB2      ARG   9  31.391   1.545   4.876
   51    HB3  ARG   9           HB3      ARG   9  32.727   1.103   5.945
   52    HG2  ARG   9           HG2      ARG   9  31.393   1.445   7.885
   53    HG3  ARG   9           HG3      ARG   9  30.096   2.176   6.937
   54    HD2  ARG   9           HD2      ARG   9  31.035  -0.687   6.729
   55    HD3  ARG   9           HD3      ARG   9  29.578  -0.142   7.563
   56   HH11  ARG   9          HH11      ARG   9  28.082   1.105   7.222
   57   HH12  ARG   9          HH12      ARG   9  26.748   1.493   6.174
   58   HH21  ARG   9          HH21      ARG   9  28.193  -0.005   3.338
   59   HH22  ARG   9          HH22      ARG   9  26.804   0.840   3.959
   60    H    LEU  10           H        LEU  10  31.800   3.806   3.420
   61    HA   LEU  10           HA       LEU  10  34.461   3.221   2.451
   62    HG   LEU  10           HG       LEU  10  31.990   1.507   2.277
   63    HB2  LEU  10           HB2      LEU  10  31.855   3.643   0.997
   64    HB3  LEU  10           HB3      LEU  10  33.377   3.235   0.222
   65   HD11  LEU  10          HD11      LEU  10  32.000   1.421  -0.721
   66   HD12  LEU  10          HD12      LEU  10  30.620   1.426   0.378
   67   HD13  LEU  10          HD13      LEU  10  31.657   0.002   0.270
   68   HD21  LEU  10          HD21      LEU  10  34.381   1.179   2.274
   69   HD22  LEU  10          HD22      LEU  10  34.386   1.015   0.518
   70   HD23  LEU  10          HD23      LEU  10  33.589  -0.201   1.515
   71    H    ILE  11           H        ILE  11  32.481   5.935   3.099
   72    HA   ILE  11           HA       ILE  11  33.984   7.755   1.411
   73    HB   ILE  11           HB       ILE  11  31.640   8.269   2.204
   74   HG12  ILE  11          HG12      ILE  11  33.797  10.257   2.947
   75   HG13  ILE  11          HG13      ILE  11  33.099  10.038   1.345
   76   HG21  ILE  11          HG21      ILE  11  31.658   9.386   4.553
   77   HG22  ILE  11          HG22      ILE  11  33.040   8.330   4.842
   78   HG23  ILE  11          HG23      ILE  11  31.475   7.637   4.415
   79   HD11  ILE  11          HD11      ILE  11  31.623  10.978   3.792
   80   HD12  ILE  11          HD12      ILE  11  30.939  10.785   2.178
   81   HD13  ILE  11          HD13      ILE  11  32.190  11.995   2.467
   82    H    GLU  12           H        GLU  12  34.362   6.022   4.248
   83    HA   GLU  12           HA       GLU  12  36.466   7.753   5.313
   84    HB2  GLU  12           HB2      GLU  12  34.682   6.618   6.779
   85    HB3  GLU  12           HB3      GLU  12  35.535   5.118   6.460
   86    HG2  GLU  12           HG2      GLU  12  36.865   7.522   7.674
   87    HG3  GLU  12           HG3      GLU  12  36.068   6.278   8.633
   88    H    SER  13           H        SER  13  36.051   4.276   4.575
   89    HA   SER  13           HA       SER  13  38.911   3.984   4.500
   90    HG   SER  13           HG       SER  13  37.698   3.197   6.318
   91    HB2  SER  13           HB2      SER  13  36.743   1.915   4.112
   92    HB3  SER  13           HB3      SER  13  38.457   1.584   4.369
   93    H    LEU  14           H        LEU  14  36.412   4.131   2.021
   94    HA   LEU  14           HA       LEU  14  38.275   3.034   0.060
   95    HG   LEU  14           HG       LEU  14  37.264   2.261  -2.029
   96    HB2  LEU  14           HB2      LEU  14  35.795   2.434   0.114
   97    HB3  LEU  14           HB3      LEU  14  35.475   4.069  -0.424
   98   HD11  LEU  14          HD11      LEU  14  35.115   1.090  -1.568
   99   HD12  LEU  14          HD12      LEU  14  35.386   1.459  -3.270
  100   HD13  LEU  14          HD13      LEU  14  34.269   2.442  -2.322
  101   HD21  LEU  14          HD21      LEU  14  37.096   4.719  -2.516
  102   HD22  LEU  14          HD22      LEU  14  35.393   4.460  -2.897
  103   HD23  LEU  14          HD23      LEU  14  36.642   3.662  -3.854
  104    H    SER  15           H        SER  15  36.578   5.957   0.954
  105    HA   SER  15           HA       SER  15  37.639   7.516  -1.153
  106    HG   SER  15           HG       SER  15  37.578  10.126   0.400
  107    HB2  SER  15           HB2      SER  15  35.571   8.145   0.047
  108    HB3  SER  15           HB3      SER  15  36.528   8.454   1.496
  109    H    GLN  16           H        GLN  16  38.940   6.332   1.744
  110    HA   GLN  16           HA       GLN  16  40.762   8.288   2.515
  111    HB2  GLN  16           HB2      GLN  16  40.258   6.153   3.739
  112    HB3  GLN  16           HB3      GLN  16  41.234   5.297   2.556
  113    HG2  GLN  16           HG2      GLN  16  42.498   7.577   3.968
  114    HG3  GLN  16           HG3      GLN  16  42.184   6.118   4.901
  115   HE21  GLN  16          HE21      GLN  16  42.590   4.949   1.926
  116   HE22  GLN  16          HE22      GLN  16  44.298   4.687   1.904
  117    H    MET  17           H        MET  17  41.198   5.614   0.193
  118    HA   MET  17           HA       MET  17  43.714   6.805  -0.660
  119    HB2  MET  17           HB2      MET  17  43.982   4.809  -2.065
  120    HB3  MET  17           HB3      MET  17  43.707   4.390  -0.383
  121    HG2  MET  17           HG2      MET  17  41.443   4.442  -2.337
  122    HG3  MET  17           HG3      MET  17  42.515   3.046  -2.224
  123    HE1  MET  17           HE1      MET  17  43.048   3.012   1.151
  124    HE2  MET  17           HE2      MET  17  43.027   1.807  -0.136
  125    HE3  MET  17           HE3      MET  17  41.948   1.639   1.248
  126    H    LEU  18           H        LEU  18  40.403   6.614  -1.641
  127    HA   LEU  18           HA       LEU  18  40.733   7.016  -4.408
  128    HG   LEU  18           HG       LEU  18  38.275   8.695  -5.077
  129    HB2  LEU  18           HB2      LEU  18  38.622   6.348  -3.201
  130    HB3  LEU  18           HB3      LEU  18  38.449   8.023  -2.714
  131   HD11  LEU  18          HD11      LEU  18  37.863   6.803  -6.724
  132   HD12  LEU  18          HD12      LEU  18  38.629   5.747  -5.537
  133   HD13  LEU  18          HD13      LEU  18  39.535   7.088  -6.239
  134   HD21  LEU  18          HD21      LEU  18  36.331   7.751  -3.555
  135   HD22  LEU  18          HD22      LEU  18  36.296   6.496  -4.794
  136   HD23  LEU  18          HD23      LEU  18  36.056   8.185  -5.242
  137    H    SER  19           H        SER  19  40.493   9.304  -1.718
  138    HA   SER  19           HA       SER  19  40.904  11.518  -3.590
  139    HG   SER  19           HG       SER  19  41.045  13.535  -2.206
  140    HB2  SER  19           HB2      SER  19  39.055  11.621  -1.884
  141    HB3  SER  19           HB3      SER  19  40.293  11.674  -0.627
  142    H    MET  20           H        MET  20  42.899   9.447  -2.225
  143    HA   MET  20           HA       MET  20  44.803  11.448  -1.215
  144    HB2  MET  20           HB2      MET  20  44.258   9.468   0.228
  145    HB3  MET  20           HB3      MET  20  44.983   8.440  -0.998
  146    HG2  MET  20           HG2      MET  20  46.565   8.793   0.758
  147    HG3  MET  20           HG3      MET  20  47.122   9.630  -0.690
  148    HE1  MET  20           HE1      MET  20  44.357  11.276   2.080
  149    HE2  MET  20           HE2      MET  20  45.672  11.271   3.254
  150    HE3  MET  20           HE3      MET  20  45.194   9.771   2.463
  151    H    GLY  21           H        GLY  21  44.317   9.031  -3.695
  152    HA2  GLY  21           HA2      GLY  21  45.461   9.344  -5.828
  153    HA3  GLY  21           HA3      GLY  21  46.866   9.893  -4.916
  154    H    PHE  22           H        PHE  22  44.745   7.087  -4.453
  155    HA   PHE  22           HA       PHE  22  47.025   5.348  -5.064
  156    HD1  PHE  22           HD1      PHE  22  48.650   4.572  -3.598
  157    HD2  PHE  22           HD2      PHE  22  45.737   6.050  -0.871
  158    HE1  PHE  22           HE1      PHE  22  50.441   5.283  -2.077
  159    HE2  PHE  22           HE2      PHE  22  47.528   6.766   0.658
  160    HZ   PHE  22           HZ       PHE  22  49.884   6.376   0.053
  161    HB2  PHE  22           HB2      PHE  22  45.035   5.054  -2.801
  162    HB3  PHE  22           HB3      PHE  22  46.057   3.734  -3.365
  163    H    SER  23           H        SER  23  45.969   2.986  -5.284
  164    HA   SER  23           HA       SER  23  43.307   2.987  -6.292
  165    HG   SER  23           HG       SER  23  43.741   4.640  -7.926
  166    HB2  SER  23           HB2      SER  23  45.541   2.498  -8.297
  167    HB3  SER  23           HB3      SER  23  43.817   2.291  -8.600
  168    H    ASP  24           H        ASP  24  42.672   0.773  -6.955
  169    HA   ASP  24           HA       ASP  24  44.175  -1.233  -5.499
  170    HB2  ASP  24           HB2      ASP  24  42.436  -2.816  -6.232
  171    HB3  ASP  24           HB3      ASP  24  41.764  -1.423  -5.404
  172    H    GLU  25           H        GLU  25  44.809  -3.222  -6.536
  173    HA   GLU  25           HA       GLU  25  46.463  -2.757  -8.768
  174    HB2  GLU  25           HB2      GLU  25  47.059  -5.068  -8.653
  175    HB3  GLU  25           HB3      GLU  25  46.844  -4.501  -7.004
  176    HG2  GLU  25           HG2      GLU  25  44.720  -5.565  -6.838
  177    HG3  GLU  25           HG3      GLU  25  44.743  -5.988  -8.549
  178    H    GLY  26           H        GLY  26  43.170  -3.592  -8.484
  179    HA2  GLY  26           HA2      GLY  26  42.210  -2.948 -10.791
  180    HA3  GLY  26           HA3      GLY  26  43.049  -4.405 -11.302
  181    H    GLY  27           H        GLY  27  41.096  -3.867  -8.316
  182    HA2  GLY  27           HA2      GLY  27  38.679  -4.590  -9.092
  183    HA3  GLY  27           HA3      GLY  27  39.464  -6.151  -9.171
  184    H    TRP  28           H        TRP  28  41.044  -5.146  -6.624
  185    HA   TRP  28           HA       TRP  28  39.113  -6.439  -4.941
  186    HD1  TRP  28           HD1      TRP  28  43.522  -6.366  -5.821
  187    HE1  TRP  28           HE1      TRP  28  45.163  -4.458  -5.312
  188    HE3  TRP  28           HE3      TRP  28  40.882  -3.971  -2.181
  189    HZ2  TRP  28           HZ2      TRP  28  45.302  -2.204  -3.609
  190    HZ3  TRP  28           HZ3      TRP  28  41.824  -1.951  -1.164
  191    HH2  TRP  28           HH2      TRP  28  43.985  -1.094  -1.858
  192    HB2  TRP  28           HB2      TRP  28  40.890  -6.497  -3.218
  193    HB3  TRP  28           HB3      TRP  28  41.368  -7.231  -4.749
  194    H    LEU  29           H        LEU  29  40.058  -3.124  -5.398
  195    HA   LEU  29           HA       LEU  29  39.716  -2.151  -2.815
  196    HG   LEU  29           HG       LEU  29  37.894   0.355  -3.559
  197    HB2  LEU  29           HB2      LEU  29  40.560  -0.691  -4.488
  198    HB3  LEU  29           HB3      LEU  29  39.103  -0.823  -5.450
  199   HD11  LEU  29          HD11      LEU  29  40.696   0.447  -2.542
  200   HD12  LEU  29          HD12      LEU  29  39.187   0.170  -1.672
  201   HD13  LEU  29          HD13      LEU  29  39.605   1.795  -2.217
  202   HD21  LEU  29          HD21      LEU  29  39.333   2.561  -4.111
  203   HD22  LEU  29          HD22      LEU  29  38.170   1.848  -5.227
  204   HD23  LEU  29          HD23      LEU  29  39.890   1.499  -5.403
  205    H    THR  30           H        THR  30  37.329  -3.415  -4.916
  206    HA   THR  30           HA       THR  30  35.136  -2.297  -3.365
  207    HB   THR  30           HB       THR  30  34.519  -2.304  -5.583
  208    HG1  THR  30           HG1      THR  30  33.669  -4.925  -4.953
  209   HG21  THR  30          HG21      THR  30  34.825  -4.299  -7.097
  210   HG22  THR  30          HG22      THR  30  35.950  -4.919  -5.888
  211   HG23  THR  30          HG23      THR  30  36.274  -3.381  -6.689
  212    H    ARG  31           H        ARG  31  36.883  -5.340  -3.733
  213    HA   ARG  31           HA       ARG  31  34.956  -6.700  -2.010
  214    HE   ARG  31           HE       ARG  31  36.873 -10.096  -5.696
  215    HB2  ARG  31           HB2      ARG  31  36.637  -8.669  -2.442
  216    HB3  ARG  31           HB3      ARG  31  35.469  -8.190  -3.664
  217    HG2  ARG  31           HG2      ARG  31  37.072  -7.231  -5.011
  218    HG3  ARG  31           HG3      ARG  31  38.199  -6.996  -3.675
  219    HD2  ARG  31           HD2      ARG  31  38.799  -8.802  -5.339
  220    HD3  ARG  31           HD3      ARG  31  38.800  -9.277  -3.644
  221   HH11  ARG  31          HH11      ARG  31  38.023 -10.291  -2.392
  222   HH12  ARG  31          HH12      ARG  31  37.099 -11.714  -2.020
  223   HH21  ARG  31          HH21      ARG  31  35.656 -11.944  -5.219
  224   HH22  ARG  31          HH22      ARG  31  35.726 -12.646  -3.627
  225    H    LEU  32           H        LEU  32  38.478  -6.143  -2.049
  226    HA   LEU  32           HA       LEU  32  39.229  -7.337   0.296
  227    HG   LEU  32           HG       LEU  32  42.531  -5.599  -0.188
  228    HB2  LEU  32           HB2      LEU  32  40.657  -6.242  -1.463
  229    HB3  LEU  32           HB3      LEU  32  40.268  -4.696  -0.740
  230   HD11  LEU  32          HD11      LEU  32  42.531  -4.903   2.075
  231   HD12  LEU  32          HD12      LEU  32  40.813  -5.263   2.253
  232   HD13  LEU  32          HD13      LEU  32  41.334  -3.928   1.223
  233   HD21  LEU  32          HD21      LEU  32  42.680  -7.735   0.343
  234   HD22  LEU  32          HD22      LEU  32  40.946  -7.863   0.644
  235   HD23  LEU  32          HD23      LEU  32  42.025  -7.294   1.920
  236    H    LEU  33           H        LEU  33  38.193  -3.945  -0.050
  237    HA   LEU  33           HA       LEU  33  38.391  -3.399   2.727
  238    HG   LEU  33           HG       LEU  33  39.535  -1.349   2.113
  239    HB2  LEU  33           HB2      LEU  33  37.083  -1.930   0.453
  240    HB3  LEU  33           HB3      LEU  33  37.005  -1.348   2.107
  241   HD11  LEU  33          HD11      LEU  33  39.059  -1.847  -0.811
  242   HD12  LEU  33          HD12      LEU  33  40.069  -2.773   0.303
  243   HD13  LEU  33          HD13      LEU  33  40.546  -1.144  -0.176
  244   HD21  LEU  33          HD21      LEU  33  39.416   0.644   0.286
  245   HD22  LEU  33          HD22      LEU  33  38.892   0.789   1.963
  246   HD23  LEU  33          HD23      LEU  33  37.712   0.453   0.696
  247    H    GLN  34           H        GLN  34  36.093  -5.148   1.030
  248    HA   GLN  34           HA       GLN  34  33.907  -4.373   2.802
  249    HB2  GLN  34           HB2      GLN  34  34.056  -5.248   0.151
  250    HB3  GLN  34           HB3      GLN  34  33.305  -6.575   1.027
  251    HG2  GLN  34           HG2      GLN  34  31.532  -5.249   0.263
  252    HG3  GLN  34           HG3      GLN  34  31.700  -4.856   1.972
  253   HE21  GLN  34          HE21      GLN  34  34.253  -3.488   0.364
  254   HE22  GLN  34          HE22      GLN  34  33.607  -1.907   0.111
  255    H    THR  35           H        THR  35  35.975  -7.134   2.062
  256    HA   THR  35           HA       THR  35  34.656  -8.912   3.873
  257    HB   THR  35           HB       THR  35  36.824 -10.264   3.490
  258    HG1  THR  35           HG1      THR  35  38.115  -9.550   1.831
  259   HG21  THR  35          HG21      THR  35  35.874 -11.266   1.732
  260   HG22  THR  35          HG22      THR  35  35.729  -9.765   0.817
  261   HG23  THR  35          HG23      THR  35  34.537 -10.165   2.054
  262    H    LYS  36           H        LYS  36  37.529  -6.869   4.027
  263    HA   LYS  36           HA       LYS  36  38.302  -7.793   6.639
  264    HB2  LYS  36           HB2      LYS  36  39.276  -5.672   4.767
  265    HB3  LYS  36           HB3      LYS  36  39.776  -5.626   6.450
  266    HG2  LYS  36           HG2      LYS  36  41.452  -6.747   5.149
  267    HG3  LYS  36           HG3      LYS  36  40.671  -7.913   6.218
  268    HD2  LYS  36           HD2      LYS  36  39.275  -8.674   4.336
  269    HD3  LYS  36           HD3      LYS  36  40.098  -7.527   3.278
  270    HE2  LYS  36           HE2      LYS  36  40.972  -9.855   3.122
  271    HE3  LYS  36           HE3      LYS  36  42.186  -8.653   3.560
  272    HZ1  LYS  36           HZ1      LYS  36  42.442  -9.521   5.616
  273    HZ2  LYS  36           HZ2      LYS  36  41.893 -10.941   4.860
  274    HZ3  LYS  36           HZ3      LYS  36  40.813  -9.988   5.766
  275    H    ASN  37           H        ASN  37  35.630  -6.900   6.606
  276    HA   ASN  37           HA       ASN  37  34.118  -5.457   7.474
  277    HB2  ASN  37           HB2      ASN  37  34.479  -4.896   9.880
  278    HB3  ASN  37           HB3      ASN  37  34.672  -6.601   9.493
  279   HD21  ASN  37          HD21      ASN  37  36.108  -3.815  10.811
  280   HD22  ASN  37          HD22      ASN  37  37.646  -4.503  11.187
  281    H    TYR  38           H        TYR  38  35.522  -4.114   5.677
  282    HA   TYR  38           HA       TYR  38  35.985  -2.064   4.887
  283    HD1  TYR  38           HD1      TYR  38  32.879  -3.072   7.127
  284    HD2  TYR  38           HD2      TYR  38  33.528  -0.424   3.862
  285    HE1  TYR  38           HE1      TYR  38  30.868  -3.950   6.025
  286    HE2  TYR  38           HE2      TYR  38  31.514  -1.290   2.756
  287    HH   TYR  38           HH       TYR  38  29.193  -3.128   4.320
  288    HB2  TYR  38           HB2      TYR  38  34.429  -1.137   7.307
  289    HB3  TYR  38           HB3      TYR  38  34.788  -0.167   5.880
  290    H    ASP  39           H        ASP  39  38.213  -2.484   5.285
  291    HA   ASP  39           HA       ASP  39  39.331  -0.671   7.329
  292    HB2  ASP  39           HB2      ASP  39  39.343  -3.180   7.909
  293    HB3  ASP  39           HB3      ASP  39  40.598  -3.317   6.685
  294    H    ILE  40           H        ILE  40  41.078   0.469   6.781
  295    HA   ILE  40           HA       ILE  40  42.159   0.175   4.080
  296    HB   ILE  40           HB       ILE  40  43.520   2.230   4.708
  297   HG12  ILE  40          HG12      ILE  40  42.872   1.902   7.221
  298   HG13  ILE  40          HG13      ILE  40  43.007   3.526   6.560
  299   HG21  ILE  40          HG21      ILE  40  40.792   3.212   4.793
  300   HG22  ILE  40          HG22      ILE  40  41.027   1.937   3.597
  301   HG23  ILE  40          HG23      ILE  40  42.025   3.390   3.547
  302   HD11  ILE  40          HD11      ILE  40  40.330   2.593   6.220
  303   HD12  ILE  40          HD12      ILE  40  40.925   3.968   7.150
  304   HD13  ILE  40          HD13      ILE  40  40.827   2.376   7.899
  305    H    GLY  41           H        GLY  41  42.646  -0.866   7.208
  306    HA2  GLY  41           HA2      GLY  41  45.443  -0.823   7.440
  307    HA3  GLY  41           HA3      GLY  41  44.379  -1.946   8.260
  308    H    ALA  42           H        ALA  42  43.268  -2.996   5.848
  309    HA   ALA  42           HA       ALA  42  45.512  -4.671   4.982
  310    HB1  ALA  42           HB1      ALA  42  42.551  -5.149   4.650
  311    HB2  ALA  42           HB2      ALA  42  43.569  -5.852   5.911
  312    HB3  ALA  42           HB3      ALA  42  43.846  -6.267   4.219
  313    H    ALA  43           H        ALA  43  43.525  -2.137   3.988
  314    HA   ALA  43           HA       ALA  43  43.550  -2.691   1.171
  315    HB1  ALA  43           HB1      ALA  43  42.284  -0.815   0.918
  316    HB2  ALA  43           HB2      ALA  43  43.145   0.073   2.176
  317    HB3  ALA  43           HB3      ALA  43  41.957  -1.157   2.618
  318    H    LEU  44           H        LEU  44  45.525  -0.808   3.393
  319    HA   LEU  44           HA       LEU  44  47.090   0.468   1.374
  320    HG   LEU  44           HG       LEU  44  47.701   2.591   2.629
  321    HB2  LEU  44           HB2      LEU  44  47.308   0.121   4.327
  322    HB3  LEU  44           HB3      LEU  44  48.761   0.560   3.442
  323   HD11  LEU  44          HD11      LEU  44  45.273   1.446   3.957
  324   HD12  LEU  44          HD12      LEU  44  45.455   2.101   2.326
  325   HD13  LEU  44          HD13      LEU  44  45.452   3.188   3.716
  326   HD21  LEU  44          HD21      LEU  44  48.158   3.708   4.505
  327   HD22  LEU  44          HD22      LEU  44  48.528   2.125   5.186
  328   HD23  LEU  44          HD23      LEU  44  46.936   2.844   5.435
  329    H    ASP  45           H        ASP  45  47.230  -2.548   3.084
  330    HA   ASP  45           HA       ASP  45  49.844  -3.362   2.440
  331    HB2  ASP  45           HB2      ASP  45  48.576  -4.535   4.123
  332    HB3  ASP  45           HB3      ASP  45  47.316  -4.939   2.962
  333    H    THR  46           H        THR  46  46.855  -3.397   0.619
  334    HA   THR  46           HA       THR  46  48.080  -5.056  -1.415
  335    HB   THR  46           HB       THR  46  45.730  -5.012  -2.397
  336    HG1  THR  46           HG1      THR  46  44.557  -3.506  -1.515
  337   HG21  THR  46          HG21      THR  46  45.062  -6.786  -1.150
  338   HG22  THR  46          HG22      THR  46  45.526  -6.033   0.374
  339   HG23  THR  46          HG23      THR  46  46.761  -6.722  -0.677
  340    H    ILE  47           H        ILE  47  46.908  -1.688  -1.129
  341    HA   ILE  47           HA       ILE  47  46.601  -1.251  -3.869
  342    HB   ILE  47           HB       ILE  47  47.182   1.230  -3.250
  343   HG12  ILE  47          HG12      ILE  47  46.841  -0.013  -0.516
  344   HG13  ILE  47          HG13      ILE  47  48.287   0.775  -1.139
  345   HG21  ILE  47          HG21      ILE  47  44.837  -0.207  -3.293
  346   HG22  ILE  47          HG22      ILE  47  44.993   1.548  -3.212
  347   HG23  ILE  47          HG23      ILE  47  44.796   0.616  -1.730
  348   HD11  ILE  47          HD11      ILE  47  45.776   2.341  -1.088
  349   HD12  ILE  47          HD12      ILE  47  47.445   2.860  -0.837
  350   HD13  ILE  47          HD13      ILE  47  46.580   2.012   0.447
  351    H    GLN  48           H        GLN  48  49.517  -0.911  -1.909
  352    HA   GLN  48           HA       GLN  48  51.207  -1.112  -4.199
  353    HB2  GLN  48           HB2      GLN  48  50.794   1.594  -2.955
  354    HB3  GLN  48           HB3      GLN  48  52.386   1.162  -3.555
  355    HG2  GLN  48           HG2      GLN  48  51.763   1.811  -5.572
  356    HG3  GLN  48           HG3      GLN  48  50.572   0.513  -5.601
  357   HE21  GLN  48          HE21      GLN  48  48.550   1.099  -5.907
  358   HE22  GLN  48          HE22      GLN  48  47.868   2.656  -5.577
  359    H    TYR  49           H        TYR  49  50.799  -0.316  -0.816
  360    HA   TYR  49           HA       TYR  49  53.520  -0.786  -0.070
  361    HD1  TYR  49           HD1      TYR  49  54.072   1.327   0.974
  362    HD2  TYR  49           HD2      TYR  49  49.859   1.252   1.552
  363    HE1  TYR  49           HE1      TYR  49  54.003   3.772   0.749
  364    HE2  TYR  49           HE2      TYR  49  49.779   3.699   1.331
  365    HH   TYR  49           HH       TYR  49  52.159   5.502   0.024
  366    HB2  TYR  49           HB2      TYR  49  51.012  -0.725   1.636
  367    HB3  TYR  49           HB3      TYR  49  52.666  -0.627   2.238
  368    H    SER  50           H        SER  50  53.531  -2.451   2.044
  369    HA   SER  50           HA       SER  50  52.145  -4.903   1.402
  370    HG   SER  50           HG       SER  50  56.100  -5.149   1.552
  371    HB2  SER  50           HB2      SER  50  54.315  -6.220   1.328
  372    HB3  SER  50           HB3      SER  50  53.982  -5.219  -0.086
  373    H    LYS  51           H        LYS  51  52.713  -2.865   3.617
  374    HA   LYS  51           HA       LYS  51  52.730  -4.829   5.741
  375    HB2  LYS  51           HB2      LYS  51  54.438  -3.623   7.056
  376    HB3  LYS  51           HB3      LYS  51  55.112  -4.276   5.568
  377    HG2  LYS  51           HG2      LYS  51  55.045  -2.098   4.528
  378    HG3  LYS  51           HG3      LYS  51  54.237  -1.418   5.939
  379    HD2  LYS  51           HD2      LYS  51  56.465  -0.771   6.204
  380    HD3  LYS  51           HD3      LYS  51  56.311  -2.179   7.254
  381    HE2  LYS  51           HE2      LYS  51  57.321  -2.371   4.424
  382    HE3  LYS  51           HE3      LYS  51  58.391  -2.038   5.783
  383    HZ1  LYS  51           HZ1      LYS  51  58.485  -4.337   5.457
  384    HZ2  LYS  51           HZ2      LYS  51  56.809  -4.491   5.253
  385    HZ3  LYS  51           HZ3      LYS  51  57.453  -4.150   6.792
  386    H    HIS  52           H        HIS  52  52.022  -3.823   7.804
  387    HA   HIS  52           HA       HIS  52  50.975  -1.135   7.544
  388    HD1  HIS  52           HD1      HIS  52  48.897   0.235   7.167
  389    HD2  HIS  52           HD2      HIS  52  47.240  -2.374   9.947
  390    HE1  HIS  52           HE1      HIS  52  47.156   1.565   8.433
  391    HB2  HIS  52           HB2      HIS  52  49.118  -2.631   6.797
  392    HB3  HIS  52           HB3      HIS  52  49.145  -3.395   8.384
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  18.378   5.143  -2.540
    2    H2   GLY   1           2H       GLY   1  19.696   4.499  -3.387
    3    H3   GLY   1           3H       GLY   1  19.308   6.140  -3.552
    4    HA2  GLY   1           HA2      GLY   1  19.826   6.506  -1.206
    5    HA3  GLY   1           HA3      GLY   1  20.285   4.812  -1.085
    6    H    SER   2           H        SER   2  22.210   6.396  -0.324
    7    HA   SER   2           HA       SER   2  23.825   7.467  -2.398
    8    HG   SER   2           HG       SER   2  23.770   8.508   1.022
    9    HB2  SER   2           HB2      SER   2  24.593   6.669   0.423
   10    HB3  SER   2           HB3      SER   2  25.561   7.674  -0.656
   11    HA   PRO   3           HA       PRO   3  25.601   3.652  -3.884
   12    HB2  PRO   3           HB2      PRO   3  27.596   5.381  -5.172
   13    HB3  PRO   3           HB3      PRO   3  26.394   4.324  -5.913
   14    HG2  PRO   3           HG2      PRO   3  26.207   7.015  -6.020
   15    HG3  PRO   3           HG3      PRO   3  24.778   5.968  -5.954
   16    HD2  PRO   3           HD2      PRO   3  26.077   7.550  -3.768
   17    HD3  PRO   3           HD3      PRO   3  24.351   7.305  -4.112
   18    HA   PRO   4           HA       PRO   4  29.139   2.988  -1.295
   19    HB2  PRO   4           HB2      PRO   4  30.390   1.244  -3.268
   20    HB3  PRO   4           HB3      PRO   4  29.632   0.823  -1.732
   21    HG2  PRO   4           HG2      PRO   4  28.546   0.166  -4.127
   22    HG3  PRO   4           HG3      PRO   4  27.565   0.501  -2.689
   23    HD2  PRO   4           HD2      PRO   4  28.186   2.285  -5.018
   24    HD3  PRO   4           HD3      PRO   4  26.648   2.043  -4.160
   25    H    GLU   5           H        GLU   5  29.345   5.277  -3.044
   26    HA   GLU   5           HA       GLU   5  32.265   5.360  -3.391
   27    HB2  GLU   5           HB2      GLU   5  30.241   6.885  -5.045
   28    HB3  GLU   5           HB3      GLU   5  31.987   6.919  -5.241
   29    HG2  GLU   5           HG2      GLU   5  30.304   4.454  -5.601
   30    HG3  GLU   5           HG3      GLU   5  30.773   5.535  -6.912
   31    H    ALA   6           H        ALA   6  29.939   6.172  -1.474
   32    HA   ALA   6           HA       ALA   6  31.232   8.277  -0.138
   33    HB1  ALA   6           HB1      ALA   6  30.560   9.796  -1.816
   34    HB2  ALA   6           HB2      ALA   6  29.414  10.017  -0.494
   35    HB3  ALA   6           HB3      ALA   6  28.945   9.091  -1.918
   36    H    ASP   7           H        ASP   7  30.084   5.771   0.346
   37    HA   ASP   7           HA       ASP   7  27.659   6.258   1.905
   38    HB2  ASP   7           HB2      ASP   7  27.767   4.243   0.474
   39    HB3  ASP   7           HB3      ASP   7  29.217   3.716   1.320
   40    HA   PRO   8           HA       PRO   8  29.704   6.988   5.792
   41    HB2  PRO   8           HB2      PRO   8  28.048   4.676   6.730
   42    HB3  PRO   8           HB3      PRO   8  28.315   6.248   7.491
   43    HG2  PRO   8           HG2      PRO   8  26.064   5.729   6.146
   44    HG3  PRO   8           HG3      PRO   8  26.822   7.331   6.098
   45    HD2  PRO   8           HD2      PRO   8  26.673   5.255   3.991
   46    HD3  PRO   8           HD3      PRO   8  26.889   7.009   3.838
   47    H    ARG   9           H        ARG   9  29.600   3.776   4.435
   48    HA   ARG   9           HA       ARG   9  31.656   2.743   6.200
   49    HE   ARG   9           HE       ARG   9  27.258  -0.924   6.429
   50    HB2  ARG   9           HB2      ARG   9  30.320   1.505   3.787
   51    HB3  ARG   9           HB3      ARG   9  31.333   0.660   4.962
   52    HG2  ARG   9           HG2      ARG   9  29.735   0.902   6.671
   53    HG3  ARG   9           HG3      ARG   9  28.826   2.108   5.759
   54    HD2  ARG   9           HD2      ARG   9  28.268   0.367   4.093
   55    HD3  ARG   9           HD3      ARG   9  29.101  -0.823   5.093
   56   HH11  ARG   9          HH11      ARG   9  27.079   2.023   4.528
   57   HH12  ARG   9          HH12      ARG   9  25.546   2.502   5.201
   58   HH21  ARG   9          HH21      ARG   9  25.260  -0.273   7.311
   59   HH22  ARG   9          HH22      ARG   9  24.514   1.198   6.763
   60    H    LEU  10           H        LEU  10  31.358   3.518   2.718
   61    HA   LEU  10           HA       LEU  10  34.192   2.983   2.405
   62    HG   LEU  10           HG       LEU  10  32.103   1.095   1.442
   63    HB2  LEU  10           HB2      LEU  10  31.962   3.335   0.420
   64    HB3  LEU  10           HB3      LEU  10  33.650   3.219  -0.054
   65   HD11  LEU  10          HD11      LEU  10  33.183   0.356  -1.124
   66   HD12  LEU  10          HD12      LEU  10  32.062   1.710  -1.266
   67   HD13  LEU  10          HD13      LEU  10  31.539   0.206  -0.508
   68   HD21  LEU  10          HD21      LEU  10  34.338   0.901   2.130
   69   HD22  LEU  10          HD22      LEU  10  34.954   1.279   0.522
   70   HD23  LEU  10          HD23      LEU  10  34.160  -0.267   0.820
   71    H    ILE  11           H        ILE  11  32.183   5.657   2.868
   72    HA   ILE  11           HA       ILE  11  33.659   7.553   1.310
   73    HB   ILE  11           HB       ILE  11  31.330   7.946   2.195
   74   HG12  ILE  11          HG12      ILE  11  33.411  10.015   2.926
   75   HG13  ILE  11          HG13      ILE  11  32.682   9.798   1.335
   76   HG21  ILE  11          HG21      ILE  11  32.811   8.216   4.796
   77   HG22  ILE  11          HG22      ILE  11  31.448   7.160   4.420
   78   HG23  ILE  11          HG23      ILE  11  31.212   8.906   4.519
   79   HD11  ILE  11          HD11      ILE  11  31.720  11.262   3.629
   80   HD12  ILE  11          HD12      ILE  11  30.524  10.103   3.048
   81   HD13  ILE  11          HD13      ILE  11  31.184  11.313   1.948
   82    H    GLU  12           H        GLU  12  34.046   5.978   4.332
   83    HA   GLU  12           HA       GLU  12  36.271   7.727   5.079
   84    HB2  GLU  12           HB2      GLU  12  34.994   5.471   6.634
   85    HB3  GLU  12           HB3      GLU  12  36.261   6.541   7.225
   86    HG2  GLU  12           HG2      GLU  12  34.691   8.457   6.823
   87    HG3  GLU  12           HG3      GLU  12  33.432   7.261   6.516
   88    H    SER  13           H        SER  13  35.572   4.375   4.186
   89    HA   SER  13           HA       SER  13  38.364   3.680   4.559
   90    HG   SER  13           HG       SER  13  36.668   1.273   6.134
   91    HB2  SER  13           HB2      SER  13  36.027   1.924   3.784
   92    HB3  SER  13           HB3      SER  13  37.640   1.367   4.232
   93    H    LEU  14           H        LEU  14  36.147   4.081   1.815
   94    HA   LEU  14           HA       LEU  14  38.196   3.020   0.021
   95    HG   LEU  14           HG       LEU  14  37.420   2.584  -2.290
   96    HB2  LEU  14           HB2      LEU  14  35.791   2.340  -0.215
   97    HB3  LEU  14           HB3      LEU  14  35.401   3.999  -0.607
   98   HD11  LEU  14          HD11      LEU  14  35.846   1.422  -3.540
   99   HD12  LEU  14          HD12      LEU  14  34.496   2.339  -2.874
  100   HD13  LEU  14          HD13      LEU  14  35.317   1.134  -1.881
  101   HD21  LEU  14          HD21      LEU  14  35.362   4.114  -3.608
  102   HD22  LEU  14          HD22      LEU  14  37.111   4.339  -3.626
  103   HD23  LEU  14          HD23      LEU  14  36.144   5.064  -2.343
  104    H    SER  15           H        SER  15  36.212   5.855   0.566
  105    HA   SER  15           HA       SER  15  37.337   7.462  -1.382
  106    HG   SER  15           HG       SER  15  36.479  10.246   0.499
  107    HB2  SER  15           HB2      SER  15  35.204   7.993  -0.314
  108    HB3  SER  15           HB3      SER  15  36.040   8.321   1.207
  109    H    GLN  16           H        GLN  16  38.412   6.763   1.867
  110    HA   GLN  16           HA       GLN  16  40.228   8.835   2.290
  111    HB2  GLN  16           HB2      GLN  16  39.733   7.228   4.042
  112    HB3  GLN  16           HB3      GLN  16  40.408   5.918   3.086
  113    HG2  GLN  16           HG2      GLN  16  42.158   8.214   3.802
  114    HG3  GLN  16           HG3      GLN  16  41.763   7.024   5.040
  115   HE21  GLN  16          HE21      GLN  16  43.985   7.818   2.757
  116   HE22  GLN  16          HE22      GLN  16  44.664   6.258   2.442
  117    H    MET  17           H        MET  17  40.820   5.656   0.807
  118    HA   MET  17           HA       MET  17  43.462   6.280   0.050
  119    HB2  MET  17           HB2      MET  17  41.563   4.119  -0.859
  120    HB3  MET  17           HB3      MET  17  43.245   4.213  -1.366
  121    HG2  MET  17           HG2      MET  17  43.979   3.992   0.936
  122    HG3  MET  17           HG3      MET  17  42.305   3.974   1.488
  123    HE1  MET  17           HE1      MET  17  40.973   0.597   0.153
  124    HE2  MET  17           HE2      MET  17  40.906   2.105  -0.762
  125    HE3  MET  17           HE3      MET  17  40.612   2.115   0.978
  126    H    LEU  18           H        LEU  18  40.358   6.422  -1.688
  127    HA   LEU  18           HA       LEU  18  41.517   6.887  -4.222
  128    HG   LEU  18           HG       LEU  18  38.091   5.874  -4.940
  129    HB2  LEU  18           HB2      LEU  18  38.815   7.200  -3.050
  130    HB3  LEU  18           HB3      LEU  18  39.141   8.070  -4.537
  131   HD11  LEU  18          HD11      LEU  18  39.360   6.683  -6.741
  132   HD12  LEU  18          HD12      LEU  18  39.874   5.009  -6.527
  133   HD13  LEU  18          HD13      LEU  18  40.887   6.326  -5.934
  134   HD21  LEU  18          HD21      LEU  18  39.111   3.830  -4.417
  135   HD22  LEU  18          HD22      LEU  18  39.277   4.794  -2.949
  136   HD23  LEU  18          HD23      LEU  18  40.652   4.598  -4.035
  137    H    SER  19           H        SER  19  40.756   9.110  -1.619
  138    HA   SER  19           HA       SER  19  41.240  11.424  -3.300
  139    HG   SER  19           HG       SER  19  40.011  10.200  -0.130
  140    HB2  SER  19           HB2      SER  19  40.936  12.686  -1.123
  141    HB3  SER  19           HB3      SER  19  39.549  11.735  -1.654
  142    H    MET  20           H        MET  20  42.923   9.638  -0.765
  143    HA   MET  20           HA       MET  20  44.994  11.532  -0.390
  144    HB2  MET  20           HB2      MET  20  44.364   9.751   1.246
  145    HB3  MET  20           HB3      MET  20  45.093   8.563   0.174
  146    HG2  MET  20           HG2      MET  20  46.569   9.184   2.024
  147    HG3  MET  20           HG3      MET  20  47.262   9.584   0.450
  148    HE1  MET  20           HE1      MET  20  48.281  11.694   3.465
  149    HE2  MET  20           HE2      MET  20  48.981  12.182   1.920
  150    HE3  MET  20           HE3      MET  20  48.744  10.472   2.279
  151    H    GLY  21           H        GLY  21  44.509   9.039  -2.754
  152    HA2  GLY  21           HA2      GLY  21  45.791   9.325  -4.829
  153    HA3  GLY  21           HA3      GLY  21  47.201   9.640  -3.819
  154    H    PHE  22           H        PHE  22  44.827   7.131  -3.249
  155    HA   PHE  22           HA       PHE  22  46.825   5.093  -3.956
  156    HD1  PHE  22           HD1      PHE  22  46.127   7.005  -1.146
  157    HD2  PHE  22           HD2      PHE  22  47.095   2.864  -1.021
  158    HE1  PHE  22           HE1      PHE  22  47.735   7.437   0.665
  159    HE2  PHE  22           HE2      PHE  22  48.707   3.290   0.783
  160    HZ   PHE  22           HZ       PHE  22  49.028   5.576   1.630
  161    HB2  PHE  22           HB2      PHE  22  44.543   4.954  -1.957
  162    HB3  PHE  22           HB3      PHE  22  45.489   3.560  -2.468
  163    H    SER  23           H        SER  23  45.274   2.935  -4.360
  164    HA   SER  23           HA       SER  23  42.923   3.707  -5.854
  165    HG   SER  23           HG       SER  23  44.913   4.389  -8.580
  166    HB2  SER  23           HB2      SER  23  45.174   2.271  -7.298
  167    HB3  SER  23           HB3      SER  23  43.631   2.772  -7.986
  168    H    ASP  24           H        ASP  24  43.080   1.176  -7.395
  169    HA   ASP  24           HA       ASP  24  42.981  -0.814  -5.247
  170    HB2  ASP  24           HB2      ASP  24  41.170  -1.995  -6.419
  171    HB3  ASP  24           HB3      ASP  24  40.672  -0.376  -5.936
  172    H    GLU  25           H        GLU  25  44.253  -2.591  -5.643
  173    HA   GLU  25           HA       GLU  25  45.370  -2.739  -8.375
  174    HB2  GLU  25           HB2      GLU  25  46.900  -2.136  -6.362
  175    HB3  GLU  25           HB3      GLU  25  46.790  -3.848  -5.971
  176    HG2  GLU  25           HG2      GLU  25  47.595  -4.337  -8.291
  177    HG3  GLU  25           HG3      GLU  25  47.889  -2.609  -8.478
  178    H    GLY  26           H        GLY  26  43.322  -4.067  -8.661
  179    HA2  GLY  26           HA2      GLY  26  43.565  -6.500  -9.450
  180    HA3  GLY  26           HA3      GLY  26  43.743  -6.835  -7.732
  181    H    GLY  27           H        GLY  27  41.596  -4.307  -8.113
  182    HA2  GLY  27           HA2      GLY  27  39.285  -4.173  -8.226
  183    HA3  GLY  27           HA3      GLY  27  39.245  -5.866  -8.699
  184    H    TRP  28           H        TRP  28  41.140  -5.491  -5.984
  185    HA   TRP  28           HA       TRP  28  39.196  -6.824  -4.355
  186    HD1  TRP  28           HD1      TRP  28  43.584  -6.564  -5.330
  187    HE1  TRP  28           HE1      TRP  28  45.148  -4.569  -4.883
  188    HE3  TRP  28           HE3      TRP  28  40.955  -4.271  -1.592
  189    HZ2  TRP  28           HZ2      TRP  28  45.239  -2.329  -3.186
  190    HZ3  TRP  28           HZ3      TRP  28  41.850  -2.204  -0.618
  191    HH2  TRP  28           HH2      TRP  28  43.951  -1.254  -1.402
  192    HB2  TRP  28           HB2      TRP  28  41.018  -6.809  -2.627
  193    HB3  TRP  28           HB3      TRP  28  41.490  -7.540  -4.163
  194    H    LEU  29           H        LEU  29  39.850  -3.558  -4.946
  195    HA   LEU  29           HA       LEU  29  39.785  -2.432  -2.429
  196    HG   LEU  29           HG       LEU  29  37.497  -0.228  -3.468
  197    HB2  LEU  29           HB2      LEU  29  40.344  -0.976  -4.116
  198    HB3  LEU  29           HB3      LEU  29  38.989  -1.430  -5.127
  199   HD11  LEU  29          HD11      LEU  29  38.791  -0.127  -1.519
  200   HD12  LEU  29          HD12      LEU  29  38.747   1.527  -2.130
  201   HD13  LEU  29          HD13      LEU  29  40.184   0.533  -2.373
  202   HD21  LEU  29          HD21      LEU  29  37.726   1.762  -4.579
  203   HD22  LEU  29          HD22      LEU  29  38.591   0.679  -5.668
  204   HD23  LEU  29          HD23      LEU  29  39.488   1.706  -4.549
  205    H    THR  30           H        THR  30  37.196  -3.887  -4.163
  206    HA   THR  30           HA       THR  30  35.292  -3.014  -2.115
  207    HB   THR  30           HB       THR  30  33.655  -4.357  -3.537
  208    HG1  THR  30           HG1      THR  30  34.416  -5.364  -5.195
  209   HG21  THR  30          HG21      THR  30  34.988  -1.858  -4.465
  210   HG22  THR  30          HG22      THR  30  33.357  -2.100  -3.843
  211   HG23  THR  30          HG23      THR  30  33.766  -2.630  -5.475
  212    H    ARG  31           H        ARG  31  36.669  -5.933  -3.573
  213    HA   ARG  31           HA       ARG  31  35.490  -7.908  -2.021
  214    HE   ARG  31           HE       ARG  31  36.808 -10.578  -5.140
  215    HB2  ARG  31           HB2      ARG  31  38.372  -8.138  -2.850
  216    HB3  ARG  31           HB3      ARG  31  37.132  -9.380  -2.825
  217    HG2  ARG  31           HG2      ARG  31  37.066  -7.071  -4.755
  218    HG3  ARG  31           HG3      ARG  31  37.902  -8.581  -5.092
  219    HD2  ARG  31           HD2      ARG  31  35.013  -8.536  -4.282
  220    HD3  ARG  31           HD3      ARG  31  35.515  -8.299  -5.961
  221   HH11  ARG  31          HH11      ARG  31  33.479  -9.545  -5.261
  222   HH12  ARG  31          HH12      ARG  31  32.867 -11.118  -5.666
  223   HH21  ARG  31          HH21      ARG  31  36.016 -12.662  -5.671
  224   HH22  ARG  31          HH22      ARG  31  34.307 -12.891  -5.877
  225    H    LEU  32           H        LEU  32  38.729  -6.579  -1.560
  226    HA   LEU  32           HA       LEU  32  39.443  -7.878   0.762
  227    HG   LEU  32           HG       LEU  32  42.571  -5.809   0.596
  228    HB2  LEU  32           HB2      LEU  32  40.842  -6.503  -0.853
  229    HB3  LEU  32           HB3      LEU  32  40.267  -5.077  -0.015
  230   HD11  LEU  32          HD11      LEU  32  40.415  -5.120   2.382
  231   HD12  LEU  32          HD12      LEU  32  42.088  -4.560   2.354
  232   HD13  LEU  32          HD13      LEU  32  41.669  -6.048   3.205
  233   HD21  LEU  32          HD21      LEU  32  41.105  -8.264   1.279
  234   HD22  LEU  32          HD22      LEU  32  42.341  -7.744   2.425
  235   HD23  LEU  32          HD23      LEU  32  42.767  -8.035   0.738
  236    H    LEU  33           H        LEU  33  38.348  -4.492   0.547
  237    HA   LEU  33           HA       LEU  33  38.212  -4.019   3.270
  238    HG   LEU  33           HG       LEU  33  38.920  -1.739   2.839
  239    HB2  LEU  33           HB2      LEU  33  36.806  -2.760   0.939
  240    HB3  LEU  33           HB3      LEU  33  36.462  -2.239   2.579
  241   HD11  LEU  33          HD11      LEU  33  39.919  -3.042   1.140
  242   HD12  LEU  33          HD12      LEU  33  40.123  -1.356   0.662
  243   HD13  LEU  33          HD13      LEU  33  38.879  -2.348  -0.103
  244   HD21  LEU  33          HD21      LEU  33  37.287  -0.298   0.767
  245   HD22  LEU  33          HD22      LEU  33  38.796   0.324   1.436
  246   HD23  LEU  33          HD23      LEU  33  37.406   0.057   2.491
  247    H    GLN  34           H        GLN  34  35.634  -5.131   1.097
  248    HA   GLN  34           HA       GLN  34  33.471  -5.113   2.796
  249    HB2  GLN  34           HB2      GLN  34  34.120  -6.227   0.319
  250    HB3  GLN  34           HB3      GLN  34  33.520  -7.572   1.282
  251    HG2  GLN  34           HG2      GLN  34  31.538  -6.889   0.482
  252    HG3  GLN  34           HG3      GLN  34  31.629  -5.749   1.828
  253   HE21  GLN  34          HE21      GLN  34  31.562  -3.642   1.383
  254   HE22  GLN  34          HE22      GLN  34  31.654  -2.954  -0.200
  255    H    THR  35           H        THR  35  35.866  -7.702   2.417
  256    HA   THR  35           HA       THR  35  34.715  -9.431   4.328
  257    HB   THR  35           HB       THR  35  37.617  -9.339   3.486
  258    HG1  THR  35           HG1      THR  35  36.511  -9.427   1.596
  259   HG21  THR  35          HG21      THR  35  37.506 -10.989   5.095
  260   HG22  THR  35          HG22      THR  35  37.217 -11.890   3.605
  261   HG23  THR  35          HG23      THR  35  35.865 -11.457   4.653
  262    H    LYS  36           H        LYS  36  37.400  -7.118   4.534
  263    HA   LYS  36           HA       LYS  36  37.808  -7.638   7.342
  264    HB2  LYS  36           HB2      LYS  36  39.055  -5.802   5.326
  265    HB3  LYS  36           HB3      LYS  36  39.339  -5.535   7.037
  266    HG2  LYS  36           HG2      LYS  36  41.150  -6.806   6.124
  267    HG3  LYS  36           HG3      LYS  36  40.226  -7.831   7.221
  268    HD2  LYS  36           HD2      LYS  36  39.102  -8.863   5.305
  269    HD3  LYS  36           HD3      LYS  36  40.013  -7.825   4.206
  270    HE2  LYS  36           HE2      LYS  36  40.943 -10.123   4.430
  271    HE3  LYS  36           HE3      LYS  36  42.079  -8.843   4.854
  272    HZ1  LYS  36           HZ1      LYS  36  42.022 -10.789   6.409
  273    HZ2  LYS  36           HZ2      LYS  36  40.459 -10.306   6.873
  274    HZ3  LYS  36           HZ3      LYS  36  41.788  -9.279   7.150
  275    H    ASN  37           H        ASN  37  35.174  -6.780   6.746
  276    HA   ASN  37           HA       ASN  37  33.577  -5.209   7.154
  277    HB2  ASN  37           HB2      ASN  37  33.619  -4.362   9.535
  278    HB3  ASN  37           HB3      ASN  37  33.691  -6.108   9.335
  279   HD21  ASN  37          HD21      ASN  37  35.176  -3.346  10.629
  280   HD22  ASN  37          HD22      ASN  37  36.590  -4.113  11.273
  281    H    TYR  38           H        TYR  38  35.173  -4.037   5.455
  282    HA   TYR  38           HA       TYR  38  35.745  -2.049   4.550
  283    HD1  TYR  38           HD1      TYR  38  34.027  -0.864   3.090
  284    HD2  TYR  38           HD2      TYR  38  31.986  -2.112   6.608
  285    HE1  TYR  38           HE1      TYR  38  32.128  -1.599   1.721
  286    HE2  TYR  38           HE2      TYR  38  30.078  -2.848   5.243
  287    HH   TYR  38           HH       TYR  38  29.105  -2.371   3.008
  288    HB2  TYR  38           HB2      TYR  38  34.033  -0.998   6.812
  289    HB3  TYR  38           HB3      TYR  38  34.617  -0.013   5.469
  290    H    ASP  39           H        ASP  39  37.903  -2.794   5.392
  291    HA   ASP  39           HA       ASP  39  38.952  -0.801   7.317
  292    HB2  ASP  39           HB2      ASP  39  38.921  -3.244   8.044
  293    HB3  ASP  39           HB3      ASP  39  40.177  -3.509   6.839
  294    H    ILE  40           H        ILE  40  40.723   0.314   6.833
  295    HA   ILE  40           HA       ILE  40  41.902  -0.029   4.184
  296    HB   ILE  40           HB       ILE  40  43.192   2.076   4.818
  297   HG12  ILE  40          HG12      ILE  40  42.371   1.738   7.319
  298   HG13  ILE  40          HG13      ILE  40  42.637   3.346   6.657
  299   HG21  ILE  40          HG21      ILE  40  41.386   3.516   4.132
  300   HG22  ILE  40          HG22      ILE  40  40.199   2.297   4.591
  301   HG23  ILE  40          HG23      ILE  40  41.303   1.991   3.248
  302   HD11  ILE  40          HD11      ILE  40  40.195   3.455   6.148
  303   HD12  ILE  40          HD12      ILE  40  40.587   3.376   7.866
  304   HD13  ILE  40          HD13      ILE  40  40.002   1.940   7.029
  305    H    GLY  41           H        GLY  41  42.344  -0.995   7.343
  306    HA2  GLY  41           HA2      GLY  41  45.104  -0.808   7.693
  307    HA3  GLY  41           HA3      GLY  41  44.078  -2.004   8.458
  308    H    ALA  42           H        ALA  42  43.187  -3.224   6.092
  309    HA   ALA  42           HA       ALA  42  45.627  -4.626   5.277
  310    HB1  ALA  42           HB1      ALA  42  44.427  -6.545   5.056
  311    HB2  ALA  42           HB2      ALA  42  42.982  -5.701   4.500
  312    HB3  ALA  42           HB3      ALA  42  43.379  -5.733   6.219
  313    H    ALA  43           H        ALA  43  43.323  -2.397   4.220
  314    HA   ALA  43           HA       ALA  43  43.308  -2.984   1.439
  315    HB1  ALA  43           HB1      ALA  43  41.735  -1.457   2.842
  316    HB2  ALA  43           HB2      ALA  43  42.087  -1.052   1.161
  317    HB3  ALA  43           HB3      ALA  43  42.922  -0.208   2.463
  318    H    LEU  44           H        LEU  44  45.133  -0.567   3.340
  319    HA   LEU  44           HA       LEU  44  46.646   0.450   1.201
  320    HG   LEU  44           HG       LEU  44  46.823   2.673   2.232
  321    HB2  LEU  44           HB2      LEU  44  47.063   0.360   4.167
  322    HB3  LEU  44           HB3      LEU  44  48.362   0.918   3.127
  323   HD11  LEU  44          HD11      LEU  44  44.970   1.379   4.168
  324   HD12  LEU  44          HD12      LEU  44  44.655   2.033   2.560
  325   HD13  LEU  44          HD13      LEU  44  44.876   3.124   3.926
  326   HD21  LEU  44          HD21      LEU  44  47.519   4.103   3.811
  327   HD22  LEU  44          HD22      LEU  44  48.342   2.691   4.474
  328   HD23  LEU  44          HD23      LEU  44  46.776   3.184   5.120
  329    H    ASP  45           H        ASP  45  46.968  -2.426   3.094
  330    HA   ASP  45           HA       ASP  45  49.667  -3.036   2.573
  331    HB2  ASP  45           HB2      ASP  45  48.322  -4.073   4.363
  332    HB3  ASP  45           HB3      ASP  45  47.346  -4.892   3.150
  333    H    THR  46           H        THR  46  46.727  -3.626   0.717
  334    HA   THR  46           HA       THR  46  48.150  -5.442  -1.031
  335    HB   THR  46           HB       THR  46  45.786  -5.583  -2.097
  336    HG1  THR  46           HG1      THR  46  44.670  -3.962  -1.219
  337   HG21  THR  46          HG21      THR  46  45.520  -7.449  -0.931
  338   HG22  THR  46          HG22      THR  46  45.417  -6.572   0.598
  339   HG23  THR  46          HG23      THR  46  46.994  -7.001  -0.071
  340    H    ILE  47           H        ILE  47  47.708  -2.088  -1.132
  341    HA   ILE  47           HA       ILE  47  47.589  -2.137  -4.080
  342    HB   ILE  47           HB       ILE  47  47.596   0.528  -3.386
  343   HG12  ILE  47          HG12      ILE  47  45.956  -1.014  -1.371
  344   HG13  ILE  47          HG13      ILE  47  47.279   0.104  -1.043
  345   HG21  ILE  47          HG21      ILE  47  45.892  -1.327  -4.668
  346   HG22  ILE  47          HG22      ILE  47  45.939   0.426  -4.832
  347   HG23  ILE  47          HG23      ILE  47  44.893  -0.315  -3.620
  348   HD11  ILE  47          HD11      ILE  47  44.747   0.804  -0.811
  349   HD12  ILE  47          HD12      ILE  47  44.936   1.135  -2.534
  350   HD13  ILE  47          HD13      ILE  47  45.982   1.936  -1.359
  351    H    GLN  48           H        GLN  48  49.670  -1.275  -1.428
  352    HA   GLN  48           HA       GLN  48  51.905  -0.989  -3.238
  353    HB2  GLN  48           HB2      GLN  48  51.013   1.351  -1.529
  354    HB3  GLN  48           HB3      GLN  48  52.615   1.218  -2.232
  355    HG2  GLN  48           HG2      GLN  48  51.840   2.276  -4.010
  356    HG3  GLN  48           HG3      GLN  48  50.859   0.850  -4.365
  357   HE21  GLN  48          HE21      GLN  48  48.840   1.375  -4.789
  358   HE22  GLN  48          HE22      GLN  48  47.921   2.617  -4.003
  359    H    TYR  49           H        TYR  49  50.759  -0.443   0.054
  360    HA   TYR  49           HA       TYR  49  53.333  -0.960   1.173
  361    HD1  TYR  49           HD1      TYR  49  54.017   1.033   2.125
  362    HD2  TYR  49           HD2      TYR  49  49.801   1.566   2.220
  363    HE1  TYR  49           HE1      TYR  49  54.319   3.438   1.744
  364    HE2  TYR  49           HE2      TYR  49  50.091   3.976   1.845
  365    HH   TYR  49           HH       TYR  49  52.122   5.413   0.647
  366    HB2  TYR  49           HB2      TYR  49  50.640  -0.544   2.486
  367    HB3  TYR  49           HB3      TYR  49  52.176  -0.615   3.350
  368    H    SER  50           H        SER  50  53.077  -3.191  -0.072
  369    HA   SER  50           HA       SER  50  51.950  -5.235   1.669
  370    HG   SER  50           HG       SER  50  51.002  -5.013  -0.474
  371    HB2  SER  50           HB2      SER  50  53.641  -5.518  -0.835
  372    HB3  SER  50           HB3      SER  50  52.852  -6.841   0.024
  373    H    LYS  51           H        LYS  51  54.431  -3.261   1.703
  374    HA   LYS  51           HA       LYS  51  55.953  -4.916   3.530
  375    HB2  LYS  51           HB2      LYS  51  58.122  -4.018   2.578
  376    HB3  LYS  51           HB3      LYS  51  57.311  -5.222   1.594
  377    HG2  LYS  51           HG2      LYS  51  56.916  -2.300   1.060
  378    HG3  LYS  51           HG3      LYS  51  58.340  -3.149   0.456
  379    HD2  LYS  51           HD2      LYS  51  56.918  -4.724  -0.741
  380    HD3  LYS  51           HD3      LYS  51  55.477  -3.945  -0.089
  381    HE2  LYS  51           HE2      LYS  51  55.906  -3.235  -2.382
  382    HE3  LYS  51           HE3      LYS  51  56.045  -1.884  -1.257
  383    HZ1  LYS  51           HZ1      LYS  51  57.857  -2.488  -3.131
  384    HZ2  LYS  51           HZ2      LYS  51  58.525  -3.290  -1.793
  385    HZ3  LYS  51           HZ3      LYS  51  58.210  -1.622  -1.710
  386    H    HIS  52           H        HIS  52  54.401  -3.372   4.666
  387    HA   HIS  52           HA       HIS  52  54.861  -0.594   4.621
  388    HD1  HIS  52           HD1      HIS  52  54.596   0.617   7.733
  389    HD2  HIS  52           HD2      HIS  52  51.101   0.080   5.549
  390    HE1  HIS  52           HE1      HIS  52  53.221   2.716   8.070
  391    HB2  HIS  52           HB2      HIS  52  52.813  -1.928   5.477
  392    HB3  HIS  52           HB3      HIS  52  53.702  -2.049   6.989
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  25.900  -5.500  -2.756
    2    H2   GLY   1           2H       GLY   1  24.993  -4.830  -1.492
    3    H3   GLY   1           3H       GLY   1  26.532  -4.213  -1.852
    4    HA2  GLY   1           HA2      GLY   1  25.064  -4.081  -4.203
    5    HA3  GLY   1           HA3      GLY   1  24.026  -3.474  -2.920
    6    H    SER   2           H        SER   2  24.346  -1.506  -4.350
    7    HA   SER   2           HA       SER   2  26.869  -0.153  -4.200
    8    HG   SER   2           HG       SER   2  24.465   0.288  -6.949
    9    HB2  SER   2           HB2      SER   2  24.169   1.020  -4.911
   10    HB3  SER   2           HB3      SER   2  25.758   1.645  -5.357
   11    HA   PRO   3           HA       PRO   3  25.881   1.526  -0.166
   12    HB2  PRO   3           HB2      PRO   3  28.566   2.462   0.071
   13    HB3  PRO   3           HB3      PRO   3  27.884   0.987   0.758
   14    HG2  PRO   3           HG2      PRO   3  29.822   1.060  -1.222
   15    HG3  PRO   3           HG3      PRO   3  28.763  -0.321  -0.887
   16    HD2  PRO   3           HD2      PRO   3  28.503   1.806  -2.983
   17    HD3  PRO   3           HD3      PRO   3  28.198   0.062  -3.102
   18    HA   PRO   4           HA       PRO   4  25.254   5.873  -0.717
   19    HB2  PRO   4           HB2      PRO   4  26.710   6.372   1.828
   20    HB3  PRO   4           HB3      PRO   4  25.075   6.848   1.354
   21    HG2  PRO   4           HG2      PRO   4  25.453   4.865   3.085
   22    HG3  PRO   4           HG3      PRO   4  24.185   4.755   1.849
   23    HD2  PRO   4           HD2      PRO   4  26.888   3.466   1.913
   24    HD3  PRO   4           HD3      PRO   4  25.331   2.791   1.385
   25    H    GLU   5           H        GLU   5  26.302   7.807  -1.266
   26    HA   GLU   5           HA       GLU   5  28.813   7.357  -2.486
   27    HB2  GLU   5           HB2      GLU   5  27.355   9.988  -2.199
   28    HB3  GLU   5           HB3      GLU   5  28.611   9.608  -3.366
   29    HG2  GLU   5           HG2      GLU   5  26.684   9.457  -4.620
   30    HG3  GLU   5           HG3      GLU   5  26.990   7.776  -4.184
   31    H    ALA   6           H        ALA   6  30.444   7.051  -1.047
   32    HA   ALA   6           HA       ALA   6  32.071   7.554   0.456
   33    HB1  ALA   6           HB1      ALA   6  33.089   9.480   0.006
   34    HB2  ALA   6           HB2      ALA   6  31.783  10.391   0.765
   35    HB3  ALA   6           HB3      ALA   6  31.683   9.962  -0.943
   36    H    ASP   7           H        ASP   7  30.156   6.524   1.596
   37    HA   ASP   7           HA       ASP   7  28.822   8.067   3.634
   38    HB2  ASP   7           HB2      ASP   7  28.039   5.847   2.518
   39    HB3  ASP   7           HB3      ASP   7  29.202   5.061   3.578
   40    HA   PRO   8           HA       PRO   8  31.921   8.350   6.809
   41    HB2  PRO   8           HB2      PRO   8  30.226   6.404   8.341
   42    HB3  PRO   8           HB3      PRO   8  31.011   7.887   8.898
   43    HG2  PRO   8           HG2      PRO   8  28.396   7.828   8.290
   44    HG3  PRO   8           HG3      PRO   8  29.398   9.253   7.969
   45    HD2  PRO   8           HD2      PRO   8  28.205   7.341   6.068
   46    HD3  PRO   8           HD3      PRO   8  28.804   8.986   5.787
   47    H    ARG   9           H        ARG   9  30.810   5.190   5.812
   48    HA   ARG   9           HA       ARG   9  33.048   3.699   6.839
   49    HE   ARG   9           HE       ARG   9  29.519   0.852   5.181
   50    HB2  ARG   9           HB2      ARG   9  30.949   2.986   4.782
   51    HB3  ARG   9           HB3      ARG   9  32.090   1.857   5.514
   52    HG2  ARG   9           HG2      ARG   9  30.754   1.543   7.254
   53    HG3  ARG   9           HG3      ARG   9  30.691   3.278   7.576
   54    HD2  ARG   9           HD2      ARG   9  28.461   2.405   7.217
   55    HD3  ARG   9           HD3      ARG   9  28.898   3.508   5.910
   56   HH11  ARG   9          HH11      ARG   9  26.841   3.036   5.610
   57   HH12  ARG   9          HH12      ARG   9  25.770   2.139   4.578
   58   HH21  ARG   9          HH21      ARG   9  28.128  -0.333   3.803
   59   HH22  ARG   9          HH22      ARG   9  26.505   0.237   3.538
   60    H    LEU  10           H        LEU  10  32.038   4.796   3.588
   61    HA   LEU  10           HA       LEU  10  34.493   3.789   2.467
   62    HG   LEU  10           HG       LEU  10  31.627   2.764   1.931
   63    HB2  LEU  10           HB2      LEU  10  32.077   5.057   1.190
   64    HB3  LEU  10           HB3      LEU  10  33.483   4.504   0.298
   65   HD11  LEU  10          HD11      LEU  10  31.969   2.189  -0.893
   66   HD12  LEU  10          HD12      LEU  10  31.277   3.785  -0.602
   67   HD13  LEU  10          HD13      LEU  10  30.496   2.349   0.061
   68   HD21  LEU  10          HD21      LEU  10  34.263   2.285   1.529
   69   HD22  LEU  10          HD22      LEU  10  33.565   1.554   0.086
   70   HD23  LEU  10          HD23      LEU  10  33.034   1.031   1.684
   71    H    ILE  11           H        ILE  11  33.121   6.864   3.384
   72    HA   ILE  11           HA       ILE  11  35.037   8.426   1.907
   73    HB   ILE  11           HB       ILE  11  32.874   9.365   2.809
   74   HG12  ILE  11          HG12      ILE  11  35.418  10.775   3.652
   75   HG13  ILE  11          HG13      ILE  11  34.709  10.813   2.038
   76   HG21  ILE  11          HG21      ILE  11  33.231  10.265   5.242
   77   HG22  ILE  11          HG22      ILE  11  34.286   8.858   5.381
   78   HG23  ILE  11          HG23      ILE  11  32.584   8.648   4.963
   79   HD11  ILE  11          HD11      ILE  11  32.941  11.647   4.235
   80   HD12  ILE  11          HD12      ILE  11  33.149  12.321   2.617
   81   HD13  ILE  11          HD13      ILE  11  34.308  12.706   3.889
   82    H    GLU  12           H        GLU  12  35.069   6.403   4.562
   83    HA   GLU  12           HA       GLU  12  37.519   7.536   5.710
   84    HB2  GLU  12           HB2      GLU  12  35.851   6.730   7.295
   85    HB3  GLU  12           HB3      GLU  12  35.852   5.148   6.533
   86    HG2  GLU  12           HG2      GLU  12  37.104   5.013   8.551
   87    HG3  GLU  12           HG3      GLU  12  38.228   4.888   7.202
   88    H    SER  13           H        SER  13  36.413   4.359   4.520
   89    HA   SER  13           HA       SER  13  39.147   3.494   4.367
   90    HG   SER  13           HG       SER  13  37.514   1.067   5.924
   91    HB2  SER  13           HB2      SER  13  36.586   2.009   3.772
   92    HB3  SER  13           HB3      SER  13  38.188   1.281   3.909
   93    H    LEU  14           H        LEU  14  36.703   4.368   1.973
   94    HA   LEU  14           HA       LEU  14  38.379   3.273  -0.152
   95    HG   LEU  14           HG       LEU  14  37.173   2.581  -2.125
   96    HB2  LEU  14           HB2      LEU  14  35.790   3.077  -0.012
   97    HB3  LEU  14           HB3      LEU  14  35.785   4.745  -0.547
   98   HD11  LEU  14          HD11      LEU  14  35.170   2.411  -3.491
   99   HD12  LEU  14          HD12      LEU  14  34.319   3.514  -2.411
  100   HD13  LEU  14          HD13      LEU  14  34.835   1.931  -1.828
  101   HD21  LEU  14          HD21      LEU  14  37.087   4.099  -3.923
  102   HD22  LEU  14          HD22      LEU  14  37.626   5.046  -2.537
  103   HD23  LEU  14          HD23      LEU  14  35.953   5.158  -3.085
  104    H    SER  15           H        SER  15  36.969   6.294   0.988
  105    HA   SER  15           HA       SER  15  38.020   7.870  -1.041
  106    HG   SER  15           HG       SER  15  38.126  10.544   0.763
  107    HB2  SER  15           HB2      SER  15  36.172   8.557   0.471
  108    HB3  SER  15           HB3      SER  15  37.358   8.792   1.754
  109    H    GLN  16           H        GLN  16  39.535   6.652   1.840
  110    HA   GLN  16           HA       GLN  16  41.593   8.579   2.020
  111    HB2  GLN  16           HB2      GLN  16  42.784   6.965   3.431
  112    HB3  GLN  16           HB3      GLN  16  41.107   7.147   3.910
  113    HG2  GLN  16           HG2      GLN  16  41.453   4.879   4.087
  114    HG3  GLN  16           HG3      GLN  16  40.706   5.024   2.499
  115   HE21  GLN  16          HE21      GLN  16  41.559   3.413   1.361
  116   HE22  GLN  16          HE22      GLN  16  43.252   3.128   1.145
  117    H    MET  17           H        MET  17  41.140   5.891  -0.108
  118    HA   MET  17           HA       MET  17  43.903   6.190  -1.052
  119    HB2  MET  17           HB2      MET  17  43.452   4.133  -2.408
  120    HB3  MET  17           HB3      MET  17  43.415   3.886  -0.672
  121    HG2  MET  17           HG2      MET  17  41.604   2.664  -1.365
  122    HG3  MET  17           HG3      MET  17  40.852   4.199  -0.945
  123    HE1  MET  17           HE1      MET  17  42.605   3.457  -4.844
  124    HE2  MET  17           HE2      MET  17  41.460   2.116  -4.826
  125    HE3  MET  17           HE3      MET  17  42.637   2.284  -3.525
  126    H    LEU  18           H        LEU  18  40.586   6.723  -1.857
  127    HA   LEU  18           HA       LEU  18  40.847   7.050  -4.651
  128    HG   LEU  18           HG       LEU  18  38.774   9.090  -5.241
  129    HB2  LEU  18           HB2      LEU  18  38.719   6.751  -3.335
  130    HB3  LEU  18           HB3      LEU  18  38.870   8.423  -2.829
  131   HD11  LEU  18          HD11      LEU  18  39.435   6.670  -5.931
  132   HD12  LEU  18          HD12      LEU  18  38.316   7.593  -6.935
  133   HD13  LEU  18          HD13      LEU  18  37.702   6.365  -5.827
  134   HD21  LEU  18          HD21      LEU  18  36.380   7.514  -4.308
  135   HD22  LEU  18          HD22      LEU  18  36.395   8.896  -5.406
  136   HD23  LEU  18          HD23      LEU  18  36.810   9.116  -3.705
  137    H    SER  19           H        SER  19  41.046   9.350  -1.956
  138    HA   SER  19           HA       SER  19  41.758  11.476  -3.832
  139    HG   SER  19           HG       SER  19  42.514  13.362  -1.881
  140    HB2  SER  19           HB2      SER  19  40.054  11.952  -2.089
  141    HB3  SER  19           HB3      SER  19  41.265  11.637  -0.845
  142    H    MET  20           H        MET  20  43.433   9.095  -2.568
  143    HA   MET  20           HA       MET  20  45.692  10.707  -1.612
  144    HB2  MET  20           HB2      MET  20  44.817   8.636  -0.370
  145    HB3  MET  20           HB3      MET  20  45.543   7.699  -1.668
  146    HG2  MET  20           HG2      MET  20  47.054   7.752   0.177
  147    HG3  MET  20           HG3      MET  20  47.728   8.728  -1.127
  148    HE1  MET  20           HE1      MET  20  49.162  10.592   1.748
  149    HE2  MET  20           HE2      MET  20  49.208   9.024   0.941
  150    HE3  MET  20           HE3      MET  20  48.405   9.188   2.503
  151    H    GLY  21           H        GLY  21  44.662   8.573  -4.168
  152    HA2  GLY  21           HA2      GLY  21  45.654   8.621  -6.360
  153    HA3  GLY  21           HA3      GLY  21  47.170   9.129  -5.612
  154    H    PHE  22           H        PHE  22  44.974   6.527  -4.656
  155    HA   PHE  22           HA       PHE  22  47.126   4.597  -5.184
  156    HD1  PHE  22           HD2      PHE  22  48.371   5.336  -4.088
  157    HD2  PHE  22           HD1      PHE  22  46.150   3.983  -0.721
  158    HE1  PHE  22           HE2      PHE  22  50.266   5.880  -2.619
  159    HE2  PHE  22           HE1      PHE  22  48.042   4.523   0.751
  160    HZ   PHE  22           HZ       PHE  22  50.104   5.467  -0.201
  161    HB2  PHE  22           HB2      PHE  22  45.082   4.718  -2.966
  162    HB3  PHE  22           HB3      PHE  22  45.867   3.202  -3.406
  163    H    SER  23           H        SER  23  46.076   2.311  -5.500
  164    HA   SER  23           HA       SER  23  43.415   2.455  -6.561
  165    HG   SER  23           HG       SER  23  44.352   4.051  -7.996
  166    HB2  SER  23           HB2      SER  23  45.699   1.678  -8.403
  167    HB3  SER  23           HB3      SER  23  43.982   1.618  -8.802
  168    H    ASP  24           H        ASP  24  42.648   0.241  -7.192
  169    HA   ASP  24           HA       ASP  24  43.625  -1.720  -5.365
  170    HB2  ASP  24           HB2      ASP  24  42.024  -3.265  -6.599
  171    HB3  ASP  24           HB3      ASP  24  41.313  -1.881  -5.779
  172    H    GLU  25           H        GLU  25  44.909  -3.400  -5.682
  173    HA   GLU  25           HA       GLU  25  46.910  -3.252  -7.614
  174    HB2  GLU  25           HB2      GLU  25  47.085  -4.322  -5.360
  175    HB3  GLU  25           HB3      GLU  25  46.136  -5.668  -5.967
  176    HG2  GLU  25           HG2      GLU  25  47.896  -6.157  -7.597
  177    HG3  GLU  25           HG3      GLU  25  48.853  -4.827  -6.942
  178    H    GLY  26           H        GLY  26  43.825  -4.669  -7.780
  179    HA2  GLY  26           HA2      GLY  26  44.349  -5.499 -10.516
  180    HA3  GLY  26           HA3      GLY  26  43.782  -6.767  -9.430
  181    H    GLY  27           H        GLY  27  41.822  -6.006  -8.075
  182    HA2  GLY  27           HA2      GLY  27  40.045  -4.062  -9.036
  183    HA3  GLY  27           HA3      GLY  27  39.659  -5.590  -9.827
  184    H    TRP  28           H        TRP  28  40.995  -5.310  -6.642
  185    HA   TRP  28           HA       TRP  28  38.762  -6.844  -5.610
  186    HD1  TRP  28           HD1      TRP  28  43.123  -6.938  -6.112
  187    HE1  TRP  28           HE1      TRP  28  44.834  -5.151  -5.416
  188    HE3  TRP  28           HE3      TRP  28  40.475  -4.677  -2.377
  189    HZ2  TRP  28           HZ2      TRP  28  45.027  -3.044  -3.547
  190    HZ3  TRP  28           HZ3      TRP  28  41.487  -2.783  -1.188
  191    HH2  TRP  28           HH2      TRP  28  43.716  -1.986  -1.759
  192    HB2  TRP  28           HB2      TRP  28  40.328  -7.068  -3.603
  193    HB3  TRP  28           HB3      TRP  28  40.873  -7.797  -5.116
  194    H    LEU  29           H        LEU  29  39.495  -3.577  -5.682
  195    HA   LEU  29           HA       LEU  29  39.323  -2.833  -3.035
  196    HG   LEU  29           HG       LEU  29  37.370  -0.315  -3.602
  197    HB2  LEU  29           HB2      LEU  29  40.081  -1.226  -4.543
  198    HB3  LEU  29           HB3      LEU  29  38.662  -1.344  -5.553
  199   HD11  LEU  29          HD11      LEU  29  38.677  -0.464  -1.721
  200   HD12  LEU  29          HD12      LEU  29  39.048   1.179  -2.247
  201   HD13  LEU  29          HD13      LEU  29  40.170  -0.133  -2.600
  202   HD21  LEU  29          HD21      LEU  29  39.453   1.574  -4.594
  203   HD22  LEU  29          HD22      LEU  29  37.713   1.802  -4.437
  204   HD23  LEU  29          HD23      LEU  29  38.359   0.808  -5.745
  205    H    THR  30           H        THR  30  36.711  -3.856  -5.067
  206    HA   THR  30           HA       THR  30  34.724  -2.997  -3.079
  207    HB   THR  30           HB       THR  30  34.199  -4.465  -5.668
  208    HG1  THR  30           HG1      THR  30  35.287  -2.148  -5.546
  209   HG21  THR  30          HG21      THR  30  32.321  -2.466  -4.577
  210   HG22  THR  30          HG22      THR  30  32.435  -4.007  -3.725
  211   HG23  THR  30          HG23      THR  30  32.009  -3.974  -5.437
  212    H    ARG  31           H        ARG  31  36.690  -5.611  -3.826
  213    HA   ARG  31           HA       ARG  31  34.901  -7.653  -2.764
  214    HE   ARG  31           HE       ARG  31  38.671 -11.562  -3.032
  215    HB2  ARG  31           HB2      ARG  31  35.979  -8.382  -4.706
  216    HB3  ARG  31           HB3      ARG  31  37.505  -7.648  -4.251
  217    HG2  ARG  31           HG2      ARG  31  37.888  -9.374  -2.607
  218    HG3  ARG  31           HG3      ARG  31  36.311 -10.093  -2.961
  219    HD2  ARG  31           HD2      ARG  31  36.980 -10.758  -5.113
  220    HD3  ARG  31           HD3      ARG  31  38.377  -9.685  -5.103
  221   HH11  ARG  31          HH11      ARG  31  38.648 -11.402  -6.531
  222   HH12  ARG  31          HH12      ARG  31  39.753 -12.728  -6.727
  223   HH21  ARG  31          HH21      ARG  31  40.129 -13.318  -3.285
  224   HH22  ARG  31          HH22      ARG  31  40.591 -13.816  -4.888
  225    H    LEU  32           H        LEU  32  38.211  -6.525  -2.177
  226    HA   LEU  32           HA       LEU  32  38.728  -8.020   0.122
  227    HG   LEU  32           HG       LEU  32  42.061  -6.284   0.154
  228    HB2  LEU  32           HB2      LEU  32  40.339  -6.775  -1.397
  229    HB3  LEU  32           HB3      LEU  32  39.882  -5.310  -0.553
  230   HD11  LEU  32          HD11      LEU  32  41.614  -6.168   2.609
  231   HD12  LEU  32          HD12      LEU  32  39.897  -6.037   2.224
  232   HD13  LEU  32          HD13      LEU  32  41.021  -4.795   1.674
  233   HD21  LEU  32          HD21      LEU  32  41.110  -8.673  -0.037
  234   HD22  LEU  32          HD22      LEU  32  40.551  -8.406   1.615
  235   HD23  LEU  32          HD23      LEU  32  42.271  -8.306   1.238
  236    H    LEU  33           H        LEU  33  38.011  -4.536  -0.050
  237    HA   LEU  33           HA       LEU  33  37.924  -4.139   2.680
  238    HG   LEU  33           HG       LEU  33  39.087  -2.078   2.164
  239    HB2  LEU  33           HB2      LEU  33  36.671  -2.588   0.430
  240    HB3  LEU  33           HB3      LEU  33  36.544  -2.066   2.102
  241   HD11  LEU  33          HD11      LEU  33  38.639  -2.444  -0.783
  242   HD12  LEU  33          HD12      LEU  33  39.669  -3.388   0.294
  243   HD13  LEU  33          HD13      LEU  33  40.111  -1.733  -0.122
  244   HD21  LEU  33          HD21      LEU  33  39.246   0.105   1.076
  245   HD22  LEU  33          HD22      LEU  33  37.775  -0.027   2.042
  246   HD23  LEU  33          HD23      LEU  33  37.694  -0.175   0.287
  247    H    GLN  34           H        GLN  34  35.079  -4.240   0.546
  248    HA   GLN  34           HA       GLN  34  33.103  -3.912   2.345
  249    HB2  GLN  34           HB2      GLN  34  33.237  -5.527  -0.160
  250    HB3  GLN  34           HB3      GLN  34  31.771  -5.571   0.806
  251    HG2  GLN  34           HG2      GLN  34  31.689  -3.937  -1.038
  252    HG3  GLN  34           HG3      GLN  34  31.456  -3.209   0.549
  253   HE21  GLN  34          HE21      GLN  34  32.256  -1.229   0.405
  254   HE22  GLN  34          HE22      GLN  34  33.814  -0.809  -0.208
  255    H    THR  35           H        THR  35  34.622  -7.061   1.673
  256    HA   THR  35           HA       THR  35  32.827  -8.468   3.389
  257    HB   THR  35           HB       THR  35  34.427 -10.372   3.016
  258    HG1  THR  35           HG1      THR  35  35.728  -8.819   1.082
  259   HG21  THR  35          HG21      THR  35  33.499 -10.861   1.048
  260   HG22  THR  35          HG22      THR  35  34.044  -9.360   0.297
  261   HG23  THR  35          HG23      THR  35  32.593  -9.368   1.299
  262    H    LYS  36           H        LYS  36  35.548  -6.563   4.033
  263    HA   LYS  36           HA       LYS  36  35.962  -7.920   6.622
  264    HB2  LYS  36           HB2      LYS  36  37.913  -6.279   5.001
  265    HB3  LYS  36           HB3      LYS  36  38.241  -6.958   6.590
  266    HG2  LYS  36           HG2      LYS  36  38.123  -9.185   5.747
  267    HG3  LYS  36           HG3      LYS  36  37.505  -8.622   4.193
  268    HD2  LYS  36           HD2      LYS  36  39.873  -9.204   4.044
  269    HD3  LYS  36           HD3      LYS  36  39.617  -7.486   3.749
  270    HE2  LYS  36           HE2      LYS  36  41.569  -7.901   5.182
  271    HE3  LYS  36           HE3      LYS  36  40.328  -6.955   6.001
  272    HZ1  LYS  36           HZ1      LYS  36  40.372  -9.881   6.324
  273    HZ2  LYS  36           HZ2      LYS  36  39.789  -8.688   7.386
  274    HZ3  LYS  36           HZ3      LYS  36  41.463  -8.921   7.209
  275    H    ASN  37           H        ASN  37  33.946  -5.892   6.088
  276    HA   ASN  37           HA       ASN  37  33.073  -4.008   7.013
  277    HB2  ASN  37           HB2      ASN  37  33.703  -5.113   9.139
  278    HB3  ASN  37           HB3      ASN  37  35.287  -4.345   9.058
  279   HD21  ASN  37          HD21      ASN  37  35.498  -2.596  10.216
  280   HD22  ASN  37          HD22      ASN  37  34.242  -1.503  10.673
  281    H    TYR  38           H        TYR  38  34.819  -3.676   4.889
  282    HA   TYR  38           HA       TYR  38  36.023  -2.142   3.738
  283    HD1  TYR  38           HD1      TYR  38  33.933  -1.346   2.480
  284    HD2  TYR  38           HD2      TYR  38  32.933  -0.208   6.454
  285    HE1  TYR  38           HE1      TYR  38  31.551  -1.702   1.981
  286    HE2  TYR  38           HE2      TYR  38  30.553  -0.565   5.965
  287    HH   TYR  38           HH       TYR  38  29.237  -2.078   4.212
  288    HB2  TYR  38           HB2      TYR  38  35.142  -0.130   5.813
  289    HB3  TYR  38           HB3      TYR  38  35.475   0.145   4.106
  290    H    ASP  39           H        ASP  39  37.718  -3.572   4.928
  291    HA   ASP  39           HA       ASP  39  39.176  -2.220   6.998
  292    HB2  ASP  39           HB2      ASP  39  38.888  -4.625   7.100
  293    HB3  ASP  39           HB3      ASP  39  39.724  -4.818   5.561
  294    H    ILE  40           H        ILE  40  40.667  -0.794   6.673
  295    HA   ILE  40           HA       ILE  40  42.110  -0.709   4.136
  296    HB   ILE  40           HB       ILE  40  43.112   1.402   5.077
  297   HG12  ILE  40          HG12      ILE  40  41.380   0.606   7.349
  298   HG13  ILE  40          HG13      ILE  40  42.873   1.529   7.340
  299   HG21  ILE  40          HG21      ILE  40  41.320   1.443   3.461
  300   HG22  ILE  40          HG22      ILE  40  41.097   2.731   4.646
  301   HG23  ILE  40          HG23      ILE  40  40.122   1.264   4.743
  302   HD11  ILE  40          HD11      ILE  40  41.392   3.388   6.282
  303   HD12  ILE  40          HD12      ILE  40  41.358   3.100   8.021
  304   HD13  ILE  40          HD13      ILE  40  40.070   2.463   6.996
  305    H    GLY  41           H        GLY  41  42.337  -2.205   7.045
  306    HA2  GLY  41           HA2      GLY  41  45.097  -1.962   7.609
  307    HA3  GLY  41           HA3      GLY  41  44.051  -3.250   8.168
  308    H    ALA  42           H        ALA  42  43.192  -4.131   5.679
  309    HA   ALA  42           HA       ALA  42  45.613  -5.480   4.727
  310    HB1  ALA  42           HB1      ALA  42  43.608  -6.811   3.504
  311    HB2  ALA  42           HB2      ALA  42  42.784  -6.249   4.959
  312    HB3  ALA  42           HB3      ALA  42  44.242  -7.235   5.095
  313    H    ALA  43           H        ALA  43  43.133  -3.305   3.771
  314    HA   ALA  43           HA       ALA  43  43.364  -3.555   0.966
  315    HB1  ALA  43           HB1      ALA  43  42.727  -0.885   2.066
  316    HB2  ALA  43           HB2      ALA  43  41.664  -2.212   2.539
  317    HB3  ALA  43           HB3      ALA  43  41.898  -1.834   0.832
  318    H    LEU  44           H        LEU  44  45.016  -1.501   3.327
  319    HA   LEU  44           HA       LEU  44  46.424   0.050   1.445
  320    HG   LEU  44           HG       LEU  44  46.918   2.152   2.795
  321    HB2  LEU  44           HB2      LEU  44  46.589  -0.409   4.362
  322    HB3  LEU  44           HB3      LEU  44  48.053   0.181   3.588
  323   HD11  LEU  44          HD11      LEU  44  44.522   2.540   3.571
  324   HD12  LEU  44          HD12      LEU  44  44.444   0.792   3.823
  325   HD13  LEU  44          HD13      LEU  44  44.769   1.442   2.211
  326   HD21  LEU  44          HD21      LEU  44  47.780   2.376   4.996
  327   HD22  LEU  44          HD22      LEU  44  46.388   1.547   5.694
  328   HD23  LEU  44          HD23      LEU  44  46.194   3.145   4.971
  329    H    ASP  45           H        ASP  45  47.121  -3.049   2.921
  330    HA   ASP  45           HA       ASP  45  49.832  -3.251   2.237
  331    HB2  ASP  45           HB2      ASP  45  48.591  -4.824   3.736
  332    HB3  ASP  45           HB3      ASP  45  47.805  -5.499   2.314
  333    H    THR  46           H        THR  46  46.903  -3.903   0.384
  334    HA   THR  46           HA       THR  46  48.499  -4.771  -1.878
  335    HB   THR  46           HB       THR  46  46.143  -5.148  -2.862
  336    HG1  THR  46           HG1      THR  46  44.869  -4.029  -1.477
  337   HG21  THR  46          HG21      THR  46  47.617  -6.689  -0.892
  338   HG22  THR  46          HG22      THR  46  46.821  -7.205  -2.380
  339   HG23  THR  46          HG23      THR  46  45.887  -7.035  -0.892
  340    H    ILE  47           H        ILE  47  47.350  -1.789  -0.811
  341    HA   ILE  47           HA       ILE  47  47.189  -0.836  -3.586
  342    HB   ILE  47           HB       ILE  47  46.456   1.375  -2.657
  343   HG12  ILE  47          HG12      ILE  47  46.084  -0.246  -0.138
  344   HG13  ILE  47          HG13      ILE  47  47.161   1.134  -0.350
  345   HG21  ILE  47          HG21      ILE  47  44.159   0.038  -1.831
  346   HG22  ILE  47          HG22      ILE  47  44.940  -1.062  -2.965
  347   HG23  ILE  47          HG23      ILE  47  44.542   0.579  -3.464
  348   HD11  ILE  47          HD11      ILE  47  44.878   2.307  -1.021
  349   HD12  ILE  47          HD12      ILE  47  45.424   2.180   0.652
  350   HD13  ILE  47          HD13      ILE  47  44.230   1.044   0.025
  351    H    GLN  48           H        GLN  48  49.603  -1.645  -2.755
  352    HA   GLN  48           HA       GLN  48  51.714  -1.008  -3.290
  353    HB2  GLN  48           HB2      GLN  48  50.785   1.846  -2.964
  354    HB3  GLN  48           HB3      GLN  48  52.382   1.358  -3.514
  355    HG2  GLN  48           HG2      GLN  48  51.662   1.161  -5.596
  356    HG3  GLN  48           HG3      GLN  48  50.367   0.069  -5.100
  357   HE21  GLN  48          HE21      GLN  48  48.365   0.755  -5.336
  358   HE22  GLN  48          HE22      GLN  48  47.866   2.400  -5.525
  359    H    TYR  49           H        TYR  49  50.198  -0.493  -0.360
  360    HA   TYR  49           HA       TYR  49  52.799   0.070   0.911
  361    HD1  TYR  49           HD1      TYR  49  51.220   2.274  -0.355
  362    HD2  TYR  49           HD2      TYR  49  52.114   2.454   3.798
  363    HE1  TYR  49           HE1      TYR  49  52.117   4.536  -0.654
  364    HE2  TYR  49           HE2      TYR  49  53.012   4.719   3.512
  365    HH   TYR  49           HH       TYR  49  52.405   6.659   1.111
  366    HB2  TYR  49           HB2      TYR  49  50.013   0.819   1.680
  367    HB3  TYR  49           HB3      TYR  49  51.190   0.531   2.962
  368    H    SER  50           H        SER  50  53.205  -2.265   0.533
  369    HA   SER  50           HA       SER  50  51.728  -4.140   2.145
  370    HG   SER  50           HG       SER  50  51.654  -4.644  -0.114
  371    HB2  SER  50           HB2      SER  50  54.350  -4.529   0.683
  372    HB3  SER  50           HB3      SER  50  53.318  -5.803   1.333
  373    H    LYS  51           H        LYS  51  53.475  -1.784   3.146
  374    HA   LYS  51           HA       LYS  51  54.559  -3.321   5.399
  375    HB2  LYS  51           HB2      LYS  51  56.424  -2.301   4.119
  376    HB3  LYS  51           HB3      LYS  51  55.689  -0.718   4.334
  377    HG2  LYS  51           HG2      LYS  51  55.968  -0.919   6.760
  378    HG3  LYS  51           HG3      LYS  51  56.718  -2.502   6.539
  379    HD2  LYS  51           HD2      LYS  51  58.511  -1.460   5.228
  380    HD3  LYS  51           HD3      LYS  51  57.756   0.119   5.465
  381    HE2  LYS  51           HE2      LYS  51  58.105  -0.011   7.845
  382    HE3  LYS  51           HE3      LYS  51  58.709  -1.660   7.704
  383    HZ1  LYS  51           HZ1      LYS  51  60.050   0.527   6.248
  384    HZ2  LYS  51           HZ2      LYS  51  60.686  -0.955   6.785
  385    HZ3  LYS  51           HZ3      LYS  51  60.373   0.290   7.901
  386    H    HIS  52           H        HIS  52  52.387  -3.068   6.216
  387    HA   HIS  52           HA       HIS  52  51.562  -0.342   6.841
  388    HD1  HIS  52           HD1      HIS  52  47.309  -2.183   6.891
  389    HD2  HIS  52           HD2      HIS  52  49.970   0.797   8.055
  390    HE1  HIS  52           HE1      HIS  52  45.900  -0.248   7.719
  391    HB2  HIS  52           HB2      HIS  52  50.014  -2.137   5.848
  392    HB3  HIS  52           HB3      HIS  52  50.025  -2.864   7.450
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  19.119   7.622  -2.670
    2    H2   GLY   1           2H       GLY   1  19.139   8.598  -1.283
    3    H3   GLY   1           3H       GLY   1  17.926   7.434  -1.481
    4    HA2  GLY   1           HA2      GLY   1  19.538   6.650   0.100
    5    HA3  GLY   1           HA3      GLY   1  19.566   5.664  -1.357
    6    H    SER   2           H        SER   2  21.686   5.891   0.531
    7    HA   SER   2           HA       SER   2  23.703   7.543  -0.751
    8    HG   SER   2           HG       SER   2  24.556   8.205   2.093
    9    HB2  SER   2           HB2      SER   2  23.813   5.673   1.625
   10    HB3  SER   2           HB3      SER   2  25.214   6.549   1.006
   11    HA   PRO   3           HA       PRO   3  24.757   4.226  -3.554
   12    HB2  PRO   3           HB2      PRO   3  27.097   5.361  -4.443
   13    HB3  PRO   3           HB3      PRO   3  25.498   5.777  -5.065
   14    HG2  PRO   3           HG2      PRO   3  27.183   7.209  -3.050
   15    HG3  PRO   3           HG3      PRO   3  26.180   7.876  -4.352
   16    HD2  PRO   3           HD2      PRO   3  25.367   7.861  -1.782
   17    HD3  PRO   3           HD3      PRO   3  24.232   7.669  -3.132
   18    HA   PRO   4           HA       PRO   4  27.657   1.949  -1.051
   19    HB2  PRO   4           HB2      PRO   4  28.143  -0.112  -2.713
   20    HB3  PRO   4           HB3      PRO   4  26.592   0.080  -1.883
   21    HG2  PRO   4           HG2      PRO   4  27.329   0.768  -4.706
   22    HG3  PRO   4           HG3      PRO   4  25.861  -0.014  -4.093
   23    HD2  PRO   4           HD2      PRO   4  25.992   2.636  -4.734
   24    HD3  PRO   4           HD3      PRO   4  24.894   1.982  -3.504
   25    H    GLU   5           H        GLU   5  28.658   4.149  -2.698
   26    HA   GLU   5           HA       GLU   5  31.436   3.286  -2.910
   27    HB2  GLU   5           HB2      GLU   5  30.001   4.716  -5.166
   28    HB3  GLU   5           HB3      GLU   5  31.732   4.423  -5.095
   29    HG2  GLU   5           HG2      GLU   5  31.328   2.017  -5.169
   30    HG3  GLU   5           HG3      GLU   5  29.591   2.313  -5.236
   31    H    ALA   6           H        ALA   6  29.451   5.064  -1.416
   32    HA   ALA   6           HA       ALA   6  31.210   7.208  -0.776
   33    HB1  ALA   6           HB1      ALA   6  28.807   8.547  -1.622
   34    HB2  ALA   6           HB2      ALA   6  29.529   7.692  -2.985
   35    HB3  ALA   6           HB3      ALA   6  30.479   8.871  -2.080
   36    H    ASP   7           H        ASP   7  30.287   5.314   0.724
   37    HA   ASP   7           HA       ASP   7  27.935   6.312   2.172
   38    HB2  ASP   7           HB2      ASP   7  27.757   4.014   1.294
   39    HB3  ASP   7           HB3      ASP   7  29.265   3.578   2.082
   40    HA   PRO   8           HA       PRO   8  30.319   7.824   5.559
   41    HB2  PRO   8           HB2      PRO   8  28.887   5.773   7.206
   42    HB3  PRO   8           HB3      PRO   8  29.176   7.483   7.548
   43    HG2  PRO   8           HG2      PRO   8  26.800   6.629   6.646
   44    HG3  PRO   8           HG3      PRO   8  27.475   8.191   6.150
   45    HD2  PRO   8           HD2      PRO   8  27.165   5.694   4.590
   46    HD3  PRO   8           HD3      PRO   8  27.308   7.369   4.021
   47    H    ARG   9           H        ARG   9  30.048   4.321   5.232
   48    HA   ARG   9           HA       ARG   9  32.409   3.725   6.766
   49    HE   ARG   9           HE       ARG   9  30.982  -0.477   6.790
   50    HB2  ARG   9           HB2      ARG   9  30.663   2.073   4.936
   51    HB3  ARG   9           HB3      ARG   9  32.010   1.415   5.875
   52    HG2  ARG   9           HG2      ARG   9  30.938   1.824   7.922
   53    HG3  ARG   9           HG3      ARG   9  29.777   2.931   7.191
   54    HD2  ARG   9           HD2      ARG   9  28.681   0.858   7.728
   55    HD3  ARG   9           HD3      ARG   9  28.768   1.038   5.976
   56   HH11  ARG   9          HH11      ARG   9  27.502  -0.695   6.684
   57   HH12  ARG   9          HH12      ARG   9  27.464  -2.427   6.577
   58   HH21  ARG   9          HH21      ARG   9  30.971  -2.761   6.640
   59   HH22  ARG   9          HH22      ARG   9  29.455  -3.609   6.527
   60    H    LEU  10           H        LEU  10  31.734   4.403   3.415
   61    HA   LEU  10           HA       LEU  10  34.402   3.538   2.604
   62    HG   LEU  10           HG       LEU  10  32.142   1.928   1.732
   63    HB2  LEU  10           HB2      LEU  10  31.943   4.314   1.061
   64    HB3  LEU  10           HB3      LEU  10  33.517   4.201   0.293
   65   HD11  LEU  10          HD11      LEU  10  30.896   1.844  -0.126
   66   HD12  LEU  10          HD12      LEU  10  32.357   1.213  -0.884
   67   HD13  LEU  10          HD13      LEU  10  31.970   2.927  -1.010
   68   HD21  LEU  10          HD21      LEU  10  34.399   1.589  -0.170
   69   HD22  LEU  10          HD22      LEU  10  33.933   0.607   1.220
   70   HD23  LEU  10          HD23      LEU  10  34.760   2.147   1.462
   71    H    ILE  11           H        ILE  11  32.544   6.340   3.350
   72    HA   ILE  11           HA       ILE  11  34.243   8.269   2.071
   73    HB   ILE  11           HB       ILE  11  32.483   8.610   4.522
   74   HG12  ILE  11          HG12      ILE  11  31.224   7.874   2.520
   75   HG13  ILE  11          HG13      ILE  11  30.809   9.518   3.000
   76   HG21  ILE  11          HG21      ILE  11  32.952  10.928   2.810
   77   HG22  ILE  11          HG22      ILE  11  34.411  10.324   3.599
   78   HG23  ILE  11          HG23      ILE  11  33.010  10.784   4.567
   79   HD11  ILE  11          HD11      ILE  11  32.293   8.557   0.613
   80   HD12  ILE  11          HD12      ILE  11  32.632  10.167   1.248
   81   HD13  ILE  11          HD13      ILE  11  30.997   9.747   0.737
   82    H    GLU  12           H        GLU  12  34.530   6.100   4.587
   83    HA   GLU  12           HA       GLU  12  36.762   7.552   5.835
   84    HB2  GLU  12           HB2      GLU  12  35.242   6.454   7.406
   85    HB3  GLU  12           HB3      GLU  12  35.495   4.910   6.600
   86    HG2  GLU  12           HG2      GLU  12  37.849   4.953   7.236
   87    HG3  GLU  12           HG3      GLU  12  37.610   6.508   8.030
   88    H    SER  13           H        SER  13  36.192   4.218   4.700
   89    HA   SER  13           HA       SER  13  39.013   3.836   4.485
   90    HG   SER  13           HG       SER  13  37.650   1.214   6.054
   91    HB2  SER  13           HB2      SER  13  36.794   1.910   3.784
   92    HB3  SER  13           HB3      SER  13  38.482   1.510   4.107
   93    H    LEU  14           H        LEU  14  36.512   4.463   2.108
   94    HA   LEU  14           HA       LEU  14  38.286   3.597  -0.041
   95    HG   LEU  14           HG       LEU  14  36.625   5.096  -2.270
   96    HB2  LEU  14           HB2      LEU  14  35.912   2.999  -0.213
   97    HB3  LEU  14           HB3      LEU  14  35.471   4.694  -0.126
   98   HD11  LEU  14          HD11      LEU  14  38.309   3.453  -2.339
   99   HD12  LEU  14          HD12      LEU  14  37.178   3.032  -3.626
  100   HD13  LEU  14          HD13      LEU  14  37.150   2.142  -2.104
  101   HD21  LEU  14          HD21      LEU  14  34.512   4.816  -2.931
  102   HD22  LEU  14          HD22      LEU  14  34.276   3.416  -1.887
  103   HD23  LEU  14          HD23      LEU  14  35.025   3.217  -3.471
  104    H    SER  15           H        SER  15  36.646   6.431   1.230
  105    HA   SER  15           HA       SER  15  37.619   8.231  -0.667
  106    HG   SER  15           HG       SER  15  37.502  10.677   1.685
  107    HB2  SER  15           HB2      SER  15  35.722   8.777   0.759
  108    HB3  SER  15           HB3      SER  15  36.767   8.760   2.179
  109    H    GLN  16           H        GLN  16  39.104   6.843   2.138
  110    HA   GLN  16           HA       GLN  16  41.221   8.650   2.575
  111    HB2  GLN  16           HB2      GLN  16  40.636   6.669   4.028
  112    HB3  GLN  16           HB3      GLN  16  41.339   5.627   2.801
  113    HG2  GLN  16           HG2      GLN  16  42.975   7.826   3.979
  114    HG3  GLN  16           HG3      GLN  16  42.718   6.348   4.896
  115   HE21  GLN  16          HE21      GLN  16  42.615   5.097   2.012
  116   HE22  GLN  16          HE22      GLN  16  44.288   4.832   1.658
  117    H    MET  17           H        MET  17  40.906   5.847   0.445
  118    HA   MET  17           HA       MET  17  43.472   6.208  -0.750
  119    HB2  MET  17           HB2      MET  17  41.099   4.477  -1.435
  120    HB3  MET  17           HB3      MET  17  42.582   4.481  -2.380
  121    HG2  MET  17           HG2      MET  17  43.855   3.693  -0.515
  122    HG3  MET  17           HG3      MET  17  42.472   3.867   0.563
  123    HE1  MET  17           HE1      MET  17  40.114   1.062  -0.419
  124    HE2  MET  17           HE2      MET  17  40.052   2.558  -1.351
  125    HE3  MET  17           HE3      MET  17  40.344   2.612   0.389
  126    H    LEU  18           H        LEU  18  40.132   6.869  -1.723
  127    HA   LEU  18           HA       LEU  18  40.599   7.658  -4.348
  128    HG   LEU  18           HG       LEU  18  38.532   9.869  -4.723
  129    HB2  LEU  18           HB2      LEU  18  38.385   7.232  -3.258
  130    HB3  LEU  18           HB3      LEU  18  38.513   8.806  -2.496
  131   HD11  LEU  18          HD11      LEU  18  37.496   7.761  -6.302
  132   HD12  LEU  18          HD12      LEU  18  39.011   7.201  -5.589
  133   HD13  LEU  18          HD13      LEU  18  38.976   8.684  -6.544
  134   HD21  LEU  18          HD21      LEU  18  36.424   9.810  -3.691
  135   HD22  LEU  18          HD22      LEU  18  36.235   8.081  -3.981
  136   HD23  LEU  18          HD23      LEU  18  36.148   9.214  -5.328
  137    H    SER  19           H        SER  19  40.990   9.479  -1.375
  138    HA   SER  19           HA       SER  19  41.407  11.964  -2.809
  139    HG   SER  19           HG       SER  19  41.604  13.810  -1.249
  140    HB2  SER  19           HB2      SER  19  40.208  12.013  -0.680
  141    HB3  SER  19           HB3      SER  19  41.606  11.320   0.142
  142    H    MET  20           H        MET  20  43.338   9.478  -1.266
  143    HA   MET  20           HA       MET  20  45.724  11.072  -1.208
  144    HB2  MET  20           HB2      MET  20  45.261   9.298   0.450
  145    HB3  MET  20           HB3      MET  20  45.410   8.094  -0.822
  146    HG2  MET  20           HG2      MET  20  47.428   8.231   0.522
  147    HG3  MET  20           HG3      MET  20  47.738   8.693  -1.151
  148    HE1  MET  20           HE1      MET  20  49.750   9.175   1.061
  149    HE2  MET  20           HE2      MET  20  50.197  10.879   1.019
  150    HE3  MET  20           HE3      MET  20  50.104   9.956  -0.481
  151    H    GLY  21           H        GLY  21  44.360   8.722  -3.448
  152    HA2  GLY  21           HA2      GLY  21  45.024   9.049  -5.776
  153    HA3  GLY  21           HA3      GLY  21  46.668   9.304  -5.205
  154    H    PHE  22           H        PHE  22  44.762   6.718  -3.866
  155    HA   PHE  22           HA       PHE  22  45.757   4.852  -5.821
  156    HD1  PHE  22           HD2      PHE  22  44.761   5.687  -2.413
  157    HD2  PHE  22           HD1      PHE  22  48.467   3.619  -2.185
  158    HE1  PHE  22           HE2      PHE  22  44.926   6.247  -0.022
  159    HE2  PHE  22           HE1      PHE  22  48.630   4.163   0.202
  160    HZ   PHE  22           HZ       PHE  22  46.862   5.479   1.289
  161    HB2  PHE  22           HB2      PHE  22  46.344   3.182  -3.971
  162    HB3  PHE  22           HB3      PHE  22  47.509   4.434  -4.358
  163    H    SER  23           H        SER  23  44.648   2.627  -5.480
  164    HA   SER  23           HA       SER  23  42.132   2.845  -4.085
  165    HG   SER  23           HG       SER  23  41.895   4.797  -5.322
  166    HB2  SER  23           HB2      SER  23  42.289   2.954  -7.088
  167    HB3  SER  23           HB3      SER  23  40.841   2.413  -6.243
  168    H    ASP  24           H        ASP  24  42.480   1.108  -7.029
  169    HA   ASP  24           HA       ASP  24  42.543  -1.422  -5.528
  170    HB2  ASP  24           HB2      ASP  24  40.388  -0.832  -6.703
  171    HB3  ASP  24           HB3      ASP  24  41.268  -0.925  -8.227
  172    H    GLU  25           H        GLU  25  44.258  -2.638  -5.884
  173    HA   GLU  25           HA       GLU  25  46.262  -2.040  -7.776
  174    HB2  GLU  25           HB2      GLU  25  46.568  -3.388  -5.660
  175    HB3  GLU  25           HB3      GLU  25  45.803  -4.732  -6.494
  176    HG2  GLU  25           HG2      GLU  25  47.606  -4.524  -8.235
  177    HG3  GLU  25           HG3      GLU  25  48.418  -3.415  -7.129
  178    H    GLY  26           H        GLY  26  43.390  -3.987  -7.915
  179    HA2  GLY  26           HA2      GLY  26  42.914  -3.800 -10.511
  180    HA3  GLY  26           HA3      GLY  26  44.139  -5.056 -10.531
  181    H    GLY  27           H        GLY  27  41.436  -4.671  -8.181
  182    HA2  GLY  27           HA2      GLY  27  39.407  -5.900  -9.194
  183    HA3  GLY  27           HA3      GLY  27  40.472  -7.291  -9.132
  184    H    TRP  28           H        TRP  28  41.463  -5.938  -6.447
  185    HA   TRP  28           HA       TRP  28  39.565  -7.530  -4.924
  186    HD1  TRP  28           HD1      TRP  28  43.907  -6.976  -5.690
  187    HE1  TRP  28           HE1      TRP  28  45.333  -4.903  -5.178
  188    HE3  TRP  28           HE3      TRP  28  41.045  -4.852  -2.024
  189    HZ2  TRP  28           HZ2      TRP  28  45.258  -2.667  -3.491
  190    HZ3  TRP  28           HZ3      TRP  28  41.791  -2.736  -1.022
  191    HH2  TRP  28           HH2      TRP  28  43.858  -1.666  -1.743
  192    HB2  TRP  28           HB2      TRP  28  41.244  -7.340  -3.075
  193    HB3  TRP  28           HB3      TRP  28  41.865  -8.094  -4.547
  194    H    LEU  29           H        LEU  29  40.135  -4.198  -5.443
  195    HA   LEU  29           HA       LEU  29  39.904  -3.144  -2.938
  196    HG   LEU  29           HG       LEU  29  37.776  -0.860  -3.644
  197    HB2  LEU  29           HB2      LEU  29  40.456  -1.720  -4.724
  198    HB3  LEU  29           HB3      LEU  29  38.949  -2.032  -5.556
  199   HD11  LEU  29          HD11      LEU  29  40.592  -0.009  -2.974
  200   HD12  LEU  29          HD12      LEU  29  39.594  -1.099  -2.009
  201   HD13  LEU  29          HD13      LEU  29  39.109   0.584  -2.224
  202   HD21  LEU  29          HD21      LEU  29  37.765   0.631  -5.312
  203   HD22  LEU  29          HD22      LEU  29  39.439   0.289  -5.751
  204   HD23  LEU  29          HD23      LEU  29  39.082   1.410  -4.439
  205    H    THR  30           H        THR  30  37.231  -4.306  -4.914
  206    HA   THR  30           HA       THR  30  35.274  -3.364  -2.987
  207    HB   THR  30           HB       THR  30  33.632  -4.439  -4.473
  208    HG1  THR  30           HG1      THR  30  34.447  -6.122  -5.454
  209   HG21  THR  30          HG21      THR  30  35.522  -3.028  -6.302
  210   HG22  THR  30          HG22      THR  30  34.693  -2.156  -5.012
  211   HG23  THR  30          HG23      THR  30  33.760  -2.983  -6.259
  212    H    ARG  31           H        ARG  31  37.239  -6.104  -3.444
  213    HA   ARG  31           HA       ARG  31  35.436  -7.912  -2.034
  214    HE   ARG  31           HE       ARG  31  39.236  -9.429  -6.073
  215    HB2  ARG  31           HB2      ARG  31  38.208  -8.629  -2.943
  216    HB3  ARG  31           HB3      ARG  31  36.793  -9.661  -2.789
  217    HG2  ARG  31           HG2      ARG  31  35.782  -8.342  -4.700
  218    HG3  ARG  31           HG3      ARG  31  37.375  -7.630  -4.928
  219    HD2  ARG  31           HD2      ARG  31  36.777 -10.587  -5.001
  220    HD3  ARG  31           HD3      ARG  31  36.932  -9.553  -6.419
  221   HH11  ARG  31          HH11      ARG  31  37.668 -11.357  -3.611
  222   HH12  ARG  31          HH12      ARG  31  39.156 -12.046  -3.028
  223   HH21  ARG  31          HH21      ARG  31  41.183 -10.323  -5.306
  224   HH22  ARG  31          HH22      ARG  31  41.156 -11.426  -3.957
  225    H    LEU  32           H        LEU  32  38.772  -6.760  -1.737
  226    HA   LEU  32           HA       LEU  32  39.524  -7.907   0.649
  227    HG   LEU  32           HG       LEU  32  42.588  -5.791   0.358
  228    HB2  LEU  32           HB2      LEU  32  40.846  -6.528  -1.049
  229    HB3  LEU  32           HB3      LEU  32  40.254  -5.109  -0.208
  230   HD11  LEU  32          HD11      LEU  32  42.276  -4.672   2.227
  231   HD12  LEU  32          HD12      LEU  32  41.510  -6.072   2.978
  232   HD13  LEU  32          HD13      LEU  32  40.537  -4.918   2.068
  233   HD21  LEU  32          HD21      LEU  32  42.432  -8.158   0.319
  234   HD22  LEU  32          HD22      LEU  32  41.183  -8.158   1.565
  235   HD23  LEU  32          HD23      LEU  32  42.830  -7.673   1.966
  236    H    LEU  33           H        LEU  33  38.606  -4.472   0.419
  237    HA   LEU  33           HA       LEU  33  38.346  -4.080   3.145
  238    HG   LEU  33           HG       LEU  33  39.490  -2.012   2.555
  239    HB2  LEU  33           HB2      LEU  33  37.083  -2.606   0.842
  240    HB3  LEU  33           HB3      LEU  33  36.929  -2.076   2.509
  241   HD11  LEU  33          HD11      LEU  33  38.986  -2.535  -0.331
  242   HD12  LEU  33          HD12      LEU  33  40.296  -3.092   0.711
  243   HD13  LEU  33          HD13      LEU  33  40.286  -1.430   0.120
  244   HD21  LEU  33          HD21      LEU  33  38.262  -0.060   0.639
  245   HD22  LEU  33          HD22      LEU  33  39.504   0.216   1.858
  246   HD23  LEU  33          HD23      LEU  33  37.836  -0.077   2.349
  247    H    GLN  34           H        GLN  34  35.803  -4.823   0.797
  248    HA   GLN  34           HA       GLN  34  33.584  -4.424   2.346
  249    HB2  GLN  34           HB2      GLN  34  34.141  -5.522  -0.131
  250    HB3  GLN  34           HB3      GLN  34  33.312  -6.816   0.719
  251    HG2  GLN  34           HG2      GLN  34  31.613  -5.687  -0.374
  252    HG3  GLN  34           HG3      GLN  34  31.535  -5.066   1.271
  253   HE21  GLN  34          HE21      GLN  34  34.106  -3.525   0.524
  254   HE22  GLN  34          HE22      GLN  34  33.506  -2.140  -0.315
  255    H    THR  35           H        THR  35  35.608  -7.333   2.290
  256    HA   THR  35           HA       THR  35  33.827  -8.632   4.191
  257    HB   THR  35           HB       THR  35  35.360 -10.591   3.856
  258    HG1  THR  35           HG1      THR  35  36.505  -8.935   1.841
  259   HG21  THR  35          HG21      THR  35  33.363  -9.709   2.222
  260   HG22  THR  35          HG22      THR  35  34.165 -11.277   2.111
  261   HG23  THR  35          HG23      THR  35  34.701  -9.939   1.092
  262    H    LYS  36           H        LYS  36  36.331  -6.525   4.441
  263    HA   LYS  36           HA       LYS  36  37.177  -7.651   7.030
  264    HB2  LYS  36           HB2      LYS  36  38.753  -5.806   5.227
  265    HB3  LYS  36           HB3      LYS  36  39.288  -6.440   6.778
  266    HG2  LYS  36           HG2      LYS  36  39.125  -8.734   5.821
  267    HG3  LYS  36           HG3      LYS  36  38.775  -8.000   4.254
  268    HD2  LYS  36           HD2      LYS  36  41.127  -8.566   4.400
  269    HD3  LYS  36           HD3      LYS  36  40.930  -6.813   4.353
  270    HE2  LYS  36           HE2      LYS  36  42.609  -7.592   6.014
  271    HE3  LYS  36           HE3      LYS  36  41.299  -6.640   6.712
  272    HZ1  LYS  36           HZ1      LYS  36  40.722  -8.329   8.012
  273    HZ2  LYS  36           HZ2      LYS  36  42.136  -9.133   7.520
  274    HZ3  LYS  36           HZ3      LYS  36  40.672  -9.419   6.715
  275    H    ASN  37           H        ASN  37  34.847  -6.112   6.692
  276    HA   ASN  37           HA       ASN  37  33.754  -4.193   7.204
  277    HB2  ASN  37           HB2      ASN  37  34.181  -3.325   9.503
  278    HB3  ASN  37           HB3      ASN  37  33.929  -5.063   9.421
  279   HD21  ASN  37          HD21      ASN  37  35.960  -2.562  10.440
  280   HD22  ASN  37          HD22      ASN  37  37.276  -3.532  11.000
  281    H    TYR  38           H        TYR  38  35.536  -3.644   5.326
  282    HA   TYR  38           HA       TYR  38  36.577  -1.994   4.217
  283    HD1  TYR  38           HD1      TYR  38  35.215  -1.034   2.642
  284    HD2  TYR  38           HD2      TYR  38  32.936  -0.464   6.181
  285    HE1  TYR  38           HE1      TYR  38  33.150  -1.421   1.370
  286    HE2  TYR  38           HE2      TYR  38  30.867  -0.842   4.909
  287    HH   TYR  38           HH       TYR  38  30.277  -2.144   2.708
  288    HB2  TYR  38           HB2      TYR  38  35.230  -0.285   6.310
  289    HB3  TYR  38           HB3      TYR  38  36.013   0.342   4.860
  290    H    ASP  39           H        ASP  39  38.548  -2.954   4.847
  291    HA   ASP  39           HA       ASP  39  40.043  -1.635   6.988
  292    HB2  ASP  39           HB2      ASP  39  39.882  -4.231   6.399
  293    HB3  ASP  39           HB3      ASP  39  41.208  -3.814   5.316
  294    H    ILE  40           H        ILE  40  41.376   0.005   6.517
  295    HA   ILE  40           HA       ILE  40  42.360   0.333   3.786
  296    HB   ILE  40           HB       ILE  40  43.476   2.424   4.829
  297   HG12  ILE  40          HG12      ILE  40  42.677   1.541   7.199
  298   HG13  ILE  40          HG13      ILE  40  42.754   3.264   6.847
  299   HG21  ILE  40          HG21      ILE  40  40.851   3.336   4.840
  300   HG22  ILE  40          HG22      ILE  40  40.847   1.930   3.773
  301   HG23  ILE  40          HG23      ILE  40  41.954   3.267   3.466
  302   HD11  ILE  40          HD11      ILE  40  40.415   1.515   7.284
  303   HD12  ILE  40          HD12      ILE  40  40.243   2.815   6.101
  304   HD13  ILE  40          HD13      ILE  40  40.694   3.187   7.765
  305    H    GLY  41           H        GLY  41  43.231  -0.843   6.859
  306    HA2  GLY  41           HA2      GLY  41  46.003  -0.457   6.764
  307    HA3  GLY  41           HA3      GLY  41  45.191  -1.687   7.702
  308    H    ALA  42           H        ALA  42  44.011  -3.146   5.749
  309    HA   ALA  42           HA       ALA  42  46.284  -4.543   4.620
  310    HB1  ALA  42           HB1      ALA  42  44.879  -6.364   4.272
  311    HB2  ALA  42           HB2      ALA  42  43.436  -5.354   4.180
  312    HB3  ALA  42           HB3      ALA  42  44.223  -5.629   5.735
  313    H    ALA  43           H        ALA  43  43.894  -2.325   3.598
  314    HA   ALA  43           HA       ALA  43  43.899  -2.948   0.822
  315    HB1  ALA  43           HB1      ALA  43  42.577  -1.088   0.520
  316    HB2  ALA  43           HB2      ALA  43  43.379  -0.175   1.797
  317    HB3  ALA  43           HB3      ALA  43  42.252  -1.468   2.210
  318    H    LEU  44           H        LEU  44  45.642  -0.540   2.769
  319    HA   LEU  44           HA       LEU  44  47.076   0.554   0.588
  320    HG   LEU  44           HG       LEU  44  47.214   2.886   1.478
  321    HB2  LEU  44           HB2      LEU  44  47.322   0.691   3.560
  322    HB3  LEU  44           HB3      LEU  44  48.669   1.247   2.577
  323   HD11  LEU  44          HD11      LEU  44  45.105   1.504   3.056
  324   HD12  LEU  44          HD12      LEU  44  45.053   2.145   1.413
  325   HD13  LEU  44          HD13      LEU  44  44.958   3.242   2.792
  326   HD21  LEU  44          HD21      LEU  44  46.733   3.255   4.397
  327   HD22  LEU  44          HD22      LEU  44  47.258   4.427   3.188
  328   HD23  LEU  44          HD23      LEU  44  48.385   3.209   3.783
  329    H    ASP  45           H        ASP  45  47.603  -2.195   2.644
  330    HA   ASP  45           HA       ASP  45  50.356  -2.626   2.134
  331    HB2  ASP  45           HB2      ASP  45  48.945  -3.684   3.955
  332    HB3  ASP  45           HB3      ASP  45  48.260  -4.726   2.716
  333    H    THR  46           H        THR  46  47.458  -3.328   0.320
  334    HA   THR  46           HA       THR  46  48.922  -5.112  -1.432
  335    HB   THR  46           HB       THR  46  46.575  -5.339  -2.496
  336    HG1  THR  46           HG1      THR  46  45.265  -3.900  -1.672
  337   HG21  THR  46          HG21      THR  46  46.557  -6.219   0.347
  338   HG22  THR  46          HG22      THR  46  47.756  -6.889  -0.764
  339   HG23  THR  46          HG23      THR  46  46.034  -7.074  -1.104
  340    H    ILE  47           H        ILE  47  47.489  -1.854  -1.632
  341    HA   ILE  47           HA       ILE  47  47.650  -1.912  -4.505
  342    HB   ILE  47           HB       ILE  47  47.308   0.699  -4.107
  343   HG12  ILE  47          HG12      ILE  47  46.298  -0.583  -1.565
  344   HG13  ILE  47          HG13      ILE  47  47.536   0.664  -1.702
  345   HG21  ILE  47          HG21      ILE  47  45.721  -1.414  -4.853
  346   HG22  ILE  47          HG22      ILE  47  45.303   0.294  -4.954
  347   HG23  ILE  47          HG23      ILE  47  44.799  -0.653  -3.555
  348   HD11  ILE  47          HD11      ILE  47  44.980   1.388  -2.908
  349   HD12  ILE  47          HD12      ILE  47  46.025   2.298  -1.816
  350   HD13  ILE  47          HD13      ILE  47  44.905   1.097  -1.171
  351    H    GLN  48           H        GLN  48  49.784  -0.653  -1.988
  352    HA   GLN  48           HA       GLN  48  51.860  -0.226  -3.937
  353    HB2  GLN  48           HB2      GLN  48  50.371   2.107  -2.803
  354    HB3  GLN  48           HB3      GLN  48  52.098   2.261  -3.074
  355    HG2  GLN  48           HG2      GLN  48  51.795   2.597  -5.240
  356    HG3  GLN  48           HG3      GLN  48  50.825   1.125  -5.385
  357   HE21  GLN  48          HE21      GLN  48  48.863   1.414  -6.084
  358   HE22  GLN  48          HE22      GLN  48  47.900   2.849  -5.912
  359    H    TYR  49           H        TYR  49  50.775   0.202  -0.602
  360    HA   TYR  49           HA       TYR  49  53.531   0.415   0.305
  361    HD1  TYR  49           HD1      TYR  49  53.953   2.499   0.963
  362    HD2  TYR  49           HD2      TYR  49  49.769   2.474   1.727
  363    HE1  TYR  49           HE1      TYR  49  53.860   4.910   0.502
  364    HE2  TYR  49           HE2      TYR  49  49.666   4.883   1.264
  365    HH   TYR  49           HH       TYR  49  51.148   6.535  -0.202
  366    HB2  TYR  49           HB2      TYR  49  50.918   0.488   1.832
  367    HB3  TYR  49           HB3      TYR  49  52.508   0.694   2.563
  368    H    SER  50           H        SER  50  53.435  -0.833   2.737
  369    HA   SER  50           HA       SER  50  52.568  -3.563   2.425
  370    HG   SER  50           HG       SER  50  53.848  -3.405   0.502
  371    HB2  SER  50           HB2      SER  50  55.524  -2.900   2.526
  372    HB3  SER  50           HB3      SER  50  54.852  -4.517   2.743
  373    H    LYS  51           H        LYS  51  51.979  -1.453   4.241
  374    HA   LYS  51           HA       LYS  51  52.941  -2.681   6.737
  375    HB2  LYS  51           HB2      LYS  51  52.433   0.263   6.240
  376    HB3  LYS  51           HB3      LYS  51  52.697  -0.440   7.826
  377    HG2  LYS  51           HG2      LYS  51  54.778   0.390   7.314
  378    HG3  LYS  51           HG3      LYS  51  54.923  -1.293   6.810
  379    HD2  LYS  51           HD2      LYS  51  54.564  -0.682   4.504
  380    HD3  LYS  51           HD3      LYS  51  54.252   0.996   4.959
  381    HE2  LYS  51           HE2      LYS  51  56.849  -0.498   5.320
  382    HE3  LYS  51           HE3      LYS  51  56.516   0.720   4.087
  383    HZ1  LYS  51           HZ1      LYS  51  57.371   1.078   6.765
  384    HZ2  LYS  51           HZ2      LYS  51  55.894   1.893   6.523
  385    HZ3  LYS  51           HZ3      LYS  51  57.225   2.232   5.527
  386    H    HIS  52           H        HIS  52  51.089  -3.984   6.868
  387    HA   HIS  52           HA       HIS  52  48.509  -2.631   6.920
  388    HD1  HIS  52           HD1      HIS  52  48.146  -7.489   6.096
  389    HD2  HIS  52           HD2      HIS  52  50.891  -5.419   8.430
  390    HE1  HIS  52           HE1      HIS  52  49.687  -9.228   7.084
  391    HB2  HIS  52           HB2      HIS  52  47.511  -4.877   6.989
  392    HB3  HIS  52           HB3      HIS  52  48.601  -4.690   5.625
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1  20.784  -0.554  -4.701
    2    H2   GLY   1           2H       GLY   1  20.631   0.944  -3.919
    3    H3   GLY   1           3H       GLY   1  20.251  -0.487  -3.094
    4    HA2  GLY   1           HA2      GLY   1  22.315  -0.705  -2.386
    5    HA3  GLY   1           HA3      GLY   1  22.878  -0.705  -4.052
    6    H    SER   2           H        SER   2  23.681   0.607  -1.348
    7    HA   SER   2           HA       SER   2  23.628   3.420  -1.971
    8    HG   SER   2           HG       SER   2  22.992   1.581   0.411
    9    HB2  SER   2           HB2      SER   2  25.228   1.961   0.146
   10    HB3  SER   2           HB3      SER   2  24.884   3.691   0.089
   11    HA   PRO   3           HA       PRO   3  27.222   3.465  -4.580
   12    HB2  PRO   3           HB2      PRO   3  27.597   6.208  -3.525
   13    HB3  PRO   3           HB3      PRO   3  27.411   5.662  -5.196
   14    HG2  PRO   3           HG2      PRO   3  25.431   6.946  -3.948
   15    HG3  PRO   3           HG3      PRO   3  25.095   5.601  -5.056
   16    HD2  PRO   3           HD2      PRO   3  25.120   5.629  -2.061
   17    HD3  PRO   3           HD3      PRO   3  23.996   4.814  -3.171
   18    HA   PRO   4           HA       PRO   4  30.202   2.611  -1.320
   19    HB2  PRO   4           HB2      PRO   4  31.809   1.355  -3.389
   20    HB3  PRO   4           HB3      PRO   4  30.957   0.600  -2.042
   21    HG2  PRO   4           HG2      PRO   4  30.218   0.284  -4.643
   22    HG3  PRO   4           HG3      PRO   4  29.077   0.198  -3.289
   23    HD2  PRO   4           HD2      PRO   4  29.614   2.459  -5.178
   24    HD3  PRO   4           HD3      PRO   4  28.067   1.877  -4.526
   25    H    GLU   5           H        GLU   5  30.281   5.201  -2.517
   26    HA   GLU   5           HA       GLU   5  33.179   5.617  -2.525
   27    HB2  GLU   5           HB2      GLU   5  31.318   6.776  -4.607
   28    HB3  GLU   5           HB3      GLU   5  33.014   7.186  -4.423
   29    HG2  GLU   5           HG2      GLU   5  33.676   4.960  -5.037
   30    HG3  GLU   5           HG3      GLU   5  31.993   4.434  -5.072
   31    H    ALA   6           H        ALA   6  30.523   6.188  -1.006
   32    HA   ALA   6           HA       ALA   6  31.329   8.576   0.279
   33    HB1  ALA   6           HB1      ALA   6  29.755  10.163  -0.462
   34    HB2  ALA   6           HB2      ALA   6  28.822   8.955  -1.343
   35    HB3  ALA   6           HB3      ALA   6  30.404   9.457  -1.943
   36    H    ASP   7           H        ASP   7  30.724   6.079   1.080
   37    HA   ASP   7           HA       ASP   7  28.056   6.253   2.298
   38    HB2  ASP   7           HB2      ASP   7  28.569   4.226   0.918
   39    HB3  ASP   7           HB3      ASP   7  29.913   3.865   1.990
   40    HA   PRO   8           HA       PRO   8  29.742   7.397   6.226
   41    HB2  PRO   8           HB2      PRO   8  28.142   5.087   7.242
   42    HB3  PRO   8           HB3      PRO   8  28.228   6.745   7.845
   43    HG2  PRO   8           HG2      PRO   8  26.155   5.888   6.369
   44    HG3  PRO   8           HG3      PRO   8  26.769   7.545   6.244
   45    HD2  PRO   8           HD2      PRO   8  26.996   5.305   4.326
   46    HD3  PRO   8           HD3      PRO   8  27.086   7.054   4.040
   47    H    ARG   9           H        ARG   9  29.941   4.134   5.043
   48    HA   ARG   9           HA       ARG   9  31.922   3.319   7.016
   49    HE   ARG   9           HE       ARG   9  29.703  -0.775   4.593
   50    HB2  ARG   9           HB2      ARG   9  30.739   1.852   4.652
   51    HB3  ARG   9           HB3      ARG   9  31.760   1.135   5.905
   52    HG2  ARG   9           HG2      ARG   9  29.988   1.847   7.572
   53    HG3  ARG   9           HG3      ARG   9  28.965   2.220   6.185
   54    HD2  ARG   9           HD2      ARG   9  30.177  -0.476   6.813
   55    HD3  ARG   9           HD3      ARG   9  28.500  -0.012   7.091
   56   HH11  ARG   9          HH11      ARG   9  27.062   0.956   6.091
   57   HH12  ARG   9          HH12      ARG   9  26.068   0.914   4.669
   58   HH21  ARG   9          HH21      ARG   9  28.391  -0.863   2.743
   59   HH22  ARG   9          HH22      ARG   9  26.816  -0.129   2.772
   60    H    LEU  10           H        LEU  10  31.711   4.071   3.550
   61    HA   LEU  10           HA       LEU  10  34.525   3.450   3.235
   62    HG   LEU  10           HG       LEU  10  32.815   1.535   2.236
   63    HB2  LEU  10           HB2      LEU  10  32.262   3.821   1.317
   64    HB3  LEU  10           HB3      LEU  10  33.922   3.921   0.762
   65   HD11  LEU  10          HD11      LEU  10  32.872   2.199  -0.675
   66   HD12  LEU  10          HD12      LEU  10  31.588   1.459   0.284
   67   HD13  LEU  10          HD13      LEU  10  33.023   0.526  -0.138
   68   HD21  LEU  10          HD21      LEU  10  34.924   0.867   2.296
   69   HD22  LEU  10          HD22      LEU  10  35.436   2.343   1.478
   70   HD23  LEU  10          HD23      LEU  10  34.983   0.925   0.534
   71    H    ILE  11           H        ILE  11  32.628   6.171   3.828
   72    HA   ILE  11           HA       ILE  11  34.156   8.063   2.324
   73    HB   ILE  11           HB       ILE  11  31.923   8.634   3.148
   74   HG12  ILE  11          HG12      ILE  11  34.078  10.361   4.383
   75   HG13  ILE  11          HG13      ILE  11  33.517  10.446   2.714
   76   HG21  ILE  11          HG21      ILE  11  31.695   7.540   5.194
   77   HG22  ILE  11          HG22      ILE  11  31.731   9.253   5.611
   78   HG23  ILE  11          HG23      ILE  11  33.168   8.259   5.848
   79   HD11  ILE  11          HD11      ILE  11  31.711  10.889   5.070
   80   HD12  ILE  11          HD12      ILE  11  31.402  11.261   3.375
   81   HD13  ILE  11          HD13      ILE  11  32.605  12.185   4.275
   82    H    GLU  12           H        GLU  12  34.642   6.263   5.180
   83    HA   GLU  12           HA       GLU  12  37.020   7.849   5.865
   84    HB2  GLU  12           HB2      GLU  12  35.537   5.708   7.360
   85    HB3  GLU  12           HB3      GLU  12  37.206   6.094   7.761
   86    HG2  GLU  12           HG2      GLU  12  36.257   7.535   9.189
   87    HG3  GLU  12           HG3      GLU  12  36.131   8.562   7.763
   88    H    SER  13           H        SER  13  36.009   4.857   4.414
   89    HA   SER  13           HA       SER  13  38.668   3.720   4.644
   90    HG   SER  13           HG       SER  13  35.638   2.568   5.526
   91    HB2  SER  13           HB2      SER  13  36.161   2.517   3.459
   92    HB3  SER  13           HB3      SER  13  37.656   1.661   3.844
   93    H    LEU  14           H        LEU  14  36.430   4.508   1.972
   94    HA   LEU  14           HA       LEU  14  38.551   3.992   0.048
   95    HG   LEU  14           HG       LEU  14  36.022   3.569  -2.619
   96    HB2  LEU  14           HB2      LEU  14  36.306   3.087  -0.388
   97    HB3  LEU  14           HB3      LEU  14  35.631   4.699  -0.309
   98   HD11  LEU  14          HD11      LEU  14  36.863   6.409  -2.052
   99   HD12  LEU  14          HD12      LEU  14  35.233   5.835  -2.405
  100   HD13  LEU  14          HD13      LEU  14  36.481   5.765  -3.649
  101   HD21  LEU  14          HD21      LEU  14  38.330   2.937  -2.306
  102   HD22  LEU  14          HD22      LEU  14  38.781   4.619  -2.021
  103   HD23  LEU  14          HD23      LEU  14  38.202   4.118  -3.609
  104    H    SER  15           H        SER  15  36.414   6.555   1.190
  105    HA   SER  15           HA       SER  15  37.352   8.466  -0.592
  106    HG   SER  15           HG       SER  15  34.334   9.319   0.358
  107    HB2  SER  15           HB2      SER  15  36.158   8.972   2.129
  108    HB3  SER  15           HB3      SER  15  36.244  10.124   0.793
  109    H    GLN  16           H        GLN  16  38.906   7.194   2.195
  110    HA   GLN  16           HA       GLN  16  40.546   9.526   2.643
  111    HB2  GLN  16           HB2      GLN  16  41.782   8.185   4.242
  112    HB3  GLN  16           HB3      GLN  16  40.059   8.001   4.509
  113    HG2  GLN  16           HG2      GLN  16  40.748   5.849   4.739
  114    HG3  GLN  16           HG3      GLN  16  40.370   5.868   3.018
  115   HE21  GLN  16          HE21      GLN  16  41.772   4.553   2.087
  116   HE22  GLN  16          HE22      GLN  16  43.488   4.593   2.292
  117    H    MET  17           H        MET  17  40.712   6.654   0.660
  118    HA   MET  17           HA       MET  17  43.495   7.231   0.004
  119    HB2  MET  17           HB2      MET  17  43.426   5.154  -1.301
  120    HB3  MET  17           HB3      MET  17  42.947   4.892   0.365
  121    HG2  MET  17           HG2      MET  17  40.614   4.808  -0.289
  122    HG3  MET  17           HG3      MET  17  41.053   5.154  -1.961
  123    HE1  MET  17           HE1      MET  17  42.655   1.456   0.183
  124    HE2  MET  17           HE2      MET  17  41.121   2.061   0.815
  125    HE3  MET  17           HE3      MET  17  42.543   3.101   0.810
  126    H    LEU  18           H        LEU  18  40.284   7.584  -1.234
  127    HA   LEU  18           HA       LEU  18  40.768   7.842  -3.967
  128    HG   LEU  18           HG       LEU  18  38.830  10.148  -4.662
  129    HB2  LEU  18           HB2      LEU  18  38.540   7.742  -2.858
  130    HB3  LEU  18           HB3      LEU  18  38.773   9.394  -2.316
  131   HD11  LEU  18          HD11      LEU  18  39.052   7.323  -5.149
  132   HD12  LEU  18          HD12      LEU  18  39.286   8.676  -6.255
  133   HD13  LEU  18          HD13      LEU  18  37.675   8.002  -6.016
  134   HD21  LEU  18          HD21      LEU  18  36.357   8.509  -4.393
  135   HD22  LEU  18          HD22      LEU  18  36.548  10.185  -4.911
  136   HD23  LEU  18          HD23      LEU  18  36.695   9.767  -3.204
  137    H    SER  19           H        SER  19  41.053  10.248  -1.391
  138    HA   SER  19           HA       SER  19  41.510  12.457  -3.104
  139    HG   SER  19           HG       SER  19  40.261  13.145   0.174
  140    HB2  SER  19           HB2      SER  19  42.273  12.120  -0.197
  141    HB3  SER  19           HB3      SER  19  42.147  13.645  -1.074
  142    H    MET  20           H        MET  20  43.693  10.209  -1.460
  143    HA   MET  20           HA       MET  20  46.004  11.766  -2.170
  144    HB2  MET  20           HB2      MET  20  45.656   9.131  -0.753
  145    HB3  MET  20           HB3      MET  20  47.242   9.761  -1.169
  146    HG2  MET  20           HG2      MET  20  46.713  10.295   1.119
  147    HG3  MET  20           HG3      MET  20  46.792  11.767   0.158
  148    HE1  MET  20           HE1      MET  20  45.720  13.017   2.117
  149    HE2  MET  20           HE2      MET  20  45.348  11.626   3.134
  150    HE3  MET  20           HE3      MET  20  44.079  12.777   2.716
  151    H    GLY  21           H        GLY  21  44.325   9.043  -3.532
  152    HA2  GLY  21           HA2      GLY  21  44.705   8.623  -5.904
  153    HA3  GLY  21           HA3      GLY  21  46.417   8.927  -5.615
  154    H    PHE  22           H        PHE  22  44.081   6.915  -3.854
  155    HA   PHE  22           HA       PHE  22  45.611   4.541  -4.642
  156    HD1  PHE  22           HD1      PHE  22  46.155   7.170  -2.253
  157    HD2  PHE  22           HD2      PHE  22  47.289   3.102  -1.738
  158    HE1  PHE  22           HE1      PHE  22  48.365   7.891  -1.453
  159    HE2  PHE  22           HE2      PHE  22  49.502   3.817  -0.937
  160    HZ   PHE  22           HZ       PHE  22  50.043   6.212  -0.792
  161    HB2  PHE  22           HB2      PHE  22  44.474   5.102  -1.884
  162    HB3  PHE  22           HB3      PHE  22  45.153   3.563  -2.397
  163    H    SER  23           H        SER  23  44.277   2.714  -4.992
  164    HA   SER  23           HA       SER  23  41.418   3.079  -4.655
  165    HG   SER  23           HG       SER  23  41.864   4.925  -5.995
  166    HB2  SER  23           HB2      SER  23  42.767   2.888  -7.350
  167    HB3  SER  23           HB3      SER  23  41.055   2.546  -7.118
  168    H    ASP  24           H        ASP  24  41.980   0.991  -7.172
  169    HA   ASP  24           HA       ASP  24  42.505  -1.285  -5.405
  170    HB2  ASP  24           HB2      ASP  24  41.101  -2.683  -6.997
  171    HB3  ASP  24           HB3      ASP  24  40.218  -1.592  -5.933
  172    H    GLU  25           H        GLU  25  43.883  -2.812  -6.180
  173    HA   GLU  25           HA       GLU  25  45.739  -2.035  -8.186
  174    HB2  GLU  25           HB2      GLU  25  46.390  -3.458  -6.294
  175    HB3  GLU  25           HB3      GLU  25  45.313  -4.721  -6.873
  176    HG2  GLU  25           HG2      GLU  25  46.758  -4.581  -9.028
  177    HG3  GLU  25           HG3      GLU  25  47.934  -3.819  -7.955
  178    H    GLY  26           H        GLY  26  43.299  -4.549  -8.016
  179    HA2  GLY  26           HA2      GLY  26  43.160  -4.549 -10.961
  180    HA3  GLY  26           HA3      GLY  26  43.259  -6.061 -10.065
  181    H    GLY  27           H        GLY  27  41.465  -4.152  -8.124
  182    HA2  GLY  27           HA2      GLY  27  39.117  -3.437  -8.626
  183    HA3  GLY  27           HA3      GLY  27  38.950  -4.992  -9.429
  184    H    TRP  28           H        TRP  28  40.868  -5.167  -6.652
  185    HA   TRP  28           HA       TRP  28  38.877  -6.743  -5.318
  186    HD1  TRP  28           HD1      TRP  28  43.296  -6.617  -6.150
  187    HE1  TRP  28           HE1      TRP  28  44.951  -4.773  -5.464
  188    HE3  TRP  28           HE3      TRP  28  40.683  -4.532  -2.282
  189    HZ2  TRP  28           HZ2      TRP  28  45.126  -2.714  -3.578
  190    HZ3  TRP  28           HZ3      TRP  28  41.665  -2.619  -1.091
  191    HH2  TRP  28           HH2      TRP  28  43.846  -1.728  -1.728
  192    HB2  TRP  28           HB2      TRP  28  40.672  -7.022  -3.568
  193    HB3  TRP  28           HB3      TRP  28  41.115  -7.558  -5.190
  194    H    LEU  29           H        LEU  29  39.494  -3.459  -5.348
  195    HA   LEU  29           HA       LEU  29  39.523  -2.717  -2.696
  196    HG   LEU  29           HG       LEU  29  37.238  -0.402  -3.234
  197    HB2  LEU  29           HB2      LEU  29  40.004  -1.047  -4.221
  198    HB3  LEU  29           HB3      LEU  29  38.574  -1.349  -5.181
  199   HD11  LEU  29          HD11      LEU  29  39.850   0.819  -2.405
  200   HD12  LEU  29          HD12      LEU  29  39.245  -0.662  -1.662
  201   HD13  LEU  29          HD13      LEU  29  38.305   0.826  -1.557
  202   HD21  LEU  29          HD21      LEU  29  37.170   1.274  -4.684
  203   HD22  LEU  29          HD22      LEU  29  38.773   0.872  -5.298
  204   HD23  LEU  29          HD23      LEU  29  38.602   1.945  -3.907
  205    H    THR  30           H        THR  30  36.769  -3.675  -4.631
  206    HA   THR  30           HA       THR  30  34.859  -2.948  -2.582
  207    HB   THR  30           HB       THR  30  33.256  -4.165  -4.112
  208    HG1  THR  30           HG1      THR  30  34.448  -5.556  -5.257
  209   HG21  THR  30          HG21      THR  30  34.344  -2.445  -6.100
  210   HG22  THR  30          HG22      THR  30  34.512  -1.674  -4.523
  211   HG23  THR  30          HG23      THR  30  32.925  -2.206  -5.080
  212    H    ARG  31           H        ARG  31  36.860  -5.630  -3.350
  213    HA   ARG  31           HA       ARG  31  35.189  -7.561  -1.949
  214    HE   ARG  31           HE       ARG  31  38.830  -9.154  -4.459
  215    HB2  ARG  31           HB2      ARG  31  37.879  -8.315  -2.967
  216    HB3  ARG  31           HB3      ARG  31  36.361  -9.197  -3.052
  217    HG2  ARG  31           HG2      ARG  31  35.612  -7.549  -4.793
  218    HG3  ARG  31           HG3      ARG  31  37.259  -6.919  -4.794
  219    HD2  ARG  31           HD2      ARG  31  36.349  -9.695  -5.531
  220    HD3  ARG  31           HD3      ARG  31  37.057  -8.478  -6.594
  221   HH11  ARG  31          HH11      ARG  31  37.617 -10.171  -7.572
  222   HH12  ARG  31          HH12      ARG  31  38.940 -11.258  -7.883
  223   HH21  ARG  31          HH21      ARG  31  40.607 -10.550  -4.878
  224   HH22  ARG  31          HH22      ARG  31  40.661 -11.438  -6.368
  225    H    LEU  32           H        LEU  32  38.588  -6.545  -1.823
  226    HA   LEU  32           HA       LEU  32  39.446  -7.895   0.403
  227    HG   LEU  32           HG       LEU  32  42.600  -5.902   0.128
  228    HB2  LEU  32           HB2      LEU  32  40.772  -6.499  -1.237
  229    HB3  LEU  32           HB3      LEU  32  40.270  -5.084  -0.335
  230   HD11  LEU  32          HD11      LEU  32  41.439  -4.432   1.694
  231   HD12  LEU  32          HD12      LEU  32  42.492  -5.575   2.530
  232   HD13  LEU  32          HD13      LEU  32  40.749  -5.840   2.503
  233   HD21  LEU  32          HD21      LEU  32  41.588  -7.986   1.939
  234   HD22  LEU  32          HD22      LEU  32  43.067  -7.924   0.980
  235   HD23  LEU  32          HD23      LEU  32  41.538  -8.365   0.217
  236    H    LEU  33           H        LEU  33  38.461  -4.471   0.439
  237    HA   LEU  33           HA       LEU  33  38.516  -4.199   3.207
  238    HG   LEU  33           HG       LEU  33  39.508  -2.042   2.653
  239    HB2  LEU  33           HB2      LEU  33  37.002  -2.670   1.099
  240    HB3  LEU  33           HB3      LEU  33  36.958  -2.224   2.797
  241   HD11  LEU  33          HD11      LEU  33  40.193  -1.399   0.258
  242   HD12  LEU  33          HD12      LEU  33  38.796  -2.354  -0.237
  243   HD13  LEU  33          HD13      LEU  33  40.102  -3.110   0.678
  244   HD21  LEU  33          HD21      LEU  33  37.963  -0.108   0.943
  245   HD22  LEU  33          HD22      LEU  33  39.390   0.212   1.929
  246   HD23  LEU  33          HD23      LEU  33  37.847  -0.153   2.702
  247    H    GLN  34           H        GLN  34  35.815  -4.914   1.068
  248    HA   GLN  34           HA       GLN  34  33.624  -4.692   2.552
  249    HB2  GLN  34           HB2      GLN  34  33.797  -5.603   0.239
  250    HB3  GLN  34           HB3      GLN  34  34.186  -7.167   0.929
  251    HG2  GLN  34           HG2      GLN  34  31.894  -7.218   0.378
  252    HG3  GLN  34           HG3      GLN  34  31.998  -7.095   2.131
  253   HE21  GLN  34          HE21      GLN  34  32.783  -4.181   0.627
  254   HE22  GLN  34          HE22      GLN  34  31.258  -3.392   0.816
  255    H    THR  35           H        THR  35  35.392  -7.818   2.587
  256    HA   THR  35           HA       THR  35  33.816  -8.629   4.852
  257    HB   THR  35           HB       THR  35  35.168 -10.758   4.631
  258    HG1  THR  35           HG1      THR  35  36.660 -10.919   3.131
  259   HG21  THR  35          HG21      THR  35  32.966 -10.114   3.366
  260   HG22  THR  35          HG22      THR  35  33.858 -11.581   2.960
  261   HG23  THR  35          HG23      THR  35  34.031 -10.138   1.959
  262    H    LYS  36           H        LYS  36  36.544  -6.781   4.671
  263    HA   LYS  36           HA       LYS  36  37.557  -7.809   7.240
  264    HB2  LYS  36           HB2      LYS  36  38.933  -6.001   5.247
  265    HB3  LYS  36           HB3      LYS  36  39.611  -6.525   6.782
  266    HG2  LYS  36           HG2      LYS  36  39.435  -8.875   5.978
  267    HG3  LYS  36           HG3      LYS  36  38.948  -8.243   4.405
  268    HD2  LYS  36           HD2      LYS  36  41.196  -8.467   4.054
  269    HD3  LYS  36           HD3      LYS  36  41.156  -6.820   4.682
  270    HE2  LYS  36           HE2      LYS  36  41.757  -9.315   6.278
  271    HE3  LYS  36           HE3      LYS  36  42.947  -8.147   5.707
  272    HZ1  LYS  36           HZ1      LYS  36  41.727  -6.450   7.076
  273    HZ2  LYS  36           HZ2      LYS  36  42.515  -7.662   7.961
  274    HZ3  LYS  36           HZ3      LYS  36  40.831  -7.730   7.750
  275    H    ASN  37           H        ASN  37  35.182  -6.128   6.851
  276    HA   ASN  37           HA       ASN  37  34.137  -4.350   7.801
  277    HB2  ASN  37           HB2      ASN  37  35.205  -5.275   9.859
  278    HB3  ASN  37           HB3      ASN  37  36.568  -4.185   9.602
  279   HD21  ASN  37          HD21      ASN  37  36.491  -2.424  10.766
  280   HD22  ASN  37          HD22      ASN  37  35.067  -1.608  11.300
  281    H    TYR  38           H        TYR  38  35.518  -3.827   5.484
  282    HA   TYR  38           HA       TYR  38  36.403  -2.205   4.177
  283    HD1  TYR  38           HD1      TYR  38  34.630  -0.917   2.664
  284    HD2  TYR  38           HD2      TYR  38  33.041  -1.315   6.586
  285    HE1  TYR  38           HE1      TYR  38  32.448  -1.527   1.711
  286    HE2  TYR  38           HE2      TYR  38  30.859  -1.921   5.646
  287    HH   TYR  38           HH       TYR  38  30.016  -2.957   3.427
  288    HB2  TYR  38           HB2      TYR  38  35.188  -0.433   6.311
  289    HB3  TYR  38           HB3      TYR  38  35.733   0.118   4.729
  290    H    ASP  39           H        ASP  39  38.321  -3.349   5.274
  291    HA   ASP  39           HA       ASP  39  39.822  -1.887   7.189
  292    HB2  ASP  39           HB2      ASP  39  39.814  -4.407   6.766
  293    HB3  ASP  39           HB3      ASP  39  40.897  -4.073   5.419
  294    H    ILE  40           H        ILE  40  40.998  -0.135   6.816
  295    HA   ILE  40           HA       ILE  40  42.197   0.247   4.174
  296    HB   ILE  40           HB       ILE  40  43.054   2.431   5.297
  297   HG12  ILE  40          HG12      ILE  40  41.884   1.444   7.533
  298   HG13  ILE  40          HG13      ILE  40  42.119   3.160   7.237
  299   HG21  ILE  40          HG21      ILE  40  41.205   3.590   4.404
  300   HG22  ILE  40          HG22      ILE  40  40.115   2.241   4.721
  301   HG23  ILE  40          HG23      ILE  40  41.344   2.104   3.462
  302   HD11  ILE  40          HD11      ILE  40  39.813   3.264   6.319
  303   HD12  ILE  40          HD12      ILE  40  39.883   2.799   8.022
  304   HD13  ILE  40          HD13      ILE  40  39.599   1.575   6.784
  305    H    GLY  41           H        GLY  41  42.857  -1.245   7.025
  306    HA2  GLY  41           HA2      GLY  41  45.642  -0.565   7.199
  307    HA3  GLY  41           HA3      GLY  41  44.823  -1.803   8.130
  308    H    ALA  42           H        ALA  42  43.685  -3.110   5.897
  309    HA   ALA  42           HA       ALA  42  46.039  -4.541   4.929
  310    HB1  ALA  42           HB1      ALA  42  44.792  -6.421   4.867
  311    HB2  ALA  42           HB2      ALA  42  43.364  -5.578   4.268
  312    HB3  ALA  42           HB3      ALA  42  43.765  -5.522   5.986
  313    H    ALA  43           H        ALA  43  43.612  -2.387   3.881
  314    HA   ALA  43           HA       ALA  43  43.507  -3.054   1.135
  315    HB1  ALA  43           HB1      ALA  43  42.016  -1.439   2.557
  316    HB2  ALA  43           HB2      ALA  43  42.262  -1.146   0.834
  317    HB3  ALA  43           HB3      ALA  43  43.181  -0.226   2.025
  318    H    LEU  44           H        LEU  44  45.501  -0.741   2.936
  319    HA   LEU  44           HA       LEU  44  46.861   0.272   0.671
  320    HG   LEU  44           HG       LEU  44  47.125   2.570   1.594
  321    HB2  LEU  44           HB2      LEU  44  47.373   0.336   3.620
  322    HB3  LEU  44           HB3      LEU  44  48.634   0.858   2.517
  323   HD11  LEU  44          HD11      LEU  44  44.952   1.841   1.809
  324   HD12  LEU  44          HD12      LEU  44  45.059   3.035   3.102
  325   HD13  LEU  44          HD13      LEU  44  45.179   1.316   3.481
  326   HD21  LEU  44          HD21      LEU  44  48.118   3.838   3.115
  327   HD22  LEU  44          HD22      LEU  44  48.199   2.494   4.255
  328   HD23  LEU  44          HD23      LEU  44  46.764   3.520   4.198
  329    H    ASP  45           H        ASP  45  47.304  -2.513   2.668
  330    HA   ASP  45           HA       ASP  45  49.946  -3.221   1.948
  331    HB2  ASP  45           HB2      ASP  45  48.919  -4.239   3.864
  332    HB3  ASP  45           HB3      ASP  45  47.572  -4.830   2.901
  333    H    THR  46           H        THR  46  46.864  -3.605   0.358
  334    HA   THR  46           HA       THR  46  48.028  -5.459  -1.549
  335    HB   THR  46           HB       THR  46  45.558  -5.482  -2.376
  336    HG1  THR  46           HG1      THR  46  44.593  -3.889  -1.294
  337   HG21  THR  46          HG21      THR  46  46.232  -6.561   0.349
  338   HG22  THR  46          HG22      THR  46  46.600  -7.345  -1.189
  339   HG23  THR  46          HG23      THR  46  44.923  -7.100  -0.702
  340    H    ILE  47           H        ILE  47  47.357  -2.048  -1.483
  341    HA   ILE  47           HA       ILE  47  46.995  -1.984  -4.387
  342    HB   ILE  47           HB       ILE  47  47.164   0.636  -3.776
  343   HG12  ILE  47          HG12      ILE  47  46.185  -0.736  -1.275
  344   HG13  ILE  47          HG13      ILE  47  47.534   0.388  -1.431
  345   HG21  ILE  47          HG21      ILE  47  44.764   0.740  -3.804
  346   HG22  ILE  47          HG22      ILE  47  44.648  -0.971  -3.405
  347   HG23  ILE  47          HG23      ILE  47  45.319  -0.473  -4.959
  348   HD11  ILE  47          HD11      ILE  47  45.696   1.515  -0.411
  349   HD12  ILE  47          HD12      ILE  47  44.606   1.004  -1.700
  350   HD13  ILE  47          HD13      ILE  47  45.899   2.154  -2.043
  351    H    GLN  48           H        GLN  48  49.512  -1.181  -2.059
  352    HA   GLN  48           HA       GLN  48  51.460  -0.992  -4.175
  353    HB2  GLN  48           HB2      GLN  48  50.624   1.471  -2.649
  354    HB3  GLN  48           HB3      GLN  48  52.252   1.314  -3.284
  355    HG2  GLN  48           HG2      GLN  48  51.532   2.129  -5.211
  356    HG3  GLN  48           HG3      GLN  48  50.530   0.691  -5.410
  357   HE21  GLN  48          HE21      GLN  48  48.497   1.107  -5.806
  358   HE22  GLN  48          HE22      GLN  48  47.598   2.486  -5.255
  359    H    TYR  49           H        TYR  49  50.728  -0.416  -0.769
  360    HA   TYR  49           HA       TYR  49  53.412  -0.780   0.141
  361    HD1  TYR  49           HD1      TYR  49  54.094   0.832   1.929
  362    HD2  TYR  49           HD2      TYR  49  49.912   1.388   1.382
  363    HE1  TYR  49           HE1      TYR  49  54.398   3.254   2.122
  364    HE2  TYR  49           HE2      TYR  49  50.205   3.815   1.574
  365    HH   TYR  49           HH       TYR  49  52.790   5.395   1.115
  366    HB2  TYR  49           HB2      TYR  49  50.739  -0.758   1.544
  367    HB3  TYR  49           HB3      TYR  49  52.259  -1.008   2.402
  368    H    SER  50           H        SER  50  53.448  -2.479   2.149
  369    HA   SER  50           HA       SER  50  52.092  -4.909   1.758
  370    HG   SER  50           HG       SER  50  52.514  -6.589   0.745
  371    HB2  SER  50           HB2      SER  50  54.012  -4.751  -0.118
  372    HB3  SER  50           HB3      SER  50  54.983  -5.382   1.214
  373    H    LYS  51           H        LYS  51  51.768  -4.490   3.924
  374    HA   LYS  51           HA       LYS  51  52.058  -5.070   6.117
  375    HB2  LYS  51           HB2      LYS  51  54.958  -5.591   5.428
  376    HB3  LYS  51           HB3      LYS  51  54.231  -5.857   7.008
  377    HG2  LYS  51           HG2      LYS  51  53.526  -7.278   4.446
  378    HG3  LYS  51           HG3      LYS  51  54.429  -7.943   5.810
  379    HD2  LYS  51           HD2      LYS  51  52.489  -7.724   7.244
  380    HD3  LYS  51           HD3      LYS  51  51.580  -6.961   5.937
  381    HE2  LYS  51           HE2      LYS  51  51.762  -9.007   4.613
  382    HE3  LYS  51           HE3      LYS  51  52.682  -9.767   5.912
  383    HZ1  LYS  51           HZ1      LYS  51  49.837  -9.343   5.669
  384    HZ2  LYS  51           HZ2      LYS  51  50.463  -8.932   7.194
  385    HZ3  LYS  51           HZ3      LYS  51  50.696 -10.497   6.575
  386    H    HIS  52           H        HIS  52  51.609  -2.713   5.717
  387    HA   HIS  52           HA       HIS  52  51.747  -0.602   6.456
  388    HD1  HIS  52           HD1      HIS  52  54.392   1.312   7.636
  389    HD2  HIS  52           HD2      HIS  52  51.462   0.078  10.312
  390    HE1  HIS  52           HE1      HIS  52  53.851   3.326   9.070
  391    HB2  HIS  52           HB2      HIS  52  52.328  -1.771   8.616
  392    HB3  HIS  52           HB3      HIS  52  54.025  -1.509   8.225
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1  20.597   9.372  -0.370
    2    H2   GLY   1           2H       GLY   1  20.114   8.623  -1.807
    3    H3   GLY   1           3H       GLY   1  21.751   8.989  -1.552
    4    HA2  GLY   1           HA2      GLY   1  20.452   7.281   0.424
    5    HA3  GLY   1           HA3      GLY   1  20.755   6.579  -1.161
    6    H    SER   2           H        SER   2  22.229   5.128  -0.121
    7    HA   SER   2           HA       SER   2  24.771   6.378   0.694
    8    HG   SER   2           HG       SER   2  23.634   5.820   2.781
    9    HB2  SER   2           HB2      SER   2  23.897   3.515   1.141
   10    HB3  SER   2           HB3      SER   2  25.288   4.327   1.857
   11    HA   PRO   3           HA       PRO   3  25.832   4.734  -3.412
   12    HB2  PRO   3           HB2      PRO   3  27.951   6.709  -3.453
   13    HB3  PRO   3           HB3      PRO   3  26.501   6.632  -4.453
   14    HG2  PRO   3           HG2      PRO   3  26.936   8.557  -2.562
   15    HG3  PRO   3           HG3      PRO   3  25.325   8.031  -3.082
   16    HD2  PRO   3           HD2      PRO   3  26.866   7.276  -0.626
   17    HD3  PRO   3           HD3      PRO   3  25.129   7.608  -0.815
   18    HA   PRO   4           HA       PRO   4  29.283   2.280  -2.023
   19    HB2  PRO   4           HB2      PRO   4  29.935   1.101  -4.352
   20    HB3  PRO   4           HB3      PRO   4  28.467   0.680  -3.462
   21    HG2  PRO   4           HG2      PRO   4  28.795   2.459  -5.844
   22    HG3  PRO   4           HG3      PRO   4  27.533   1.261  -5.507
   23    HD2  PRO   4           HD2      PRO   4  27.207   3.950  -5.130
   24    HD3  PRO   4           HD3      PRO   4  26.327   2.713  -4.211
   25    H    GLU   5           H        GLU   5  29.779   5.065  -2.702
   26    HA   GLU   5           HA       GLU   5  32.619   4.930  -3.038
   27    HB2  GLU   5           HB2      GLU   5  31.537   4.937  -5.417
   28    HB3  GLU   5           HB3      GLU   5  31.206   6.630  -5.080
   29    HG2  GLU   5           HG2      GLU   5  33.549   7.091  -4.826
   30    HG3  GLU   5           HG3      GLU   5  33.941   5.381  -4.994
   31    H    ALA   6           H        ALA   6  30.400   5.841  -1.254
   32    HA   ALA   6           HA       ALA   6  31.539   8.135  -0.141
   33    HB1  ALA   6           HB1      ALA   6  30.805   9.712  -1.588
   34    HB2  ALA   6           HB2      ALA   6  29.283   9.518  -0.718
   35    HB3  ALA   6           HB3      ALA   6  29.542   8.670  -2.242
   36    H    ASP   7           H        ASP   7  30.341   5.570   0.389
   37    HA   ASP   7           HA       ASP   7  27.947   6.037   1.952
   38    HB2  ASP   7           HB2      ASP   7  28.253   3.896   0.794
   39    HB3  ASP   7           HB3      ASP   7  29.793   3.648   1.604
   40    HA   PRO   8           HA       PRO   8  29.988   7.387   5.682
   41    HB2  PRO   8           HB2      PRO   8  28.511   5.158   7.022
   42    HB3  PRO   8           HB3      PRO   8  28.659   6.856   7.496
   43    HG2  PRO   8           HG2      PRO   8  26.429   5.950   6.342
   44    HG3  PRO   8           HG3      PRO   8  27.064   7.562   5.967
   45    HD2  PRO   8           HD2      PRO   8  27.101   5.082   4.324
   46    HD3  PRO   8           HD3      PRO   8  27.046   6.779   3.810
   47    H    ARG   9           H        ARG   9  29.969   4.014   4.773
   48    HA   ARG   9           HA       ARG   9  32.245   3.376   6.481
   49    HE   ARG   9           HE       ARG   9  29.108  -0.823   5.074
   50    HB2  ARG   9           HB2      ARG   9  30.551   1.709   4.619
   51    HB3  ARG   9           HB3      ARG   9  31.855   1.067   5.633
   52    HG2  ARG   9           HG2      ARG   9  30.639   1.912   7.634
   53    HG3  ARG   9           HG3      ARG   9  29.307   2.378   6.579
   54    HD2  ARG   9           HD2      ARG   9  30.373  -0.426   6.918
   55    HD3  ARG   9           HD3      ARG   9  28.933   0.213   7.703
   56   HH11  ARG   9          HH11      ARG   9  27.523   1.658   6.944
   57   HH12  ARG   9          HH12      ARG   9  26.169   1.792   5.866
   58   HH21  ARG   9          HH21      ARG   9  27.309  -0.709   3.682
   59   HH22  ARG   9          HH22      ARG   9  26.042   0.435   4.009
   60    H    LEU  10           H        LEU  10  31.526   3.990   3.103
   61    HA   LEU  10           HA       LEU  10  34.139   3.027   2.290
   62    HG   LEU  10           HG       LEU  10  31.915   1.415   1.619
   63    HB2  LEU  10           HB2      LEU  10  31.650   3.767   0.787
   64    HB3  LEU  10           HB3      LEU  10  33.189   3.596  -0.039
   65   HD11  LEU  10          HD11      LEU  10  31.461   0.355  -0.586
   66   HD12  LEU  10          HD12      LEU  10  31.891   1.883  -1.357
   67   HD13  LEU  10          HD13      LEU  10  30.500   1.801  -0.273
   68   HD21  LEU  10          HD21      LEU  10  34.530   1.778   0.585
   69   HD22  LEU  10          HD22      LEU  10  33.747   0.503  -0.349
   70   HD23  LEU  10          HD23      LEU  10  33.857   0.369   1.406
   71    H    ILE  11           H        ILE  11  32.550   5.928   3.066
   72    HA   ILE  11           HA       ILE  11  34.281   7.664   1.543
   73    HB   ILE  11           HB       ILE  11  31.997   8.340   2.410
   74   HG12  ILE  11          HG12      ILE  11  34.313  10.105   3.227
   75   HG13  ILE  11          HG13      ILE  11  33.674   9.965   1.592
   76   HG21  ILE  11          HG21      ILE  11  31.499   8.351   4.574
   77   HG22  ILE  11          HG22      ILE  11  32.951   9.268   4.970
   78   HG23  ILE  11          HG23      ILE  11  33.022   7.508   4.857
   79   HD11  ILE  11          HD11      ILE  11  32.662  11.456   3.897
   80   HD12  ILE  11          HD12      ILE  11  31.434  10.599   2.964
   81   HD13  ILE  11          HD13      ILE  11  32.489  11.768   2.170
   82    H    GLU  12           H        GLU  12  34.610   5.601   4.080
   83    HA   GLU  12           HA       GLU  12  36.837   7.035   5.337
   84    HB2  GLU  12           HB2      GLU  12  35.717   4.305   5.996
   85    HB3  GLU  12           HB3      GLU  12  36.915   5.190   6.924
   86    HG2  GLU  12           HG2      GLU  12  35.224   6.925   7.384
   87    HG3  GLU  12           HG3      GLU  12  34.032   5.940   6.532
   88    H    SER  13           H        SER  13  36.224   3.756   4.120
   89    HA   SER  13           HA       SER  13  39.046   3.329   3.879
   90    HG   SER  13           HG       SER  13  37.625   0.792   5.541
   91    HB2  SER  13           HB2      SER  13  36.803   1.418   3.210
   92    HB3  SER  13           HB3      SER  13  38.476   1.011   3.596
   93    H    LEU  14           H        LEU  14  36.443   3.894   1.578
   94    HA   LEU  14           HA       LEU  14  38.162   3.050  -0.622
   95    HG   LEU  14           HG       LEU  14  37.051   3.054  -2.844
   96    HB2  LEU  14           HB2      LEU  14  35.775   2.363  -0.585
   97    HB3  LEU  14           HB3      LEU  14  35.309   4.048  -0.648
   98   HD11  LEU  14          HD11      LEU  14  35.588   1.220  -2.823
   99   HD12  LEU  14          HD12      LEU  14  34.921   2.322  -4.027
  100   HD13  LEU  14          HD13      LEU  14  34.196   2.227  -2.422
  101   HD21  LEU  14          HD21      LEU  14  36.389   5.353  -2.878
  102   HD22  LEU  14          HD22      LEU  14  34.697   4.923  -2.620
  103   HD23  LEU  14          HD23      LEU  14  35.490   4.509  -4.139
  104    H    SER  15           H        SER  15  36.451   5.855   0.648
  105    HA   SER  15           HA       SER  15  37.381   7.634  -1.313
  106    HG   SER  15           HG       SER  15  36.316  10.347   0.713
  107    HB2  SER  15           HB2      SER  15  35.411   8.056   0.173
  108    HB3  SER  15           HB3      SER  15  36.542   8.368   1.490
  109    H    GLN  16           H        GLN  16  38.934   6.230   1.390
  110    HA   GLN  16           HA       GLN  16  40.895   8.226   1.898
  111    HB2  GLN  16           HB2      GLN  16  40.411   6.254   3.388
  112    HB3  GLN  16           HB3      GLN  16  41.194   5.226   2.197
  113    HG2  GLN  16           HG2      GLN  16  42.717   7.547   3.254
  114    HG3  GLN  16           HG3      GLN  16  42.470   6.164   4.313
  115   HE21  GLN  16          HE21      GLN  16  42.437   4.624   1.571
  116   HE22  GLN  16          HE22      GLN  16  44.118   4.337   1.299
  117    H    MET  17           H        MET  17  40.713   5.436  -0.255
  118    HA   MET  17           HA       MET  17  43.295   5.811  -1.397
  119    HB2  MET  17           HB2      MET  17  40.891   4.326  -2.476
  120    HB3  MET  17           HB3      MET  17  42.528   4.214  -3.109
  121    HG2  MET  17           HG2      MET  17  43.275   3.332  -0.929
  122    HG3  MET  17           HG3      MET  17  41.601   3.366  -0.374
  123    HE1  MET  17           HE1      MET  17  41.371   0.435   0.023
  124    HE2  MET  17           HE2      MET  17  43.019   1.059   0.117
  125    HE3  MET  17           HE3      MET  17  42.670  -0.372  -0.855
  126    H    LEU  18           H        LEU  18  40.021   6.855  -2.226
  127    HA   LEU  18           HA       LEU  18  40.632   7.945  -4.764
  128    HG   LEU  18           HG       LEU  18  38.284   7.971  -5.788
  129    HB2  LEU  18           HB2      LEU  18  38.449   8.264  -2.787
  130    HB3  LEU  18           HB3      LEU  18  38.623   9.536  -3.979
  131   HD11  LEU  18          HD11      LEU  18  38.243   5.869  -3.632
  132   HD12  LEU  18          HD12      LEU  18  39.383   6.011  -4.971
  133   HD13  LEU  18          HD13      LEU  18  37.696   5.602  -5.287
  134   HD21  LEU  18          HD21      LEU  18  36.378   8.654  -3.868
  135   HD22  LEU  18          HD22      LEU  18  36.085   6.957  -4.248
  136   HD23  LEU  18          HD23      LEU  18  36.094   8.161  -5.538
  137    H    SER  19           H        SER  19  41.015   9.202  -1.528
  138    HA   SER  19           HA       SER  19  41.524  11.891  -2.394
  139    HG   SER  19           HG       SER  19  41.513  13.332  -0.078
  140    HB2  SER  19           HB2      SER  19  40.503  11.427  -0.208
  141    HB3  SER  19           HB3      SER  19  41.962  10.580   0.300
  142    H    MET  20           H        MET  20  43.521   9.196  -1.200
  143    HA   MET  20           HA       MET  20  45.927  10.744  -1.309
  144    HB2  MET  20           HB2      MET  20  45.563   7.757  -1.015
  145    HB3  MET  20           HB3      MET  20  47.065   8.632  -0.754
  146    HG2  MET  20           HG2      MET  20  44.530   8.972   0.834
  147    HG3  MET  20           HG3      MET  20  45.965   8.084   1.345
  148    HE1  MET  20           HE1      MET  20  46.422  10.730   3.792
  149    HE2  MET  20           HE2      MET  20  45.362   9.391   3.351
  150    HE3  MET  20           HE3      MET  20  44.804  11.054   3.171
  151    H    GLY  21           H        GLY  21  44.344   8.482  -3.476
  152    HA2  GLY  21           HA2      GLY  21  44.813   8.730  -5.861
  153    HA3  GLY  21           HA3      GLY  21  46.497   9.010  -5.427
  154    H    PHE  22           H        PHE  22  44.186   6.521  -4.374
  155    HA   PHE  22           HA       PHE  22  45.907   4.491  -5.616
  156    HD1  PHE  22           HD1      PHE  22  47.949   4.034  -4.469
  157    HD2  PHE  22           HD2      PHE  22  45.591   5.304  -1.166
  158    HE1  PHE  22           HE1      PHE  22  49.965   4.914  -3.376
  159    HE2  PHE  22           HE2      PHE  22  47.607   6.185  -0.062
  160    HZ   PHE  22           HZ       PHE  22  49.795   5.991  -1.169
  161    HB2  PHE  22           HB2      PHE  22  44.564   4.241  -2.909
  162    HB3  PHE  22           HB3      PHE  22  45.538   3.007  -3.705
  163    H    SER  23           H        SER  23  44.676   2.436  -5.966
  164    HA   SER  23           HA       SER  23  41.794   2.854  -6.035
  165    HG   SER  23           HG       SER  23  41.878   4.314  -8.015
  166    HB2  SER  23           HB2      SER  23  43.402   1.939  -8.443
  167    HB3  SER  23           HB3      SER  23  41.644   2.039  -8.359
  168    H    ASP  24           H        ASP  24  41.767   0.354  -7.813
  169    HA   ASP  24           HA       ASP  24  42.303  -1.569  -5.671
  170    HB2  ASP  24           HB2      ASP  24  40.928  -3.158  -7.073
  171    HB3  ASP  24           HB3      ASP  24  40.043  -1.800  -6.388
  172    H    GLU  25           H        GLU  25  43.950  -2.945  -5.855
  173    HA   GLU  25           HA       GLU  25  45.558  -2.909  -8.280
  174    HB2  GLU  25           HB2      GLU  25  46.631  -2.835  -6.035
  175    HB3  GLU  25           HB3      GLU  25  45.991  -4.433  -5.696
  176    HG2  GLU  25           HG2      GLU  25  48.283  -4.638  -6.303
  177    HG3  GLU  25           HG3      GLU  25  47.299  -5.317  -7.597
  178    H    GLY  26           H        GLY  26  43.334  -3.795  -9.099
  179    HA2  GLY  26           HA2      GLY  26  43.270  -5.978 -10.472
  180    HA3  GLY  26           HA3      GLY  26  43.250  -6.723  -8.875
  181    H    GLY  27           H        GLY  27  41.435  -6.431  -7.532
  182    HA2  GLY  27           HA2      GLY  27  39.195  -4.861  -8.276
  183    HA3  GLY  27           HA3      GLY  27  38.934  -6.536  -8.742
  184    H    TRP  28           H        TRP  28  40.840  -5.662  -5.971
  185    HA   TRP  28           HA       TRP  28  38.958  -7.116  -4.295
  186    HD1  TRP  28           HD1      TRP  28  43.116  -6.998  -5.624
  187    HE1  TRP  28           HE1      TRP  28  44.782  -5.058  -5.456
  188    HE3  TRP  28           HE3      TRP  28  41.071  -4.518  -1.659
  189    HZ2  TRP  28           HZ2      TRP  28  45.171  -2.751  -3.860
  190    HZ3  TRP  28           HZ3      TRP  28  42.141  -2.452  -0.878
  191    HH2  TRP  28           HH2      TRP  28  44.147  -1.592  -1.951
  192    HB2  TRP  28           HB2      TRP  28  40.853  -6.971  -2.610
  193    HB3  TRP  28           HB3      TRP  28  41.205  -7.880  -4.082
  194    H    LEU  29           H        LEU  29  39.631  -3.865  -5.010
  195    HA   LEU  29           HA       LEU  29  39.580  -2.718  -2.474
  196    HG   LEU  29           HG       LEU  29  37.356  -0.483  -3.656
  197    HB2  LEU  29           HB2      LEU  29  40.240  -1.243  -4.094
  198    HB3  LEU  29           HB3      LEU  29  38.972  -1.696  -5.207
  199   HD11  LEU  29          HD11      LEU  29  38.468   1.275  -2.245
  200   HD12  LEU  29          HD12      LEU  29  39.975   0.384  -2.452
  201   HD13  LEU  29          HD13      LEU  29  38.604  -0.376  -1.641
  202   HD21  LEU  29          HD21      LEU  29  39.520   1.240  -4.843
  203   HD22  LEU  29          HD22      LEU  29  37.816   1.641  -4.622
  204   HD23  LEU  29          HD23      LEU  29  38.288   0.418  -5.801
  205    H    THR  30           H        THR  30  37.060  -4.219  -4.204
  206    HA   THR  30           HA       THR  30  35.051  -3.183  -2.338
  207    HB   THR  30           HB       THR  30  33.461  -4.587  -3.696
  208    HG1  THR  30           HG1      THR  30  34.193  -5.781  -5.272
  209   HG21  THR  30          HG21      THR  30  33.354  -2.373  -4.336
  210   HG22  THR  30          HG22      THR  30  33.752  -3.188  -5.849
  211   HG23  THR  30          HG23      THR  30  35.012  -2.356  -4.935
  212    H    ARG  31           H        ARG  31  36.490  -6.214  -3.467
  213    HA   ARG  31           HA       ARG  31  35.190  -7.966  -1.716
  214    HE   ARG  31           HE       ARG  31  34.486 -10.687  -3.178
  215    HB2  ARG  31           HB2      ARG  31  37.963  -8.397  -2.822
  216    HB3  ARG  31           HB3      ARG  31  36.744  -9.608  -2.450
  217    HG2  ARG  31           HG2      ARG  31  36.485  -7.552  -4.640
  218    HG3  ARG  31           HG3      ARG  31  37.050  -9.207  -4.874
  219    HD2  ARG  31           HD2      ARG  31  34.366  -8.465  -3.712
  220    HD3  ARG  31           HD3      ARG  31  34.642  -8.877  -5.407
  221   HH11  ARG  31          HH11      ARG  31  35.728 -10.204  -6.406
  222   HH12  ARG  31          HH12      ARG  31  35.960 -11.897  -6.721
  223   HH21  ARG  31          HH21      ARG  31  34.806 -12.922  -3.564
  224   HH22  ARG  31          HH22      ARG  31  35.467 -13.443  -5.088
  225    H    LEU  32           H        LEU  32  38.576  -6.905  -1.552
  226    HA   LEU  32           HA       LEU  32  39.336  -8.017   0.839
  227    HG   LEU  32           HG       LEU  32  42.516  -6.108   0.437
  228    HB2  LEU  32           HB2      LEU  32  40.678  -6.716  -0.932
  229    HB3  LEU  32           HB3      LEU  32  40.218  -5.275  -0.047
  230   HD11  LEU  32          HD11      LEU  32  41.587  -4.666   2.049
  231   HD12  LEU  32          HD12      LEU  32  42.278  -6.024   2.938
  232   HD13  LEU  32          HD13      LEU  32  40.535  -5.932   2.685
  233   HD21  LEU  32          HD21      LEU  32  42.194  -8.465   0.321
  234   HD22  LEU  32          HD22      LEU  32  41.018  -8.422   1.636
  235   HD23  LEU  32          HD23      LEU  32  42.714  -8.057   1.957
  236    H    LEU  33           H        LEU  33  38.040  -4.724   0.371
  237    HA   LEU  33           HA       LEU  33  38.037  -4.015   3.082
  238    HG   LEU  33           HG       LEU  33  38.656  -2.390   0.521
  239    HB2  LEU  33           HB2      LEU  33  36.328  -3.041   0.798
  240    HB3  LEU  33           HB3      LEU  33  36.292  -2.328   2.403
  241   HD11  LEU  33          HD11      LEU  33  37.251  -0.731  -0.274
  242   HD12  LEU  33          HD12      LEU  33  38.304   0.151   0.834
  243   HD13  LEU  33          HD13      LEU  33  36.675  -0.304   1.336
  244   HD21  LEU  33          HD21      LEU  33  38.378  -1.362   3.335
  245   HD22  LEU  33          HD22      LEU  33  39.673  -0.878   2.242
  246   HD23  LEU  33          HD23      LEU  33  39.517  -2.565   2.731
  247    H    GLN  34           H        GLN  34  35.235  -4.913   1.098
  248    HA   GLN  34           HA       GLN  34  33.239  -4.933   2.890
  249    HB2  GLN  34           HB2      GLN  34  33.673  -5.979   0.371
  250    HB3  GLN  34           HB3      GLN  34  33.118  -7.356   1.302
  251    HG2  GLN  34           HG2      GLN  34  31.177  -6.457   0.381
  252    HG3  GLN  34           HG3      GLN  34  31.179  -5.894   2.048
  253   HE21  GLN  34          HE21      GLN  34  33.442  -4.311   0.044
  254   HE22  GLN  34          HE22      GLN  34  32.527  -2.877  -0.241
  255    H    THR  35           H        THR  35  35.239  -7.831   2.292
  256    HA   THR  35           HA       THR  35  33.943  -9.367   4.256
  257    HB   THR  35           HB       THR  35  35.929 -10.912   3.954
  258    HG1  THR  35           HG1      THR  35  36.675  -9.095   1.910
  259   HG21  THR  35          HG21      THR  35  35.355 -10.577   1.200
  260   HG22  THR  35          HG22      THR  35  33.880 -10.269   2.117
  261   HG23  THR  35          HG23      THR  35  34.741 -11.795   2.318
  262    H    LYS  36           H        LYS  36  36.552  -7.119   4.481
  263    HA   LYS  36           HA       LYS  36  37.119  -7.995   7.229
  264    HB2  LYS  36           HB2      LYS  36  38.676  -6.190   5.378
  265    HB3  LYS  36           HB3      LYS  36  39.121  -6.527   7.045
  266    HG2  LYS  36           HG2      LYS  36  39.412  -8.876   6.521
  267    HG3  LYS  36           HG3      LYS  36  38.897  -8.583   4.856
  268    HD2  LYS  36           HD2      LYS  36  40.805  -7.241   4.414
  269    HD3  LYS  36           HD3      LYS  36  41.250  -7.203   6.120
  270    HE2  LYS  36           HE2      LYS  36  41.293  -9.593   4.275
  271    HE3  LYS  36           HE3      LYS  36  42.690  -8.751   4.945
  272    HZ1  LYS  36           HZ1      LYS  36  40.865 -10.651   6.222
  273    HZ2  LYS  36           HZ2      LYS  36  41.485  -9.395   7.190
  274    HZ3  LYS  36           HZ3      LYS  36  42.547 -10.467   6.405
  275    H    ASN  37           H        ASN  37  34.715  -6.641   6.629
  276    HA   ASN  37           HA       ASN  37  33.444  -4.805   7.028
  277    HB2  ASN  37           HB2      ASN  37  33.662  -3.893   9.354
  278    HB3  ASN  37           HB3      ASN  37  33.489  -5.642   9.251
  279   HD21  ASN  37          HD21      ASN  37  35.476  -3.019  10.215
  280   HD22  ASN  37          HD22      ASN  37  36.733  -3.957  10.941
  281    H    TYR  38           H        TYR  38  35.449  -4.108   5.323
  282    HA   TYR  38           HA       TYR  38  36.327  -2.280   4.317
  283    HD1  TYR  38           HD1      TYR  38  34.719  -1.048   2.735
  284    HD2  TYR  38           HD2      TYR  38  32.630  -1.395   6.422
  285    HE1  TYR  38           HE1      TYR  38  32.634  -1.484   1.507
  286    HE2  TYR  38           HE2      TYR  38  30.546  -1.832   5.206
  287    HH   TYR  38           HH       TYR  38  30.398  -2.681   2.027
  288    HB2  TYR  38           HB2      TYR  38  34.838  -0.751   6.459
  289    HB3  TYR  38           HB3      TYR  38  35.555  -0.040   5.016
  290    H    ASP  39           H        ASP  39  38.272  -3.369   5.361
  291    HA   ASP  39           HA       ASP  39  39.499  -1.574   7.352
  292    HB2  ASP  39           HB2      ASP  39  39.408  -3.990   7.898
  293    HB3  ASP  39           HB3      ASP  39  40.417  -4.323   6.494
  294    H    ILE  40           H        ILE  40  40.922  -0.132   6.684
  295    HA   ILE  40           HA       ILE  40  42.236  -0.498   4.107
  296    HB   ILE  40           HB       ILE  40  43.247   1.787   4.640
  297   HG12  ILE  40          HG12      ILE  40  42.328   1.515   7.122
  298   HG13  ILE  40          HG13      ILE  40  42.473   3.094   6.359
  299   HG21  ILE  40          HG21      ILE  40  41.393   1.269   3.037
  300   HG22  ILE  40          HG22      ILE  40  41.418   2.916   3.664
  301   HG23  ILE  40          HG23      ILE  40  40.263   1.748   4.304
  302   HD11  ILE  40          HD11      ILE  40  40.338   3.426   6.843
  303   HD12  ILE  40          HD12      ILE  40  40.140   1.751   7.362
  304   HD13  ILE  40          HD13      ILE  40  39.931   2.179   5.664
  305    H    GLY  41           H        GLY  41  42.700  -1.401   7.219
  306    HA2  GLY  41           HA2      GLY  41  45.433  -0.855   7.616
  307    HA3  GLY  41           HA3      GLY  41  44.531  -2.133   8.404
  308    H    ALA  42           H        ALA  42  43.728  -3.506   6.142
  309    HA   ALA  42           HA       ALA  42  46.255  -4.730   5.307
  310    HB1  ALA  42           HB1      ALA  42  44.685  -6.597   4.525
  311    HB2  ALA  42           HB2      ALA  42  43.438  -5.754   5.445
  312    HB3  ALA  42           HB3      ALA  42  44.876  -6.366   6.263
  313    H    ALA  43           H        ALA  43  43.649  -2.869   4.151
  314    HA   ALA  43           HA       ALA  43  43.863  -3.592   1.386
  315    HB1  ALA  43           HB1      ALA  43  42.772  -0.938   2.042
  316    HB2  ALA  43           HB2      ALA  43  41.966  -2.308   2.809
  317    HB3  ALA  43           HB3      ALA  43  42.100  -2.232   1.051
  318    H    LEU  44           H        LEU  44  45.360  -1.219   3.473
  319    HA   LEU  44           HA       LEU  44  46.512   0.294   1.327
  320    HG   LEU  44           HG       LEU  44  46.729   2.665   2.362
  321    HB2  LEU  44           HB2      LEU  44  46.655   0.337   4.285
  322    HB3  LEU  44           HB3      LEU  44  48.050   0.977   3.428
  323   HD11  LEU  44          HD11      LEU  44  44.393   1.115   3.432
  324   HD12  LEU  44          HD12      LEU  44  44.717   1.644   1.776
  325   HD13  LEU  44          HD13      LEU  44  44.253   2.823   3.005
  326   HD21  LEU  44          HD21      LEU  44  47.282   3.567   4.375
  327   HD22  LEU  44          HD22      LEU  44  46.444   2.315   5.293
  328   HD23  LEU  44          HD23      LEU  44  45.524   3.605   4.519
  329    H    ASP  45           H        ASP  45  47.306  -2.623   2.907
  330    HA   ASP  45           HA       ASP  45  50.118  -2.549   2.426
  331    HB2  ASP  45           HB2      ASP  45  48.889  -4.053   4.075
  332    HB3  ASP  45           HB3      ASP  45  48.415  -5.028   2.689
  333    H    THR  46           H        THR  46  47.313  -3.318   0.516
  334    HA   THR  46           HA       THR  46  48.986  -4.483  -1.566
  335    HB   THR  46           HB       THR  46  46.719  -4.850  -2.693
  336    HG1  THR  46           HG1      THR  46  45.177  -3.809  -1.719
  337   HG21  THR  46          HG21      THR  46  46.642  -6.895  -1.811
  338   HG22  THR  46          HG22      THR  46  46.477  -6.284  -0.165
  339   HG23  THR  46          HG23      THR  46  48.074  -6.399  -0.908
  340    H    ILE  47           H        ILE  47  47.374  -1.461  -0.856
  341    HA   ILE  47           HA       ILE  47  47.511  -0.611  -3.625
  342    HB   ILE  47           HB       ILE  47  46.837   1.675  -2.721
  343   HG12  ILE  47          HG12      ILE  47  45.431   1.285  -0.531
  344   HG13  ILE  47          HG13      ILE  47  46.628   0.031  -0.235
  345   HG21  ILE  47          HG21      ILE  47  44.466   0.374  -2.091
  346   HG22  ILE  47          HG22      ILE  47  45.308  -0.721  -3.187
  347   HG23  ILE  47          HG23      ILE  47  44.981   0.937  -3.678
  348   HD11  ILE  47          HD11      ILE  47  48.163   2.197  -0.925
  349   HD12  ILE  47          HD12      ILE  47  47.832   1.633   0.715
  350   HD13  ILE  47          HD13      ILE  47  46.845   2.911   0.003
  351    H    GLN  48           H        GLN  48  49.941  -1.361  -2.777
  352    HA   GLN  48           HA       GLN  48  52.051  -0.748  -3.325
  353    HB2  GLN  48           HB2      GLN  48  51.088   2.118  -3.374
  354    HB3  GLN  48           HB3      GLN  48  52.633   1.531  -3.973
  355    HG2  GLN  48           HG2      GLN  48  51.744   1.095  -5.952
  356    HG3  GLN  48           HG3      GLN  48  50.519   0.060  -5.218
  357   HE21  GLN  48          HE21      GLN  48  48.498   0.658  -5.479
  358   HE22  GLN  48          HE22      GLN  48  47.940   2.260  -5.835
  359    H    TYR  49           H        TYR  49  50.649  -0.315  -0.487
  360    HA   TYR  49           HA       TYR  49  53.160   0.664   0.694
  361    HD1  TYR  49           HD1      TYR  49  50.951   2.701  -0.671
  362    HD2  TYR  49           HD2      TYR  49  52.735   3.252   3.152
  363    HE1  TYR  49           HE1      TYR  49  51.603   4.981  -1.310
  364    HE2  TYR  49           HE2      TYR  49  53.389   5.536   2.524
  365    HH   TYR  49           HH       TYR  49  52.135   7.148  -0.134
  366    HB2  TYR  49           HB2      TYR  49  50.343   1.296   1.506
  367    HB3  TYR  49           HB3      TYR  49  51.622   1.274   2.723
  368    H    SER  50           H        SER  50  53.565  -1.712   0.393
  369    HA   SER  50           HA       SER  50  52.243  -3.510   2.224
  370    HG   SER  50           HG       SER  50  52.015  -4.155  -0.078
  371    HB2  SER  50           HB2      SER  50  54.762  -3.983   0.613
  372    HB3  SER  50           HB3      SER  50  53.699  -5.203   1.317
  373    H    LYS  51           H        LYS  51  53.289  -1.383   3.637
  374    HA   LYS  51           HA       LYS  51  55.457  -2.668   5.163
  375    HB2  LYS  51           HB2      LYS  51  55.110   0.315   4.773
  376    HB3  LYS  51           HB3      LYS  51  56.415  -0.489   5.632
  377    HG2  LYS  51           HG2      LYS  51  55.883  -0.736   2.674
  378    HG3  LYS  51           HG3      LYS  51  57.089   0.322   3.406
  379    HD2  LYS  51           HD2      LYS  51  57.033  -2.680   3.731
  380    HD3  LYS  51           HD3      LYS  51  58.010  -1.831   2.531
  381    HE2  LYS  51           HE2      LYS  51  58.192  -1.511   5.528
  382    HE3  LYS  51           HE3      LYS  51  59.329  -2.396   4.512
  383    HZ1  LYS  51           HZ1      LYS  51  59.871  -0.329   3.376
  384    HZ2  LYS  51           HZ2      LYS  51  60.152  -0.189   5.047
  385    HZ3  LYS  51           HZ3      LYS  51  58.776   0.527   4.354
  386    H    HIS  52           H        HIS  52  54.024  -3.530   6.674
  387    HA   HIS  52           HA       HIS  52  52.318  -1.605   8.084
  388    HD1  HIS  52           HD1      HIS  52  51.437  -3.259  10.834
  389    HD2  HIS  52           HD2      HIS  52  48.790  -3.371   7.629
  390    HE1  HIS  52           HE1      HIS  52  49.137  -2.847  11.802
  391    HB2  HIS  52           HB2      HIS  52  51.355  -3.747   7.031
  392    HB3  HIS  52           HB3      HIS  52  52.154  -4.608   8.340
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1  20.182   9.459  -4.258
    2    H2   GLY   1           2H       GLY   1  20.390   9.937  -2.645
    3    H3   GLY   1           3H       GLY   1  18.884   9.367  -3.172
    4    HA2  GLY   1           HA2      GLY   1  19.729   7.547  -2.060
    5    HA3  GLY   1           HA3      GLY   1  20.109   7.211  -3.744
    6    H    SER   2           H        SER   2  21.402   6.423  -1.130
    7    HA   SER   2           HA       SER   2  23.945   7.768  -1.141
    8    HG   SER   2           HG       SER   2  23.231   7.183   2.009
    9    HB2  SER   2           HB2      SER   2  23.100   5.255   0.321
   10    HB3  SER   2           HB3      SER   2  24.538   6.223   0.654
   11    HA   PRO   3           HA       PRO   3  25.493   5.027  -4.327
   12    HB2  PRO   3           HB2      PRO   3  27.885   6.674  -4.311
   13    HB3  PRO   3           HB3      PRO   3  26.640   6.547  -5.555
   14    HG2  PRO   3           HG2      PRO   3  27.013   8.785  -4.051
   15    HG3  PRO   3           HG3      PRO   3  25.439   8.315  -4.722
   16    HD2  PRO   3           HD2      PRO   3  26.506   7.938  -1.943
   17    HD3  PRO   3           HD3      PRO   3  24.886   8.451  -2.467
   18    HA   PRO   4           HA       PRO   4  28.372   2.501  -2.022
   19    HB2  PRO   4           HB2      PRO   4  29.332   0.962  -4.019
   20    HB3  PRO   4           HB3      PRO   4  27.687   0.779  -3.397
   21    HG2  PRO   4           HG2      PRO   4  28.638   2.127  -5.885
   22    HG3  PRO   4           HG3      PRO   4  27.183   1.149  -5.618
   23    HD2  PRO   4           HD2      PRO   4  27.227   3.913  -5.681
   24    HD3  PRO   4           HD3      PRO   4  25.977   2.942  -4.880
   25    H    GLU   5           H        GLU   5  29.286   5.107  -2.837
   26    HA   GLU   5           HA       GLU   5  32.140   4.624  -2.851
   27    HB2  GLU   5           HB2      GLU   5  32.413   6.354  -4.723
   28    HB3  GLU   5           HB3      GLU   5  31.894   4.741  -5.199
   29    HG2  GLU   5           HG2      GLU   5  29.598   5.498  -5.364
   30    HG3  GLU   5           HG3      GLU   5  30.066   7.103  -4.799
   31    H    ALA   6           H        ALA   6  29.775   5.868  -1.351
   32    HA   ALA   6           HA       ALA   6  31.229   8.043  -0.176
   33    HB1  ALA   6           HB1      ALA   6  30.425   9.643  -1.551
   34    HB2  ALA   6           HB2      ALA   6  28.933   9.447  -0.633
   35    HB3  ALA   6           HB3      ALA   6  29.139   8.606  -2.169
   36    H    ASP   7           H        ASP   7  29.922   5.472   0.339
   37    HA   ASP   7           HA       ASP   7  27.668   5.968   2.059
   38    HB2  ASP   7           HB2      ASP   7  27.865   3.862   0.816
   39    HB3  ASP   7           HB3      ASP   7  29.423   3.538   1.562
   40    HA   PRO   8           HA       PRO   8  29.768   7.205   5.779
   41    HB2  PRO   8           HB2      PRO   8  28.377   4.871   7.033
   42    HB3  PRO   8           HB3      PRO   8  28.502   6.541   7.597
   43    HG2  PRO   8           HG2      PRO   8  26.270   5.640   6.430
   44    HG3  PRO   8           HG3      PRO   8  26.851   7.292   6.162
   45    HD2  PRO   8           HD2      PRO   8  26.873   4.965   4.326
   46    HD3  PRO   8           HD3      PRO   8  26.846   6.699   3.958
   47    H    ARG   9           H        ARG   9  29.861   3.898   4.698
   48    HA   ARG   9           HA       ARG   9  32.131   3.198   6.387
   49    HE   ARG   9           HE       ARG   9  28.522   1.330   4.421
   50    HB2  ARG   9           HB2      ARG   9  30.512   1.646   4.363
   51    HB3  ARG   9           HB3      ARG   9  31.822   0.960   5.333
   52    HG2  ARG   9           HG2      ARG   9  30.616   1.191   7.335
   53    HG3  ARG   9           HG3      ARG   9  29.451   2.296   6.606
   54    HD2  ARG   9           HD2      ARG   9  29.769  -0.629   5.935
   55    HD3  ARG   9           HD3      ARG   9  28.503   0.062   6.949
   56   HH11  ARG   9          HH11      ARG   9  27.653  -1.689   5.961
   57   HH12  ARG   9          HH12      ARG   9  26.394  -2.052   4.822
   58   HH21  ARG   9          HH21      ARG   9  26.847   0.877   2.944
   59   HH22  ARG   9          HH22      ARG   9  25.939  -0.600   3.095
   60    H    LEU  10           H        LEU  10  31.427   3.875   2.989
   61    HA   LEU  10           HA       LEU  10  34.141   3.162   2.247
   62    HG   LEU  10           HG       LEU  10  31.478   1.659   1.493
   63    HB2  LEU  10           HB2      LEU  10  31.761   3.889   0.539
   64    HB3  LEU  10           HB3      LEU  10  33.339   3.446  -0.081
   65   HD11  LEU  10          HD11      LEU  10  30.661   1.859  -0.712
   66   HD12  LEU  10          HD12      LEU  10  31.557   0.341  -0.658
   67   HD13  LEU  10          HD13      LEU  10  32.282   1.767  -1.399
   68   HD21  LEU  10          HD21      LEU  10  33.123   0.166   1.773
   69   HD22  LEU  10          HD22      LEU  10  34.215   1.526   1.502
   70   HD23  LEU  10          HD23      LEU  10  33.786   0.456   0.166
   71    H    ILE  11           H        ILE  11  32.233   5.894   2.938
   72    HA   ILE  11           HA       ILE  11  33.959   7.801   1.590
   73    HB   ILE  11           HB       ILE  11  31.420   8.036   2.427
   74   HG12  ILE  11          HG12      ILE  11  32.812   9.674   1.082
   75   HG13  ILE  11          HG13      ILE  11  31.572  10.391   2.105
   76   HG21  ILE  11          HG21      ILE  11  32.580   9.632   4.614
   77   HG22  ILE  11          HG22      ILE  11  32.525   7.885   4.856
   78   HG23  ILE  11          HG23      ILE  11  31.042   8.776   4.515
   79   HD11  ILE  11          HD11      ILE  11  33.118  11.257   3.582
   80   HD12  ILE  11          HD12      ILE  11  33.902  11.467   2.015
   81   HD13  ILE  11          HD13      ILE  11  34.384  10.140   3.076
   82    H    GLU  12           H        GLU  12  34.081   5.744   4.156
   83    HA   GLU  12           HA       GLU  12  36.126   7.296   5.584
   84    HB2  GLU  12           HB2      GLU  12  34.293   6.046   6.856
   85    HB3  GLU  12           HB3      GLU  12  35.090   4.564   6.349
   86    HG2  GLU  12           HG2      GLU  12  37.181   5.445   7.433
   87    HG3  GLU  12           HG3      GLU  12  36.189   6.736   8.110
   88    H    SER  13           H        SER  13  35.618   4.006   4.341
   89    HA   SER  13           HA       SER  13  38.467   3.569   4.385
   90    HG   SER  13           HG       SER  13  38.617   1.233   3.286
   91    HB2  SER  13           HB2      SER  13  36.993   1.944   5.418
   92    HB3  SER  13           HB3      SER  13  36.168   1.672   3.884
   93    H    LEU  14           H        LEU  14  36.091   4.028   1.819
   94    HA   LEU  14           HA       LEU  14  37.917   2.822  -0.109
   95    HG   LEU  14           HG       LEU  14  36.991   2.622  -2.414
   96    HB2  LEU  14           HB2      LEU  14  35.506   2.263  -0.213
   97    HB3  LEU  14           HB3      LEU  14  35.139   3.951  -0.500
   98   HD11  LEU  14          HD11      LEU  14  34.240   1.748  -1.883
   99   HD12  LEU  14          HD12      LEU  14  35.557   0.920  -2.709
  100   HD13  LEU  14          HD13      LEU  14  34.593   2.118  -3.570
  101   HD21  LEU  14          HD21      LEU  14  35.181   4.917  -2.306
  102   HD22  LEU  14          HD22      LEU  14  35.081   3.994  -3.804
  103   HD23  LEU  14          HD23      LEU  14  36.628   4.658  -3.279
  104    H    SER  15           H        SER  15  36.338   5.873   0.627
  105    HA   SER  15           HA       SER  15  37.618   7.184  -1.522
  106    HG   SER  15           HG       SER  15  36.109   9.240   1.489
  107    HB2  SER  15           HB2      SER  15  36.741   9.285  -0.496
  108    HB3  SER  15           HB3      SER  15  35.507   8.054  -0.777
  109    H    GLN  16           H        GLN  16  38.742   6.138   1.427
  110    HA   GLN  16           HA       GLN  16  40.569   8.134   2.204
  111    HB2  GLN  16           HB2      GLN  16  40.117   6.235   3.647
  112    HB3  GLN  16           HB3      GLN  16  40.708   5.115   2.432
  113    HG2  GLN  16           HG2      GLN  16  42.574   7.188   3.468
  114    HG3  GLN  16           HG3      GLN  16  42.173   5.823   4.504
  115   HE21  GLN  16          HE21      GLN  16  44.398   6.890   2.412
  116   HE22  GLN  16          HE22      GLN  16  44.980   5.392   1.776
  117    H    MET  17           H        MET  17  41.157   5.196   0.246
  118    HA   MET  17           HA       MET  17  43.654   6.227  -0.690
  119    HB2  MET  17           HB2      MET  17  43.705   4.257  -2.171
  120    HB3  MET  17           HB3      MET  17  43.406   3.830  -0.494
  121    HG2  MET  17           HG2      MET  17  41.156   4.142  -2.445
  122    HG3  MET  17           HG3      MET  17  42.073   2.641  -2.328
  123    HE1  MET  17           HE1      MET  17  42.586   1.529  -0.180
  124    HE2  MET  17           HE2      MET  17  41.326   1.186   1.007
  125    HE3  MET  17           HE3      MET  17  42.407   2.562   1.238
  126    H    LEU  18           H        LEU  18  40.342   6.296  -1.806
  127    HA   LEU  18           HA       LEU  18  40.837   6.897  -4.517
  128    HG   LEU  18           HG       LEU  18  38.583   8.787  -5.186
  129    HB2  LEU  18           HB2      LEU  18  38.627   6.292  -3.477
  130    HB3  LEU  18           HB3      LEU  18  38.545   7.932  -2.860
  131   HD11  LEU  18          HD11      LEU  18  38.954   7.502  -6.969
  132   HD12  LEU  18          HD12      LEU  18  37.865   6.240  -6.394
  133   HD13  LEU  18          HD13      LEU  18  39.533   6.289  -5.826
  134   HD21  LEU  18          HD21      LEU  18  36.475   8.289  -3.908
  135   HD22  LEU  18          HD22      LEU  18  36.391   6.766  -4.794
  136   HD23  LEU  18          HD23      LEU  18  36.312   8.296  -5.665
  137    H    SER  19           H        SER  19  40.938   8.923  -1.654
  138    HA   SER  19           HA       SER  19  41.190  11.322  -3.303
  139    HG   SER  19           HG       SER  19  41.411  13.151  -0.367
  140    HB2  SER  19           HB2      SER  19  39.674  11.331  -1.320
  141    HB3  SER  19           HB3      SER  19  41.081  11.085  -0.287
  142    H    MET  20           H        MET  20  43.075   9.303  -1.112
  143    HA   MET  20           HA       MET  20  45.252  11.164  -0.966
  144    HB2  MET  20           HB2      MET  20  44.962   8.305  -0.054
  145    HB3  MET  20           HB3      MET  20  46.440   9.236   0.165
  146    HG2  MET  20           HG2      MET  20  45.251  10.861   1.513
  147    HG3  MET  20           HG3      MET  20  43.731  10.011   1.235
  148    HE1  MET  20           HE1      MET  20  47.255   8.996   1.770
  149    HE2  MET  20           HE2      MET  20  47.180   7.695   2.957
  150    HE3  MET  20           HE3      MET  20  47.333   9.367   3.494
  151    H    GLY  21           H        GLY  21  44.335   8.896  -3.315
  152    HA2  GLY  21           HA2      GLY  21  45.425   8.836  -5.412
  153    HA3  GLY  21           HA3      GLY  21  46.919   9.319  -4.618
  154    H    PHE  22           H        PHE  22  44.735   6.646  -3.813
  155    HA   PHE  22           HA       PHE  22  46.784   4.764  -4.734
  156    HD1  PHE  22           HD1      PHE  22  46.246   6.748  -1.485
  157    HD2  PHE  22           HD2      PHE  22  48.545   3.264  -2.292
  158    HE1  PHE  22           HE1      PHE  22  48.139   7.712  -0.244
  159    HE2  PHE  22           HE2      PHE  22  50.440   4.217  -1.055
  160    HZ   PHE  22           HZ       PHE  22  50.239   6.443  -0.027
  161    HB2  PHE  22           HB2      PHE  22  45.219   4.496  -2.148
  162    HB3  PHE  22           HB3      PHE  22  46.294   3.275  -2.823
  163    H    SER  23           H        SER  23  45.800   2.598  -5.187
  164    HA   SER  23           HA       SER  23  42.925   2.786  -5.663
  165    HG   SER  23           HG       SER  23  44.524   3.924  -8.685
  166    HB2  SER  23           HB2      SER  23  44.965   2.031  -7.778
  167    HB3  SER  23           HB3      SER  23  43.215   1.920  -7.973
  168    H    ASP  24           H        ASP  24  42.320   0.519  -6.828
  169    HA   ASP  24           HA       ASP  24  43.053  -1.508  -4.916
  170    HB2  ASP  24           HB2      ASP  24  41.551  -2.963  -6.350
  171    HB3  ASP  24           HB3      ASP  24  40.775  -1.559  -5.624
  172    H    GLU  25           H        GLU  25  44.844  -2.618  -5.085
  173    HA   GLU  25           HA       GLU  25  46.271  -2.797  -7.597
  174    HB2  GLU  25           HB2      GLU  25  47.435  -2.309  -5.449
  175    HB3  GLU  25           HB3      GLU  25  46.994  -3.910  -4.877
  176    HG2  GLU  25           HG2      GLU  25  49.170  -4.166  -5.582
  177    HG3  GLU  25           HG3      GLU  25  48.234  -4.777  -6.940
  178    H    GLY  26           H        GLY  26  44.148  -4.068  -8.204
  179    HA2  GLY  26           HA2      GLY  26  44.578  -6.399  -9.244
  180    HA3  GLY  26           HA3      GLY  26  44.498  -6.918  -7.569
  181    H    GLY  27           H        GLY  27  42.391  -4.449  -7.680
  182    HA2  GLY  27           HA2      GLY  27  40.113  -4.279  -8.163
  183    HA3  GLY  27           HA3      GLY  27  40.171  -5.885  -8.879
  184    H    TRP  28           H        TRP  28  41.630  -5.455  -5.800
  185    HA   TRP  28           HA       TRP  28  39.700  -7.262  -4.621
  186    HD1  TRP  28           HD1      TRP  28  44.059  -6.356  -4.946
  187    HE1  TRP  28           HE1      TRP  28  45.213  -4.164  -4.261
  188    HE3  TRP  28           HE3      TRP  28  40.675  -4.681  -1.503
  189    HZ2  TRP  28           HZ2      TRP  28  44.732  -1.996  -2.520
  190    HZ3  TRP  28           HZ3      TRP  28  41.092  -2.542  -0.376
  191    HH2  TRP  28           HH2      TRP  28  43.077  -1.231  -0.873
  192    HB2  TRP  28           HB2      TRP  28  41.229  -7.093  -2.614
  193    HB3  TRP  28           HB3      TRP  28  42.008  -7.682  -4.087
  194    H    LEU  29           H        LEU  29  39.988  -3.894  -4.873
  195    HA   LEU  29           HA       LEU  29  39.504  -3.053  -2.302
  196    HG   LEU  29           HG       LEU  29  37.424  -0.724  -3.031
  197    HB2  LEU  29           HB2      LEU  29  40.199  -1.483  -3.933
  198    HB3  LEU  29           HB3      LEU  29  38.776  -1.739  -4.909
  199   HD11  LEU  29          HD11      LEU  29  39.185   0.858  -1.721
  200   HD12  LEU  29          HD12      LEU  29  40.109  -0.637  -1.859
  201   HD13  LEU  29          HD13      LEU  29  38.525  -0.648  -1.085
  202   HD21  LEU  29          HD21      LEU  29  37.524   1.011  -4.407
  203   HD22  LEU  29          HD22      LEU  29  39.123   0.524  -4.972
  204   HD23  LEU  29          HD23      LEU  29  38.968   1.558  -3.552
  205    H    THR  30           H        THR  30  37.191  -4.357  -4.544
  206    HA   THR  30           HA       THR  30  35.002  -3.714  -2.706
  207    HB   THR  30           HB       THR  30  34.907  -5.107  -5.396
  208    HG1  THR  30           HG1      THR  30  35.115  -2.479  -4.671
  209   HG21  THR  30          HG21      THR  30  32.928  -5.135  -3.567
  210   HG22  THR  30          HG22      THR  30  32.665  -5.125  -5.312
  211   HG23  THR  30          HG23      THR  30  32.579  -3.620  -4.397
  212    H    ARG  31           H        ARG  31  37.272  -6.152  -3.246
  213    HA   ARG  31           HA       ARG  31  35.541  -8.297  -2.272
  214    HE   ARG  31           HE       ARG  31  36.649 -10.733  -6.273
  215    HB2  ARG  31           HB2      ARG  31  38.438  -8.740  -2.810
  216    HB3  ARG  31           HB3      ARG  31  37.070  -9.807  -3.096
  217    HG2  ARG  31           HG2      ARG  31  36.407  -8.285  -4.985
  218    HG3  ARG  31           HG3      ARG  31  37.937  -7.449  -4.752
  219    HD2  ARG  31           HD2      ARG  31  38.244  -9.024  -6.509
  220    HD3  ARG  31           HD3      ARG  31  39.102  -9.632  -5.095
  221   HH11  ARG  31          HH11      ARG  31  39.179 -10.935  -3.860
  222   HH12  ARG  31          HH12      ARG  31  38.789 -12.569  -3.413
  223   HH21  ARG  31          HH21      ARG  31  36.152 -12.876  -5.711
  224   HH22  ARG  31          HH22      ARG  31  37.078 -13.681  -4.479
  225    H    LEU  32           H        LEU  32  38.694  -6.863  -1.451
  226    HA   LEU  32           HA       LEU  32  39.164  -8.386   0.829
  227    HG   LEU  32           HG       LEU  32  40.625  -6.536   2.533
  228    HB2  LEU  32           HB2      LEU  32  40.908  -7.197  -0.367
  229    HB3  LEU  32           HB3      LEU  32  40.199  -5.653   0.078
  230   HD11  LEU  32          HD11      LEU  32  42.748  -7.971   0.957
  231   HD12  LEU  32          HD12      LEU  32  41.393  -8.749   1.777
  232   HD13  LEU  32          HD13      LEU  32  42.611  -7.881   2.712
  233   HD21  LEU  32          HD21      LEU  32  42.788  -5.401   2.507
  234   HD22  LEU  32          HD22      LEU  32  41.580  -4.513   1.578
  235   HD23  LEU  32          HD23      LEU  32  42.806  -5.470   0.746
  236    H    LEU  33           H        LEU  33  38.788  -4.866   1.078
  237    HA   LEU  33           HA       LEU  33  38.223  -5.067   3.807
  238    HG   LEU  33           HG       LEU  33  38.633  -3.039   0.773
  239    HB2  LEU  33           HB2      LEU  33  37.683  -2.585   3.605
  240    HB3  LEU  33           HB3      LEU  33  39.306  -3.126   3.208
  241   HD11  LEU  33          HD11      LEU  33  36.480  -1.142   1.324
  242   HD12  LEU  33          HD12      LEU  33  36.080  -2.818   1.700
  243   HD13  LEU  33          HD13      LEU  33  36.614  -2.381   0.075
  244   HD21  LEU  33          HD21      LEU  33  38.611  -0.477   0.769
  245   HD22  LEU  33          HD22      LEU  33  39.992  -1.299   1.499
  246   HD23  LEU  33          HD23      LEU  33  38.729  -0.616   2.524
  247    H    GLN  34           H        GLN  34  36.101  -5.309   1.173
  248    HA   GLN  34           HA       GLN  34  33.739  -4.308   2.360
  249    HB2  GLN  34           HB2      GLN  34  33.964  -4.727  -0.026
  250    HB3  GLN  34           HB3      GLN  34  34.120  -6.450   0.263
  251    HG2  GLN  34           HG2      GLN  34  31.927  -6.242  -0.411
  252    HG3  GLN  34           HG3      GLN  34  31.796  -6.269   1.344
  253   HE21  GLN  34          HE21      GLN  34  33.050  -3.313   0.490
  254   HE22  GLN  34          HE22      GLN  34  31.585  -2.409   0.417
  255    H    THR  35           H        THR  35  35.393  -7.416   2.592
  256    HA   THR  35           HA       THR  35  33.247  -8.419   4.317
  257    HB   THR  35           HB       THR  35  34.467 -10.568   4.267
  258    HG1  THR  35           HG1      THR  35  36.544 -10.198   3.927
  259   HG21  THR  35          HG21      THR  35  34.361  -9.784   1.404
  260   HG22  THR  35          HG22      THR  35  32.876  -9.735   2.354
  261   HG23  THR  35          HG23      THR  35  33.776 -11.243   2.203
  262    H    LYS  36           H        LYS  36  36.267  -6.894   4.428
  263    HA   LYS  36           HA       LYS  36  36.944  -7.775   7.113
  264    HB2  LYS  36           HB2      LYS  36  38.267  -6.083   5.044
  265    HB3  LYS  36           HB3      LYS  36  38.738  -5.880   6.723
  266    HG2  LYS  36           HG2      LYS  36  39.313  -8.257   6.844
  267    HG3  LYS  36           HG3      LYS  36  38.851  -8.445   5.148
  268    HD2  LYS  36           HD2      LYS  36  40.612  -7.061   4.411
  269    HD3  LYS  36           HD3      LYS  36  40.916  -6.449   6.038
  270    HE2  LYS  36           HE2      LYS  36  42.629  -8.058   5.320
  271    HE3  LYS  36           HE3      LYS  36  41.736  -8.626   6.731
  272    HZ1  LYS  36           HZ1      LYS  36  40.474  -9.524   4.358
  273    HZ2  LYS  36           HZ2      LYS  36  41.139 -10.434   5.632
  274    HZ3  LYS  36           HZ3      LYS  36  42.120  -9.954   4.335
  275    H    ASN  37           H        ASN  37  34.455  -6.501   6.905
  276    HA   ASN  37           HA       ASN  37  33.163  -4.782   7.599
  277    HB2  ASN  37           HB2      ASN  37  33.643  -3.989   9.925
  278    HB3  ASN  37           HB3      ASN  37  33.557  -5.736   9.732
  279   HD21  ASN  37          HD21      ASN  37  35.521  -3.047  10.593
  280   HD22  ASN  37          HD22      ASN  37  36.903  -3.949  11.097
  281    H    TYR  38           H        TYR  38  34.916  -3.879   5.698
  282    HA   TYR  38           HA       TYR  38  35.599  -1.957   4.707
  283    HD1  TYR  38           HD1      TYR  38  33.500  -0.943   3.178
  284    HD2  TYR  38           HD2      TYR  38  31.998  -2.081   6.990
  285    HE1  TYR  38           HE1      TYR  38  31.510  -1.903   2.105
  286    HE2  TYR  38           HE2      TYR  38  30.006  -3.046   5.926
  287    HH   TYR  38           HH       TYR  38  29.374  -3.964   3.703
  288    HB2  TYR  38           HB2      TYR  38  33.893  -0.673   6.852
  289    HB3  TYR  38           HB3      TYR  38  34.368   0.060   5.322
  290    H    ASP  39           H        ASP  39  37.791  -2.512   5.646
  291    HA   ASP  39           HA       ASP  39  38.600  -0.292   7.405
  292    HB2  ASP  39           HB2      ASP  39  39.955  -1.605   8.728
  293    HB3  ASP  39           HB3      ASP  39  38.587  -2.676   8.431
  294    H    ILE  40           H        ILE  40  40.450   0.744   7.056
  295    HA   ILE  40           HA       ILE  40  41.774   0.280   4.503
  296    HB   ILE  40           HB       ILE  40  42.984   2.427   5.019
  297   HG12  ILE  40          HG12      ILE  40  42.245   2.198   7.558
  298   HG13  ILE  40          HG13      ILE  40  42.463   3.777   6.813
  299   HG21  ILE  40          HG21      ILE  40  40.269   1.996   4.192
  300   HG22  ILE  40          HG22      ILE  40  41.473   3.122   3.562
  301   HG23  ILE  40          HG23      ILE  40  40.452   3.589   4.924
  302   HD11  ILE  40          HD11      ILE  40  40.356   4.322   7.215
  303   HD12  ILE  40          HD12      ILE  40  40.201   2.824   8.138
  304   HD13  ILE  40          HD13      ILE  40  39.771   2.859   6.426
  305    H    GLY  41           H        GLY  41  42.042  -0.711   7.625
  306    HA2  GLY  41           HA2      GLY  41  44.772  -0.401   8.177
  307    HA3  GLY  41           HA3      GLY  41  43.734  -1.621   8.885
  308    H    ALA  42           H        ALA  42  42.998  -2.959   6.604
  309    HA   ALA  42           HA       ALA  42  45.501  -4.296   5.883
  310    HB1  ALA  42           HB1      ALA  42  42.805  -5.202   6.313
  311    HB2  ALA  42           HB2      ALA  42  44.290  -6.141   6.157
  312    HB3  ALA  42           HB3      ALA  42  43.378  -5.688   4.717
  313    H    ALA  43           H        ALA  43  43.041  -2.279   4.633
  314    HA   ALA  43           HA       ALA  43  43.404  -2.795   1.863
  315    HB1  ALA  43           HB1      ALA  43  41.946  -1.078   1.487
  316    HB2  ALA  43           HB2      ALA  43  42.615  -0.080   2.779
  317    HB3  ALA  43           HB3      ALA  43  41.551  -1.433   3.171
  318    H    LEU  44           H        LEU  44  45.049  -0.749   4.177
  319    HA   LEU  44           HA       LEU  44  46.461   0.874   2.340
  320    HG   LEU  44           HG       LEU  44  48.241   2.364   3.561
  321    HB2  LEU  44           HB2      LEU  44  46.185   0.748   5.078
  322    HB3  LEU  44           HB3      LEU  44  47.857   0.265   4.843
  323   HD11  LEU  44          HD11      LEU  44  46.073   2.861   2.741
  324   HD12  LEU  44          HD12      LEU  44  46.502   4.156   3.859
  325   HD13  LEU  44          HD13      LEU  44  45.387   2.885   4.366
  326   HD21  LEU  44          HD21      LEU  44  48.955   2.472   5.775
  327   HD22  LEU  44          HD22      LEU  44  47.310   2.436   6.411
  328   HD23  LEU  44          HD23      LEU  44  47.919   3.886   5.610
  329    H    ASP  45           H        ASP  45  47.084  -2.242   3.778
  330    HA   ASP  45           HA       ASP  45  49.778  -2.530   2.910
  331    HB2  ASP  45           HB2      ASP  45  48.991  -3.857   4.749
  332    HB3  ASP  45           HB3      ASP  45  47.671  -4.515   3.788
  333    H    THR  46           H        THR  46  46.650  -3.276   1.495
  334    HA   THR  46           HA       THR  46  47.883  -4.765  -0.653
  335    HB   THR  46           HB       THR  46  45.515  -5.103  -1.390
  336    HG1  THR  46           HG1      THR  46  44.439  -3.385  -0.620
  337   HG21  THR  46          HG21      THR  46  46.546  -5.931   1.248
  338   HG22  THR  46          HG22      THR  46  46.015  -6.903  -0.125
  339   HG23  THR  46          HG23      THR  46  44.826  -6.166   0.950
  340    H    ILE  47           H        ILE  47  46.649  -1.486  -0.232
  341    HA   ILE  47           HA       ILE  47  46.090  -1.071  -2.996
  342    HB   ILE  47           HB       ILE  47  46.317   1.412  -2.424
  343   HG12  ILE  47          HG12      ILE  47  46.510   0.251   0.357
  344   HG13  ILE  47          HG13      ILE  47  47.731   1.222  -0.463
  345   HG21  ILE  47          HG21      ILE  47  44.199  -0.147  -2.376
  346   HG22  ILE  47          HG22      ILE  47  44.128   1.519  -1.797
  347   HG23  ILE  47          HG23      ILE  47  44.276   0.194  -0.646
  348   HD11  ILE  47          HD11      ILE  47  44.979   2.244   0.161
  349   HD12  ILE  47          HD12      ILE  47  46.401   3.166  -0.328
  350   HD13  ILE  47          HD13      ILE  47  46.345   2.406   1.263
  351    H    GLN  48           H        GLN  48  49.020  -0.910  -1.130
  352    HA   GLN  48           HA       GLN  48  50.638  -0.843  -3.435
  353    HB2  GLN  48           HB2      GLN  48  49.747   1.705  -2.730
  354    HB3  GLN  48           HB3      GLN  48  51.366   1.611  -2.048
  355    HG2  GLN  48           HG2      GLN  48  52.120   2.178  -4.056
  356    HG3  GLN  48           HG3      GLN  48  51.656   0.561  -4.589
  357   HE21  GLN  48          HE21      GLN  48  49.005   2.398  -3.650
  358   HE22  GLN  48          HE22      GLN  48  48.459   2.879  -5.224
  359    H    TYR  49           H        TYR  49  50.512   0.093  -0.012
  360    HA   TYR  49           HA       TYR  49  53.282  -0.555   0.371
  361    HD1  TYR  49           HD1      TYR  49  54.474   1.325   1.005
  362    HD2  TYR  49           HD2      TYR  49  50.505   2.482   2.006
  363    HE1  TYR  49           HE1      TYR  49  54.986   3.630   0.333
  364    HE2  TYR  49           HE2      TYR  49  51.007   4.795   1.340
  365    HH   TYR  49           HH       TYR  49  53.701   5.634  -0.473
  366    HB2  TYR  49           HB2      TYR  49  51.123   0.285   2.310
  367    HB3  TYR  49           HB3      TYR  49  52.812   0.041   2.757
  368    H    SER  50           H        SER  50  53.095  -2.842  -0.275
  369    HA   SER  50           HA       SER  50  51.883  -4.595   1.712
  370    HG   SER  50           HG       SER  50  50.801  -4.641  -0.337
  371    HB2  SER  50           HB2      SER  50  53.466  -5.303  -0.772
  372    HB3  SER  50           HB3      SER  50  52.548  -6.427   0.233
  373    H    LYS  51           H        LYS  51  54.403  -2.785   1.817
  374    HA   LYS  51           HA       LYS  51  55.795  -4.537   3.633
  375    HB2  LYS  51           HB2      LYS  51  58.053  -3.807   2.679
  376    HB3  LYS  51           HB3      LYS  51  57.167  -5.030   1.782
  377    HG2  LYS  51           HG2      LYS  51  57.719  -3.726   0.033
  378    HG3  LYS  51           HG3      LYS  51  56.278  -2.839   0.523
  379    HD2  LYS  51           HD2      LYS  51  57.707  -1.328   1.865
  380    HD3  LYS  51           HD3      LYS  51  59.131  -2.182   1.266
  381    HE2  LYS  51           HE2      LYS  51  57.123  -0.627  -0.364
  382    HE3  LYS  51           HE3      LYS  51  58.794  -0.171  -0.025
  383    HZ1  LYS  51           HZ1      LYS  51  58.800  -1.058  -2.184
  384    HZ2  LYS  51           HZ2      LYS  51  57.809  -2.371  -1.757
  385    HZ3  LYS  51           HZ3      LYS  51  59.416  -2.308  -1.211
  386    H    HIS  52           H        HIS  52  56.069  -3.456   5.447
  387    HA   HIS  52           HA       HIS  52  55.860  -0.533   5.352
  388    HD1  HIS  52           HD1      HIS  52  53.332  -0.122   5.464
  389    HD2  HIS  52           HD2      HIS  52  53.166  -3.714   7.561
  390    HE1  HIS  52           HE1      HIS  52  51.031  -1.089   5.045
  391    HB2  HIS  52           HB2      HIS  52  55.470  -2.392   7.712
  392    HB3  HIS  52           HB3      HIS  52  55.159  -0.660   7.688
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1  19.478   9.544   4.878
    2    H2   GLY   1           2H       GLY   1  20.441  10.371   3.754
    3    H3   GLY   1           3H       GLY   1  21.138   9.724   5.159
    4    HA2  GLY   1           HA2      GLY   1  20.366   7.474   4.333
    5    HA3  GLY   1           HA3      GLY   1  20.095   8.287   2.795
    6    H    SER   2           H        SER   2  21.833   6.244   2.763
    7    HA   SER   2           HA       SER   2  24.452   7.592   2.644
    8    HG   SER   2           HG       SER   2  23.662   5.499   5.269
    9    HB2  SER   2           HB2      SER   2  23.948   4.692   3.348
   10    HB3  SER   2           HB3      SER   2  25.521   5.484   3.260
   11    HA   PRO   3           HA       PRO   3  23.989   6.274  -1.672
   12    HB2  PRO   3           HB2      PRO   3  26.406   7.855  -2.080
   13    HB3  PRO   3           HB3      PRO   3  24.791   8.113  -2.741
   14    HG2  PRO   3           HG2      PRO   3  25.906   9.758  -0.894
   15    HG3  PRO   3           HG3      PRO   3  24.158   9.482  -1.008
   16    HD2  PRO   3           HD2      PRO   3  26.147   8.297   0.900
   17    HD3  PRO   3           HD3      PRO   3  24.493   8.877   1.207
   18    HA   PRO   4           HA       PRO   4  26.910   2.990  -1.193
   19    HB2  PRO   4           HB2      PRO   4  26.450   2.338  -4.017
   20    HB3  PRO   4           HB3      PRO   4  26.058   1.405  -2.572
   21    HG2  PRO   4           HG2      PRO   4  24.155   2.587  -4.067
   22    HG3  PRO   4           HG3      PRO   4  24.005   2.420  -2.308
   23    HD2  PRO   4           HD2      PRO   4  24.788   4.816  -3.928
   24    HD3  PRO   4           HD3      PRO   4  23.736   4.716  -2.498
   25    H    GLU   5           H        GLU   5  27.747   5.679  -2.505
   26    HA   GLU   5           HA       GLU   5  30.394   4.685  -3.189
   27    HB2  GLU   5           HB2      GLU   5  28.889   6.663  -4.916
   28    HB3  GLU   5           HB3      GLU   5  30.615   6.359  -5.041
   29    HG2  GLU   5           HG2      GLU   5  30.076   3.965  -5.514
   30    HG3  GLU   5           HG3      GLU   5  28.378   4.428  -5.591
   31    H    ALA   6           H        ALA   6  28.766   6.156  -1.097
   32    HA   ALA   6           HA       ALA   6  30.865   7.873  -0.211
   33    HB1  ALA   6           HB1      ALA   6  30.133   9.798  -1.085
   34    HB2  ALA   6           HB2      ALA   6  28.767   9.673   0.025
   35    HB3  ALA   6           HB3      ALA   6  28.620   9.063  -1.624
   36    H    ASP   7           H        ASP   7  29.878   5.599   0.786
   37    HA   ASP   7           HA       ASP   7  27.800   5.944   2.707
   38    HB2  ASP   7           HB2      ASP   7  29.998   3.858   2.518
   39    HB3  ASP   7           HB3      ASP   7  28.665   3.796   3.660
   40    HA   PRO   8           HA       PRO   8  30.243   7.652   6.086
   41    HB2  PRO   8           HB2      PRO   8  29.320   6.090   8.150
   42    HB3  PRO   8           HB3      PRO   8  28.490   7.533   7.558
   43    HG2  PRO   8           HG2      PRO   8  27.902   4.660   7.049
   44    HG3  PRO   8           HG3      PRO   8  26.787   6.028   7.205
   45    HD2  PRO   8           HD2      PRO   8  27.500   4.892   4.816
   46    HD3  PRO   8           HD3      PRO   8  26.962   6.575   4.986
   47    H    ARG   9           H        ARG   9  30.156   4.473   4.960
   48    HA   ARG   9           HA       ARG   9  32.495   3.557   6.447
   49    HE   ARG   9           HE       ARG   9  31.579  -0.891   6.289
   50    HB2  ARG   9           HB2      ARG   9  30.963   2.104   4.283
   51    HB3  ARG   9           HB3      ARG   9  32.099   1.413   5.444
   52    HG2  ARG   9           HG2      ARG   9  30.445   2.186   7.239
   53    HG3  ARG   9           HG3      ARG   9  29.302   2.384   5.905
   54    HD2  ARG   9           HD2      ARG   9  28.983   0.199   6.839
   55    HD3  ARG   9           HD3      ARG   9  29.748   0.019   5.258
   56   HH11  ARG   9          HH11      ARG   9  29.586   0.691   8.677
   57   HH12  ARG   9          HH12      ARG   9  30.593   0.238  10.019
   58   HH21  ARG   9          HH21      ARG   9  32.948  -1.457   8.035
   59   HH22  ARG   9          HH22      ARG   9  32.530  -0.961   9.651
   60    H    LEU  10           H        LEU  10  31.462   4.279   3.108
   61    HA   LEU  10           HA       LEU  10  34.061   3.632   2.090
   62    HG   LEU  10           HG       LEU  10  31.425   2.210   1.342
   63    HB2  LEU  10           HB2      LEU  10  31.526   4.547   0.763
   64    HB3  LEU  10           HB3      LEU  10  33.023   4.311  -0.117
   65   HD11  LEU  10          HD11      LEU  10  30.476   1.887  -0.626
   66   HD12  LEU  10          HD12      LEU  10  32.058   1.505  -1.305
   67   HD13  LEU  10          HD13      LEU  10  31.460   3.163  -1.344
   68   HD21  LEU  10          HD21      LEU  10  33.142   0.629   0.540
   69   HD22  LEU  10          HD22      LEU  10  33.766   1.769   1.733
   70   HD23  LEU  10          HD23      LEU  10  34.125   1.998   0.021
   71    H    ILE  11           H        ILE  11  32.418   6.496   3.074
   72    HA   ILE  11           HA       ILE  11  34.108   8.308   1.609
   73    HB   ILE  11           HB       ILE  11  31.887   8.972   2.608
   74   HG12  ILE  11          HG12      ILE  11  34.259  10.620   3.510
   75   HG13  ILE  11          HG13      ILE  11  33.573  10.636   1.888
   76   HG21  ILE  11          HG21      ILE  11  32.131   9.757   5.062
   77   HG22  ILE  11          HG22      ILE  11  33.422   8.558   5.138
   78   HG23  ILE  11          HG23      ILE  11  31.780   8.061   4.725
   79   HD11  ILE  11          HD11      ILE  11  31.444  11.436   2.840
   80   HD12  ILE  11          HD12      ILE  11  32.791  12.542   3.111
   81   HD13  ILE  11          HD13      ILE  11  32.217  11.514   4.423
   82    H    GLU  12           H        GLU  12  34.398   6.211   4.212
   83    HA   GLU  12           HA       GLU  12  36.837   7.497   5.226
   84    HB2  GLU  12           HB2      GLU  12  35.159   5.217   6.251
   85    HB3  GLU  12           HB3      GLU  12  36.787   5.503   6.848
   86    HG2  GLU  12           HG2      GLU  12  34.609   7.574   6.906
   87    HG3  GLU  12           HG3      GLU  12  34.954   6.475   8.240
   88    H    SER  13           H        SER  13  35.869   4.171   4.402
   89    HA   SER  13           HA       SER  13  38.589   3.417   4.117
   90    HG   SER  13           HG       SER  13  36.967   1.097   5.768
   91    HB2  SER  13           HB2      SER  13  36.148   1.787   3.414
   92    HB3  SER  13           HB3      SER  13  37.756   1.185   3.814
   93    H    LEU  14           H        LEU  14  36.156   4.305   1.736
   94    HA   LEU  14           HA       LEU  14  37.808   3.169  -0.386
   95    HG   LEU  14           HG       LEU  14  34.841   2.819  -2.503
   96    HB2  LEU  14           HB2      LEU  14  35.083   3.345  -0.127
   97    HB3  LEU  14           HB3      LEU  14  35.431   4.738  -1.132
   98   HD11  LEU  14          HD11      LEU  14  37.179   2.604  -3.711
   99   HD12  LEU  14          HD12      LEU  14  37.584   3.948  -2.642
  100   HD13  LEU  14          HD13      LEU  14  36.235   4.096  -3.769
  101   HD21  LEU  14          HD21      LEU  14  35.349   0.841  -1.564
  102   HD22  LEU  14          HD22      LEU  14  36.792   1.467  -0.761
  103   HD23  LEU  14          HD23      LEU  14  36.850   1.028  -2.470
  104    H    SER  15           H        SER  15  36.346   6.204   0.642
  105    HA   SER  15           HA       SER  15  37.502   7.779  -1.324
  106    HG   SER  15           HG       SER  15  36.760  10.662   0.632
  107    HB2  SER  15           HB2      SER  15  35.583   8.477   0.089
  108    HB3  SER  15           HB3      SER  15  36.698   8.694   1.440
  109    H    GLN  16           H        GLN  16  38.834   6.582   1.638
  110    HA   GLN  16           HA       GLN  16  40.946   8.317   2.125
  111    HB2  GLN  16           HB2      GLN  16  40.501   6.513   3.649
  112    HB3  GLN  16           HB3      GLN  16  40.749   5.311   2.395
  113    HG2  GLN  16           HG2      GLN  16  43.017   7.090   3.132
  114    HG3  GLN  16           HG3      GLN  16  42.571   5.781   4.222
  115   HE21  GLN  16          HE21      GLN  16  44.627   6.547   1.835
  116   HE22  GLN  16          HE22      GLN  16  44.897   4.987   1.137
  117    H    MET  17           H        MET  17  40.832   5.527  -0.058
  118    HA   MET  17           HA       MET  17  43.433   6.284  -1.118
  119    HB2  MET  17           HB2      MET  17  43.133   4.044  -2.355
  120    HB3  MET  17           HB3      MET  17  43.424   4.019  -0.622
  121    HG2  MET  17           HG2      MET  17  40.996   3.753  -0.257
  122    HG3  MET  17           HG3      MET  17  40.774   3.675  -2.005
  123    HE1  MET  17           HE1      MET  17  41.739   1.163  -3.471
  124    HE2  MET  17           HE2      MET  17  43.276   0.709  -2.729
  125    HE3  MET  17           HE3      MET  17  42.947   2.398  -3.119
  126    H    LEU  18           H        LEU  18  40.068   6.089  -2.093
  127    HA   LEU  18           HA       LEU  18  40.473   6.293  -4.886
  128    HG   LEU  18           HG       LEU  18  38.057   7.904  -5.729
  129    HB2  LEU  18           HB2      LEU  18  38.340   5.657  -3.728
  130    HB3  LEU  18           HB3      LEU  18  38.126   7.346  -3.309
  131   HD11  LEU  18          HD11      LEU  18  37.650   5.990  -7.295
  132   HD12  LEU  18          HD12      LEU  18  38.219   4.912  -6.023
  133   HD13  LEU  18          HD13      LEU  18  39.304   6.127  -6.701
  134   HD21  LEU  18          HD21      LEU  18  36.098   6.333  -4.250
  135   HD22  LEU  18          HD22      LEU  18  35.885   6.262  -5.999
  136   HD23  LEU  18          HD23      LEU  18  35.897   7.822  -5.176
  137    H    SER  19           H        SER  19  40.406   8.681  -2.330
  138    HA   SER  19           HA       SER  19  40.506  10.851  -4.286
  139    HG   SER  19           HG       SER  19  38.297  10.615  -1.474
  140    HB2  SER  19           HB2      SER  19  40.340  11.015  -1.269
  141    HB3  SER  19           HB3      SER  19  40.079  12.330  -2.415
  142    H    MET  20           H        MET  20  42.649   8.905  -2.615
  143    HA   MET  20           HA       MET  20  44.673  10.971  -2.215
  144    HB2  MET  20           HB2      MET  20  44.293   9.132  -0.538
  145    HB3  MET  20           HB3      MET  20  44.900   7.994  -1.732
  146    HG2  MET  20           HG2      MET  20  46.785   8.339  -0.517
  147    HG3  MET  20           HG3      MET  20  46.978   9.594  -1.738
  148    HE1  MET  20           HE1      MET  20  46.307  12.868   0.120
  149    HE2  MET  20           HE2      MET  20  44.936  12.017  -0.594
  150    HE3  MET  20           HE3      MET  20  46.495  12.034  -1.424
  151    H    GLY  21           H        GLY  21  43.928   8.302  -4.349
  152    HA2  GLY  21           HA2      GLY  21  44.842   8.459  -6.637
  153    HA3  GLY  21           HA3      GLY  21  46.367   8.933  -5.892
  154    H    PHE  22           H        PHE  22  44.281   6.441  -4.611
  155    HA   PHE  22           HA       PHE  22  46.206   4.394  -5.476
  156    HD1  PHE  22           HD2      PHE  22  47.637   5.412  -4.474
  157    HD2  PHE  22           HD1      PHE  22  45.830   4.207  -0.814
  158    HE1  PHE  22           HE2      PHE  22  49.561   6.309  -3.230
  159    HE2  PHE  22           HE1      PHE  22  47.750   5.098   0.435
  160    HZ   PHE  22           HZ       PHE  22  49.623   6.148  -0.774
  161    HB2  PHE  22           HB2      PHE  22  44.526   4.480  -2.950
  162    HB3  PHE  22           HB3      PHE  22  45.500   3.103  -3.458
  163    H    SER  23           H        SER  23  45.178   2.322  -5.969
  164    HA   SER  23           HA       SER  23  42.294   2.534  -6.392
  165    HG   SER  23           HG       SER  23  44.389   3.778  -8.744
  166    HB2  SER  23           HB2      SER  23  44.222   1.665  -8.566
  167    HB3  SER  23           HB3      SER  23  42.467   1.768  -8.706
  168    H    ASP  24           H        ASP  24  42.134   0.104  -7.928
  169    HA   ASP  24           HA       ASP  24  42.764  -1.827  -5.843
  170    HB2  ASP  24           HB2      ASP  24  41.574  -3.464  -7.380
  171    HB3  ASP  24           HB3      ASP  24  40.578  -2.185  -6.696
  172    H    GLU  25           H        GLU  25  44.674  -2.693  -5.834
  173    HA   GLU  25           HA       GLU  25  46.352  -2.627  -8.171
  174    HB2  GLU  25           HB2      GLU  25  46.817  -3.646  -5.365
  175    HB3  GLU  25           HB3      GLU  25  48.033  -3.566  -6.612
  176    HG2  GLU  25           HG2      GLU  25  46.534  -1.167  -5.621
  177    HG3  GLU  25           HG3      GLU  25  48.067  -1.708  -4.937
  178    H    GLY  26           H        GLY  26  44.378  -4.147  -8.943
  179    HA2  GLY  26           HA2      GLY  26  45.100  -6.371 -10.060
  180    HA3  GLY  26           HA3      GLY  26  45.074  -6.948  -8.401
  181    H    GLY  27           H        GLY  27  42.743  -4.930  -8.057
  182    HA2  GLY  27           HA2      GLY  27  40.458  -4.913  -8.910
  183    HA3  GLY  27           HA3      GLY  27  40.676  -6.607  -9.326
  184    H    TRP  28           H        TRP  28  42.130  -5.958  -6.390
  185    HA   TRP  28           HA       TRP  28  40.094  -7.439  -5.004
  186    HD1  TRP  28           HD1      TRP  28  44.326  -7.056  -5.731
  187    HE1  TRP  28           HE1      TRP  28  45.841  -5.043  -5.324
  188    HE3  TRP  28           HE3      TRP  28  41.692  -4.780  -1.994
  189    HZ2  TRP  28           HZ2      TRP  28  45.921  -2.750  -3.660
  190    HZ3  TRP  28           HZ3      TRP  28  42.547  -2.680  -1.049
  191    HH2  TRP  28           HH2      TRP  28  44.621  -1.688  -1.864
  192    HB2  TRP  28           HB2      TRP  28  41.702  -7.209  -3.041
  193    HB3  TRP  28           HB3      TRP  28  42.315  -8.077  -4.452
  194    H    LEU  29           H        LEU  29  40.967  -4.058  -5.274
  195    HA   LEU  29           HA       LEU  29  40.307  -3.106  -2.790
  196    HG   LEU  29           HG       LEU  29  38.130  -0.918  -4.178
  197    HB2  LEU  29           HB2      LEU  29  41.096  -1.481  -4.203
  198    HB3  LEU  29           HB3      LEU  29  40.018  -1.921  -5.509
  199   HD11  LEU  29          HD11      LEU  29  39.113  -1.036  -1.967
  200   HD12  LEU  29          HD12      LEU  29  38.719   0.634  -2.377
  201   HD13  LEU  29          HD13      LEU  29  40.392   0.078  -2.454
  202   HD21  LEU  29          HD21      LEU  29  39.644   0.231  -5.967
  203   HD22  LEU  29          HD22      LEU  29  40.206   1.180  -4.592
  204   HD23  LEU  29          HD23      LEU  29  38.496   1.183  -5.025
  205    H    THR  30           H        THR  30  38.055  -4.154  -5.256
  206    HA   THR  30           HA       THR  30  35.715  -3.345  -3.784
  207    HB   THR  30           HB       THR  30  35.257  -3.371  -6.034
  208    HG1  THR  30           HG1      THR  30  34.582  -6.053  -5.863
  209   HG21  THR  30          HG21      THR  30  37.155  -4.224  -7.053
  210   HG22  THR  30          HG22      THR  30  35.874  -5.338  -7.527
  211   HG23  THR  30          HG23      THR  30  37.004  -5.789  -6.249
  212    H    ARG  31           H        ARG  31  37.696  -6.214  -4.029
  213    HA   ARG  31           HA       ARG  31  35.735  -7.887  -2.689
  214    HE   ARG  31           HE       ARG  31  36.336 -10.743  -5.156
  215    HB2  ARG  31           HB2      ARG  31  38.503  -8.836  -3.250
  216    HB3  ARG  31           HB3      ARG  31  36.972  -9.684  -3.414
  217    HG2  ARG  31           HG2      ARG  31  36.483  -8.252  -5.411
  218    HG3  ARG  31           HG3      ARG  31  38.126  -7.627  -5.285
  219    HD2  ARG  31           HD2      ARG  31  38.041  -9.400  -6.920
  220    HD3  ARG  31           HD3      ARG  31  38.997  -9.918  -5.527
  221   HH11  ARG  31          HH11      ARG  31  39.096 -11.391  -7.186
  222   HH12  ARG  31          HH12      ARG  31  38.645 -13.028  -7.524
  223   HH21  ARG  31          HH21      ARG  31  35.715 -12.909  -5.586
  224   HH22  ARG  31          HH22      ARG  31  36.721 -13.900  -6.607
  225    H    LEU  32           H        LEU  32  39.135  -6.999  -2.140
  226    HA   LEU  32           HA       LEU  32  39.741  -8.157   0.221
  227    HG   LEU  32           HG       LEU  32  42.749  -5.947   0.275
  228    HB2  LEU  32           HB2      LEU  32  41.131  -6.653  -1.284
  229    HB3  LEU  32           HB3      LEU  32  40.431  -5.292  -0.432
  230   HD11  LEU  32          HD11      LEU  32  41.710  -4.572   1.806
  231   HD12  LEU  32          HD12      LEU  32  42.132  -5.980   2.782
  232   HD13  LEU  32          HD13      LEU  32  40.478  -5.770   2.205
  233   HD21  LEU  32          HD21      LEU  32  42.751  -7.883   1.952
  234   HD22  LEU  32          HD22      LEU  32  42.795  -8.257   0.229
  235   HD23  LEU  32          HD23      LEU  32  41.283  -8.407   1.126
  236    H    LEU  33           H        LEU  33  38.435  -4.847   0.037
  237    HA   LEU  33           HA       LEU  33  38.154  -4.614   2.832
  238    HG   LEU  33           HG       LEU  33  39.339  -2.504   2.410
  239    HB2  LEU  33           HB2      LEU  33  37.002  -2.989   0.570
  240    HB3  LEU  33           HB3      LEU  33  36.781  -2.570   2.259
  241   HD11  LEU  33          HD11      LEU  33  38.954  -2.688  -0.556
  242   HD12  LEU  33          HD12      LEU  33  40.089  -3.560   0.476
  243   HD13  LEU  33          HD13      LEU  33  40.336  -1.845   0.144
  244   HD21  LEU  33          HD21      LEU  33  37.429  -0.598   1.736
  245   HD22  LEU  33          HD22      LEU  33  38.757  -0.329   0.609
  246   HD23  LEU  33          HD23      LEU  33  39.057  -0.306   2.347
  247    H    GLN  34           H        GLN  34  35.900  -5.482   0.298
  248    HA   GLN  34           HA       GLN  34  33.495  -5.090   1.516
  249    HB2  GLN  34           HB2      GLN  34  33.879  -5.789  -0.821
  250    HB3  GLN  34           HB3      GLN  34  34.185  -7.426  -0.263
  251    HG2  GLN  34           HG2      GLN  34  31.963  -7.383  -1.049
  252    HG3  GLN  34           HG3      GLN  34  31.875  -7.433   0.710
  253   HE21  GLN  34          HE21      GLN  34  32.861  -4.404  -0.257
  254   HE22  GLN  34          HE22      GLN  34  31.332  -3.599  -0.235
  255    H    THR  35           H        THR  35  35.463  -8.058   1.785
  256    HA   THR  35           HA       THR  35  33.538  -9.321   3.489
  257    HB   THR  35           HB       THR  35  35.415 -11.017   3.773
  258    HG1  THR  35           HG1      THR  35  37.297 -10.585   2.957
  259   HG21  THR  35          HG21      THR  35  34.570 -10.311   0.972
  260   HG22  THR  35          HG22      THR  35  33.739 -11.398   2.085
  261   HG23  THR  35          HG23      THR  35  35.330 -11.826   1.455
  262    H    LYS  36           H        LYS  36  35.923  -7.012   4.030
  263    HA   LYS  36           HA       LYS  36  36.165  -7.753   6.870
  264    HB2  LYS  36           HB2      LYS  36  37.945  -5.927   5.251
  265    HB3  LYS  36           HB3      LYS  36  38.217  -6.465   6.904
  266    HG2  LYS  36           HG2      LYS  36  38.588  -8.710   6.195
  267    HG3  LYS  36           HG3      LYS  36  38.071  -8.332   4.549
  268    HD2  LYS  36           HD2      LYS  36  39.977  -6.839   4.280
  269    HD3  LYS  36           HD3      LYS  36  40.479  -7.172   5.940
  270    HE2  LYS  36           HE2      LYS  36  41.759  -8.479   4.287
  271    HE3  LYS  36           HE3      LYS  36  40.845  -9.503   5.396
  272    HZ1  LYS  36           HZ1      LYS  36  39.535  -8.752   2.895
  273    HZ2  LYS  36           HZ2      LYS  36  39.454 -10.203   3.768
  274    HZ3  LYS  36           HZ3      LYS  36  40.806  -9.876   2.790
  275    H    ASN  37           H        ASN  37  33.864  -6.436   5.884
  276    HA   ASN  37           HA       ASN  37  32.585  -4.564   5.982
  277    HB2  ASN  37           HB2      ASN  37  32.472  -3.515   8.251
  278    HB3  ASN  37           HB3      ASN  37  32.326  -5.264   8.249
  279   HD21  ASN  37          HD21      ASN  37  33.934  -2.598   9.526
  280   HD22  ASN  37          HD22      ASN  37  35.160  -3.442  10.400
  281    H    TYR  38           H        TYR  38  34.860  -4.057   4.557
  282    HA   TYR  38           HA       TYR  38  35.965  -2.371   3.568
  283    HD1  TYR  38           HD1      TYR  38  34.935  -1.749   1.793
  284    HD2  TYR  38           HD2      TYR  38  32.007  -0.433   4.584
  285    HE1  TYR  38           HE1      TYR  38  33.182  -2.091   0.107
  286    HE2  TYR  38           HE2      TYR  38  30.244  -0.773   2.906
  287    HH   TYR  38           HH       TYR  38  30.334  -0.790   0.122
  288    HB2  TYR  38           HB2      TYR  38  34.204  -0.615   5.281
  289    HB3  TYR  38           HB3      TYR  38  35.280  -0.013   4.025
  290    H    ASP  39           H        ASP  39  37.792  -3.272   4.639
  291    HA   ASP  39           HA       ASP  39  38.808  -1.632   6.871
  292    HB2  ASP  39           HB2      ASP  39  38.690  -4.293   6.810
  293    HB3  ASP  39           HB3      ASP  39  40.230  -4.096   5.980
  294    H    ILE  40           H        ILE  40  40.415  -0.244   6.504
  295    HA   ILE  40           HA       ILE  40  41.849  -0.388   3.965
  296    HB   ILE  40           HB       ILE  40  42.949   1.764   4.814
  297   HG12  ILE  40          HG12      ILE  40  41.895   1.298   7.193
  298   HG13  ILE  40          HG13      ILE  40  42.081   2.942   6.601
  299   HG21  ILE  40          HG21      ILE  40  41.503   2.905   3.533
  300   HG22  ILE  40          HG22      ILE  40  40.097   2.362   4.447
  301   HG23  ILE  40          HG23      ILE  40  40.820   1.307   3.233
  302   HD11  ILE  40          HD11      ILE  40  39.870   2.331   7.702
  303   HD12  ILE  40          HD12      ILE  40  39.525   1.416   6.232
  304   HD13  ILE  40          HD13      ILE  40  39.795   3.158   6.144
  305    H    GLY  41           H        GLY  41  42.093  -1.388   7.165
  306    HA2  GLY  41           HA2      GLY  41  44.826  -1.126   7.671
  307    HA3  GLY  41           HA3      GLY  41  43.791  -2.352   8.369
  308    H    ALA  42           H        ALA  42  43.046  -3.623   6.010
  309    HA   ALA  42           HA       ALA  42  45.543  -4.992   5.349
  310    HB1  ALA  42           HB1      ALA  42  42.773  -5.915   4.629
  311    HB2  ALA  42           HB2      ALA  42  43.523  -6.269   6.187
  312    HB3  ALA  42           HB3      ALA  42  44.255  -6.868   4.697
  313    H    ALA  43           H        ALA  43  43.306  -2.805   4.043
  314    HA   ALA  43           HA       ALA  43  43.688  -3.404   1.275
  315    HB1  ALA  43           HB1      ALA  43  43.004  -0.671   2.286
  316    HB2  ALA  43           HB2      ALA  43  41.831  -1.984   2.383
  317    HB3  ALA  43           HB3      ALA  43  42.467  -1.481   0.817
  318    H    LEU  44           H        LEU  44  45.178  -1.162   3.570
  319    HA   LEU  44           HA       LEU  44  46.828   0.190   1.754
  320    HG   LEU  44           HG       LEU  44  47.155   2.338   3.002
  321    HB2  LEU  44           HB2      LEU  44  46.739  -0.131   4.696
  322    HB3  LEU  44           HB3      LEU  44  48.262   0.412   4.011
  323   HD11  LEU  44          HD11      LEU  44  44.745   2.747   3.905
  324   HD12  LEU  44          HD12      LEU  44  44.695   0.987   4.015
  325   HD13  LEU  44          HD13      LEU  44  44.995   1.769   2.460
  326   HD21  LEU  44          HD21      LEU  44  46.129   3.156   5.372
  327   HD22  LEU  44          HD22      LEU  44  47.848   3.142   4.980
  328   HD23  LEU  44          HD23      LEU  44  47.138   1.805   5.886
  329    H    ASP  45           H        ASP  45  47.204  -2.912   3.273
  330    HA   ASP  45           HA       ASP  45  49.958  -3.275   3.104
  331    HB2  ASP  45           HB2      ASP  45  48.499  -4.875   4.219
  332    HB3  ASP  45           HB3      ASP  45  47.753  -5.303   2.682
  333    H    THR  46           H        THR  46  47.499  -3.654   0.578
  334    HA   THR  46           HA       THR  46  49.569  -4.486  -1.293
  335    HB   THR  46           HB       THR  46  47.401  -4.583  -2.806
  336    HG1  THR  46           HG1      THR  46  45.823  -3.851  -1.567
  337   HG21  THR  46          HG21      THR  46  48.634  -6.566  -2.272
  338   HG22  THR  46          HG22      THR  46  46.924  -6.856  -1.949
  339   HG23  THR  46          HG23      THR  46  48.033  -6.544  -0.614
  340    H    ILE  47           H        ILE  47  47.685  -1.638  -0.567
  341    HA   ILE  47           HA       ILE  47  48.255  -0.454  -3.141
  342    HB   ILE  47           HB       ILE  47  47.316   1.674  -2.134
  343   HG12  ILE  47          HG12      ILE  47  46.466  -0.271   0.014
  344   HG13  ILE  47          HG13      ILE  47  47.526   1.122   0.221
  345   HG21  ILE  47          HG21      ILE  47  45.968  -0.777  -2.958
  346   HG22  ILE  47          HG22      ILE  47  45.742   0.884  -3.502
  347   HG23  ILE  47          HG23      ILE  47  44.938   0.320  -2.037
  348   HD11  ILE  47          HD11      ILE  47  45.183   1.453   0.999
  349   HD12  ILE  47          HD12      ILE  47  44.669   1.326  -0.685
  350   HD13  ILE  47          HD13      ILE  47  45.741   2.635  -0.187
  351    H    GLN  48           H        GLN  48  50.551  -1.220  -2.054
  352    HA   GLN  48           HA       GLN  48  52.684  -0.488  -2.151
  353    HB2  GLN  48           HB2      GLN  48  51.597   2.330  -2.058
  354    HB3  GLN  48           HB3      GLN  48  53.225   1.851  -2.517
  355    HG2  GLN  48           HG2      GLN  48  52.579   1.645  -4.629
  356    HG3  GLN  48           HG3      GLN  48  51.386   0.427  -4.162
  357   HE21  GLN  48          HE21      GLN  48  49.421   0.878  -4.786
  358   HE22  GLN  48          HE22      GLN  48  48.707   2.455  -4.923
  359    H    TYR  49           H        TYR  49  51.217  -0.919   0.405
  360    HA   TYR  49           HA       TYR  49  53.371   0.117   2.083
  361    HD1  TYR  49           HD1      TYR  49  53.459   2.565   2.862
  362    HD2  TYR  49           HD2      TYR  49  49.387   2.005   1.773
  363    HE1  TYR  49           HE1      TYR  49  53.383   4.862   1.990
  364    HE2  TYR  49           HE2      TYR  49  49.300   4.296   0.896
  365    HH   TYR  49           HH       TYR  49  51.050   6.608   1.609
  366    HB2  TYR  49           HB2      TYR  49  50.464   0.323   2.915
  367    HB3  TYR  49           HB3      TYR  49  51.857   0.735   3.911
  368    H    SER  50           H        SER  50  53.695  -2.305   1.401
  369    HA   SER  50           HA       SER  50  52.013  -4.169   2.789
  370    HG   SER  50           HG       SER  50  52.201  -6.138   2.184
  371    HB2  SER  50           HB2      SER  50  53.244  -4.495   0.520
  372    HB3  SER  50           HB3      SER  50  54.625  -4.943   1.527
  373    H    LYS  51           H        LYS  51  54.077  -2.215   4.084
  374    HA   LYS  51           HA       LYS  51  54.684  -4.104   6.228
  375    HB2  LYS  51           HB2      LYS  51  56.652  -2.071   5.155
  376    HB3  LYS  51           HB3      LYS  51  56.853  -2.944   6.666
  377    HG2  LYS  51           HG2      LYS  51  56.789  -5.073   5.347
  378    HG3  LYS  51           HG3      LYS  51  56.829  -4.088   3.881
  379    HD2  LYS  51           HD2      LYS  51  58.951  -3.108   4.588
  380    HD3  LYS  51           HD3      LYS  51  58.897  -4.053   6.076
  381    HE2  LYS  51           HE2      LYS  51  58.922  -6.122   4.709
  382    HE3  LYS  51           HE3      LYS  51  59.104  -5.128   3.262
  383    HZ1  LYS  51           HZ1      LYS  51  61.277  -5.606   3.715
  384    HZ2  LYS  51           HZ2      LYS  51  61.042  -5.695   5.395
  385    HZ3  LYS  51           HZ3      LYS  51  61.125  -4.183   4.628
  386    H    HIS  52           H        HIS  52  52.671  -2.090   5.601
  387    HA   HIS  52           HA       HIS  52  51.631  -0.223   6.353
  388    HD1  HIS  52           HD1      HIS  52  53.709  -0.429  10.021
  389    HD2  HIS  52           HD2      HIS  52  51.642  -3.948   9.235
  390    HE1  HIS  52           HE1      HIS  52  54.696  -2.185  11.548
  391    HB2  HIS  52           HB2      HIS  52  51.138  -0.306   8.803
  392    HB3  HIS  52           HB3      HIS  52  50.799  -1.788   7.924
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  20.637   4.466  -0.737
    2    H2   GLY   1           2H       GLY   1  19.101   4.789  -0.098
    3    H3   GLY   1           3H       GLY   1  19.982   3.453   0.450
    4    HA2  GLY   1           HA2      GLY   1  19.944   6.006   1.518
    5    HA3  GLY   1           HA3      GLY   1  20.945   4.646   2.013
    6    H    SER   2           H        SER   2  22.951   5.368   2.261
    7    HA   SER   2           HA       SER   2  24.020   7.553   0.775
    8    HG   SER   2           HG       SER   2  25.408   7.803   3.732
    9    HB2  SER   2           HB2      SER   2  25.394   5.525   2.556
   10    HB3  SER   2           HB3      SER   2  26.143   6.992   1.928
   11    HA   PRO   3           HA       PRO   3  25.490   5.136  -2.674
   12    HB2  PRO   3           HB2      PRO   3  26.871   7.082  -3.930
   13    HB3  PRO   3           HB3      PRO   3  25.105   7.033  -3.932
   14    HG2  PRO   3           HG2      PRO   3  26.954   8.734  -2.325
   15    HG3  PRO   3           HG3      PRO   3  25.380   9.141  -3.031
   16    HD2  PRO   3           HD2      PRO   3  25.810   8.488  -0.372
   17    HD3  PRO   3           HD3      PRO   3  24.247   8.387  -1.203
   18    HA   PRO   4           HA       PRO   4  29.507   3.898  -1.326
   19    HB2  PRO   4           HB2      PRO   4  30.447   2.694  -3.578
   20    HB3  PRO   4           HB3      PRO   4  29.215   1.974  -2.538
   21    HG2  PRO   4           HG2      PRO   4  28.899   3.445  -5.117
   22    HG3  PRO   4           HG3      PRO   4  28.053   1.999  -4.538
   23    HD2  PRO   4           HD2      PRO   4  26.958   4.486  -4.468
   24    HD3  PRO   4           HD3      PRO   4  26.559   3.217  -3.293
   25    H    GLU   5           H        GLU   5  29.177   6.602  -2.719
   26    HA   GLU   5           HA       GLU   5  31.990   6.933  -3.516
   27    HB2  GLU   5           HB2      GLU   5  29.594   8.663  -4.143
   28    HB3  GLU   5           HB3      GLU   5  31.250   9.096  -4.533
   29    HG2  GLU   5           HG2      GLU   5  31.439   7.246  -6.048
   30    HG3  GLU   5           HG3      GLU   5  29.850   6.646  -5.570
   31    H    ALA   6           H        ALA   6  30.009   7.134  -1.034
   32    HA   ALA   6           HA       ALA   6  31.704   8.688   0.609
   33    HB1  ALA   6           HB1      ALA   6  29.045  10.013   0.277
   34    HB2  ALA   6           HB2      ALA   6  30.378  10.423  -0.804
   35    HB3  ALA   6           HB3      ALA   6  30.547  10.661   0.936
   36    H    ASP   7           H        ASP   7  30.545   6.143   0.606
   37    HA   ASP   7           HA       ASP   7  28.301   5.949   2.342
   38    HB2  ASP   7           HB2      ASP   7  30.176   4.132   1.044
   39    HB3  ASP   7           HB3      ASP   7  29.846   3.640   2.700
   40    HA   PRO   8           HA       PRO   8  30.347   6.591   6.302
   41    HB2  PRO   8           HB2      PRO   8  29.111   4.617   7.768
   42    HB3  PRO   8           HB3      PRO   8  28.416   6.212   7.469
   43    HG2  PRO   8           HG2      PRO   8  27.822   3.605   6.158
   44    HG3  PRO   8           HG3      PRO   8  26.732   4.948   6.535
   45    HD2  PRO   8           HD2      PRO   8  27.706   4.434   4.032
   46    HD3  PRO   8           HD3      PRO   8  27.227   6.052   4.582
   47    H    ARG   9           H        ARG   9  30.311   3.798   4.429
   48    HA   ARG   9           HA       ARG   9  32.397   2.407   5.913
   49    HE   ARG   9           HE       ARG   9  29.167  -0.867   6.829
   50    HB2  ARG   9           HB2      ARG   9  30.851   1.697   3.414
   51    HB3  ARG   9           HB3      ARG   9  32.098   0.679   4.139
   52    HG2  ARG   9           HG2      ARG   9  29.529   1.510   5.479
   53    HG3  ARG   9           HG3      ARG   9  29.840  -0.059   4.733
   54    HD2  ARG   9           HD2      ARG   9  31.835  -0.219   6.325
   55    HD3  ARG   9           HD3      ARG   9  31.105   1.138   7.182
   56   HH11  ARG   9          HH11      ARG   9  32.149  -0.315   8.562
   57   HH12  ARG   9          HH12      ARG   9  31.690  -1.299   9.916
   58   HH21  ARG   9          HH21      ARG   9  28.562  -2.171   8.615
   59   HH22  ARG   9          HH22      ARG   9  29.671  -2.366   9.944
   60    H    LEU  10           H        LEU  10  31.827   3.728   2.644
   61    HA   LEU  10           HA       LEU  10  34.572   3.232   1.971
   62    HG   LEU  10           HG       LEU  10  32.088   1.789   0.968
   63    HB2  LEU  10           HB2      LEU  10  32.223   4.168   0.336
   64    HB3  LEU  10           HB3      LEU  10  33.829   3.899  -0.319
   65   HD11  LEU  10          HD11      LEU  10  31.856   0.870  -1.240
   66   HD12  LEU  10          HD12      LEU  10  32.890   2.129  -1.913
   67   HD13  LEU  10          HD13      LEU  10  31.310   2.547  -1.251
   68   HD21  LEU  10          HD21      LEU  10  34.866   1.735  -0.162
   69   HD22  LEU  10          HD22      LEU  10  33.862   0.286  -0.082
   70   HD23  LEU  10          HD23      LEU  10  34.292   1.142   1.399
   71    H    ILE  11           H        ILE  11  32.756   5.955   2.998
   72    HA   ILE  11           HA       ILE  11  34.314   7.966   1.698
   73    HB   ILE  11           HB       ILE  11  32.029   8.140   3.035
   74   HG12  ILE  11          HG12      ILE  11  33.291   9.945   1.757
   75   HG13  ILE  11          HG13      ILE  11  32.221  10.492   3.041
   76   HG21  ILE  11          HG21      ILE  11  33.679   9.294   5.203
   77   HG22  ILE  11          HG22      ILE  11  33.492   7.539   5.170
   78   HG23  ILE  11          HG23      ILE  11  32.069   8.576   5.258
   79   HD11  ILE  11          HD11      ILE  11  35.164  10.627   2.829
   80   HD12  ILE  11          HD12      ILE  11  34.484  10.345   4.432
   81   HD13  ILE  11          HD13      ILE  11  34.016  11.777   3.515
   82    H    GLU  12           H        GLU  12  34.746   5.849   4.351
   83    HA   GLU  12           HA       GLU  12  37.190   7.210   5.232
   84    HB2  GLU  12           HB2      GLU  12  35.805   4.760   6.330
   85    HB3  GLU  12           HB3      GLU  12  37.258   5.485   6.998
   86    HG2  GLU  12           HG2      GLU  12  36.010   7.529   7.489
   87    HG3  GLU  12           HG3      GLU  12  34.548   6.785   6.835
   88    H    SER  13           H        SER  13  36.058   4.153   3.884
   89    HA   SER  13           HA       SER  13  38.733   3.103   3.909
   90    HG   SER  13           HG       SER  13  37.783   0.189   4.474
   91    HB2  SER  13           HB2      SER  13  36.570   1.891   4.599
   92    HB3  SER  13           HB3      SER  13  36.315   1.652   2.872
   93    H    LEU  14           H        LEU  14  36.402   4.019   1.355
   94    HA   LEU  14           HA       LEU  14  38.292   3.045  -0.653
   95    HG   LEU  14           HG       LEU  14  37.394   2.751  -2.900
   96    HB2  LEU  14           HB2      LEU  14  35.800   2.606  -0.813
   97    HB3  LEU  14           HB3      LEU  14  35.588   4.322  -1.094
   98   HD11  LEU  14          HD11      LEU  14  34.488   2.452  -2.623
   99   HD12  LEU  14          HD12      LEU  14  35.676   1.387  -3.374
  100   HD13  LEU  14          HD13      LEU  14  35.052   2.777  -4.262
  101   HD21  LEU  14          HD21      LEU  14  35.664   5.199  -3.187
  102   HD22  LEU  14          HD22      LEU  14  36.467   4.404  -4.542
  103   HD23  LEU  14          HD23      LEU  14  37.425   5.107  -3.239
  104    H    SER  15           H        SER  15  36.688   5.948   0.468
  105    HA   SER  15           HA       SER  15  37.825   7.687  -1.396
  106    HG   SER  15           HG       SER  15  35.257   9.017  -0.725
  107    HB2  SER  15           HB2      SER  15  36.825   8.311   1.384
  108    HB3  SER  15           HB3      SER  15  37.121   9.499   0.112
  109    H    GLN  16           H        GLN  16  39.176   6.117   1.290
  110    HA   GLN  16           HA       GLN  16  41.193   7.912   2.076
  111    HB2  GLN  16           HB2      GLN  16  40.654   5.880   3.342
  112    HB3  GLN  16           HB3      GLN  16  41.209   4.882   2.010
  113    HG2  GLN  16           HG2      GLN  16  43.093   6.814   3.295
  114    HG3  GLN  16           HG3      GLN  16  42.731   5.274   4.075
  115   HE21  GLN  16          HE21      GLN  16  44.977   6.687   2.269
  116   HE22  GLN  16          HE22      GLN  16  45.529   5.344   1.327
  117    H    MET  17           H        MET  17  41.505   5.106  -0.142
  118    HA   MET  17           HA       MET  17  43.970   6.148  -1.163
  119    HB2  MET  17           HB2      MET  17  43.957   4.246  -2.697
  120    HB3  MET  17           HB3      MET  17  43.659   3.740  -1.042
  121    HG2  MET  17           HG2      MET  17  41.420   4.196  -2.981
  122    HG3  MET  17           HG3      MET  17  42.290   2.665  -2.900
  123    HE1  MET  17           HE1      MET  17  42.666   1.382  -0.818
  124    HE2  MET  17           HE2      MET  17  41.453   1.177   0.445
  125    HE3  MET  17           HE3      MET  17  42.661   2.455   0.581
  126    H    LEU  18           H        LEU  18  40.619   6.416  -2.038
  127    HA   LEU  18           HA       LEU  18  40.912   7.051  -4.767
  128    HG   LEU  18           HG       LEU  18  38.766   9.201  -5.088
  129    HB2  LEU  18           HB2      LEU  18  38.756   6.562  -3.611
  130    HB3  LEU  18           HB3      LEU  18  38.850   8.137  -2.846
  131   HD11  LEU  18          HD11      LEU  18  39.667   7.129  -6.260
  132   HD12  LEU  18          HD12      LEU  18  38.346   7.987  -7.054
  133   HD13  LEU  18          HD13      LEU  18  38.023   6.498  -6.165
  134   HD21  LEU  18          HD21      LEU  18  36.740   8.702  -3.647
  135   HD22  LEU  18          HD22      LEU  18  36.437   7.340  -4.725
  136   HD23  LEU  18          HD23      LEU  18  36.440   8.984  -5.362
  137    H    SER  19           H        SER  19  41.276   8.998  -1.864
  138    HA   SER  19           HA       SER  19  41.625  11.428  -3.417
  139    HG   SER  19           HG       SER  19  41.134   9.953  -0.175
  140    HB2  SER  19           HB2      SER  19  41.981  12.491  -1.156
  141    HB3  SER  19           HB3      SER  19  40.407  11.727  -1.378
  142    H    MET  20           H        MET  20  43.590   9.277  -1.378
  143    HA   MET  20           HA       MET  20  45.924  10.853  -1.463
  144    HB2  MET  20           HB2      MET  20  45.535   7.906  -0.959
  145    HB3  MET  20           HB3      MET  20  47.094   8.709  -0.819
  146    HG2  MET  20           HG2      MET  20  44.622   9.363   0.772
  147    HG3  MET  20           HG3      MET  20  46.018   8.451   1.347
  148    HE1  MET  20           HE1      MET  20  48.298   9.474   0.337
  149    HE2  MET  20           HE2      MET  20  48.695  10.207   1.891
  150    HE3  MET  20           HE3      MET  20  48.712  11.186   0.422
  151    H    GLY  21           H        GLY  21  44.702   8.399  -3.672
  152    HA2  GLY  21           HA2      GLY  21  45.385   8.589  -5.996
  153    HA3  GLY  21           HA3      GLY  21  46.992   9.031  -5.422
  154    H    PHE  22           H        PHE  22  44.808   6.407  -4.459
  155    HA   PHE  22           HA       PHE  22  46.735   4.493  -5.549
  156    HD1  PHE  22           HD1      PHE  22  46.735   6.264  -1.985
  157    HD2  PHE  22           HD2      PHE  22  48.619   2.877  -3.729
  158    HE1  PHE  22           HE1      PHE  22  48.895   6.975  -1.035
  159    HE2  PHE  22           HE2      PHE  22  50.772   3.581  -2.790
  160    HZ   PHE  22           HZ       PHE  22  50.914   5.616  -1.437
  161    HB2  PHE  22           HB2      PHE  22  45.444   4.355  -2.812
  162    HB3  PHE  22           HB3      PHE  22  46.248   2.993  -3.585
  163    H    SER  23           H        SER  23  45.584   2.252  -5.567
  164    HA   SER  23           HA       SER  23  42.722   2.421  -5.799
  165    HG   SER  23           HG       SER  23  44.252   3.901  -8.454
  166    HB2  SER  23           HB2      SER  23  44.413   1.805  -8.243
  167    HB3  SER  23           HB3      SER  23  42.657   1.667  -8.155
  168    H    ASP  24           H        ASP  24  42.130   0.110  -7.046
  169    HA   ASP  24           HA       ASP  24  43.409  -1.910  -5.390
  170    HB2  ASP  24           HB2      ASP  24  41.742  -3.472  -6.415
  171    HB3  ASP  24           HB3      ASP  24  41.032  -2.138  -5.518
  172    H    GLU  25           H        GLU  25  44.334  -3.804  -6.275
  173    HA   GLU  25           HA       GLU  25  46.062  -3.140  -8.468
  174    HB2  GLU  25           HB2      GLU  25  47.374  -4.960  -7.800
  175    HB3  GLU  25           HB3      GLU  25  46.668  -4.373  -6.300
  176    HG2  GLU  25           HG2      GLU  25  44.913  -6.147  -6.539
  177    HG3  GLU  25           HG3      GLU  25  45.855  -6.793  -7.880
  178    H    GLY  26           H        GLY  26  43.055  -4.540  -8.307
  179    HA2  GLY  26           HA2      GLY  26  43.097  -5.310 -11.052
  180    HA3  GLY  26           HA3      GLY  26  43.108  -6.721  -9.998
  181    H    GLY  27           H        GLY  27  41.477  -5.301  -7.948
  182    HA2  GLY  27           HA2      GLY  27  39.143  -4.225  -8.555
  183    HA3  GLY  27           HA3      GLY  27  38.912  -5.825  -9.246
  184    H    TRP  28           H        TRP  28  40.739  -5.253  -6.316
  185    HA   TRP  28           HA       TRP  28  38.768  -6.839  -4.880
  186    HD1  TRP  28           HD1      TRP  28  43.175  -6.884  -5.699
  187    HE1  TRP  28           HE1      TRP  28  44.884  -5.046  -5.154
  188    HE3  TRP  28           HE3      TRP  28  40.617  -4.443  -2.015
  189    HZ2  TRP  28           HZ2      TRP  28  45.102  -2.823  -3.428
  190    HZ3  TRP  28           HZ3      TRP  28  41.639  -2.473  -0.974
  191    HH2  TRP  28           HH2      TRP  28  43.832  -1.687  -1.662
  192    HB2  TRP  28           HB2      TRP  28  40.528  -6.969  -3.091
  193    HB3  TRP  28           HB3      TRP  28  40.984  -7.702  -4.629
  194    H    LEU  29           H        LEU  29  39.688  -3.567  -5.235
  195    HA   LEU  29           HA       LEU  29  39.466  -2.644  -2.629
  196    HG   LEU  29           HG       LEU  29  37.632  -0.064  -3.501
  197    HB2  LEU  29           HB2      LEU  29  40.350  -1.161  -4.205
  198    HB3  LEU  29           HB3      LEU  29  38.959  -1.283  -5.256
  199   HD11  LEU  29          HD11      LEU  29  39.047   1.261  -1.886
  200   HD12  LEU  29          HD12      LEU  29  40.363   0.150  -2.261
  201   HD13  LEU  29          HD13      LEU  29  38.877  -0.457  -1.530
  202   HD21  LEU  29          HD21      LEU  29  39.737   1.854  -4.044
  203   HD22  LEU  29          HD22      LEU  29  38.074   1.805  -4.626
  204   HD23  LEU  29          HD23      LEU  29  39.327   0.889  -5.463
  205    H    THR  30           H        THR  30  36.992  -3.951  -4.526
  206    HA   THR  30           HA       THR  30  34.935  -2.834  -2.761
  207    HB   THR  30           HB       THR  30  33.316  -4.007  -4.211
  208    HG1  THR  30           HG1      THR  30  34.083  -5.600  -5.319
  209   HG21  THR  30          HG21      THR  30  34.169  -2.824  -6.463
  210   HG22  THR  30          HG22      THR  30  35.152  -1.968  -5.274
  211   HG23  THR  30          HG23      THR  30  33.394  -1.961  -5.135
  212    H    ARG  31           H        ARG  31  36.031  -6.009  -3.977
  213    HA   ARG  31           HA       ARG  31  34.581  -7.488  -2.076
  214    HE   ARG  31           HE       ARG  31  39.597  -9.755  -4.842
  215    HB2  ARG  31           HB2      ARG  31  36.194  -9.367  -2.845
  216    HB3  ARG  31           HB3      ARG  31  35.018  -8.698  -3.963
  217    HG2  ARG  31           HG2      ARG  31  36.640  -7.482  -5.121
  218    HG3  ARG  31           HG3      ARG  31  37.834  -7.698  -3.838
  219    HD2  ARG  31           HD2      ARG  31  36.745 -10.164  -5.043
  220    HD3  ARG  31           HD3      ARG  31  37.761  -9.171  -6.085
  221   HH11  ARG  31          HH11      ARG  31  36.712 -10.844  -3.155
  222   HH12  ARG  31          HH12      ARG  31  37.606 -11.607  -1.875
  223   HH21  ARG  31          HH21      ARG  31  40.756 -10.753  -3.155
  224   HH22  ARG  31          HH22      ARG  31  39.893 -11.585  -1.893
  225    H    LEU  32           H        LEU  32  38.106  -6.858  -2.217
  226    HA   LEU  32           HA       LEU  32  38.906  -8.305  -0.001
  227    HG   LEU  32           HG       LEU  32  42.223  -6.588  -0.262
  228    HB2  LEU  32           HB2      LEU  32  40.402  -7.129  -1.613
  229    HB3  LEU  32           HB3      LEU  32  39.955  -5.604  -0.879
  230   HD11  LEU  32          HD11      LEU  32  40.368  -5.123   1.268
  231   HD12  LEU  32          HD12      LEU  32  42.126  -5.151   1.414
  232   HD13  LEU  32          HD13      LEU  32  41.144  -6.271   2.357
  233   HD21  LEU  32          HD21      LEU  32  41.663  -8.871   0.073
  234   HD22  LEU  32          HD22      LEU  32  40.440  -8.456   1.275
  235   HD23  LEU  32          HD23      LEU  32  42.151  -8.203   1.631
  236    H    LEU  33           H        LEU  33  37.969  -4.877  -0.092
  237    HA   LEU  33           HA       LEU  33  38.017  -4.386   2.651
  238    HG   LEU  33           HG       LEU  33  38.516  -1.981   2.258
  239    HB2  LEU  33           HB2      LEU  33  36.472  -3.183   0.379
  240    HB3  LEU  33           HB3      LEU  33  36.151  -2.681   2.029
  241   HD11  LEU  33          HD11      LEU  33  39.554  -3.453   0.643
  242   HD12  LEU  33          HD12      LEU  33  39.894  -1.769   0.244
  243   HD13  LEU  33          HD13      LEU  33  38.679  -2.664  -0.670
  244   HD21  LEU  33          HD21      LEU  33  37.862  -0.466  -0.109
  245   HD22  LEU  33          HD22      LEU  33  37.895   0.037   1.582
  246   HD23  LEU  33          HD23      LEU  33  36.448  -0.718   0.913
  247    H    GLN  34           H        GLN  34  35.162  -5.123   0.648
  248    HA   GLN  34           HA       GLN  34  33.164  -5.320   2.439
  249    HB2  GLN  34           HB2      GLN  34  32.981  -5.772   0.006
  250    HB3  GLN  34           HB3      GLN  34  33.693  -7.356   0.268
  251    HG2  GLN  34           HG2      GLN  34  31.431  -7.809   0.145
  252    HG3  GLN  34           HG3      GLN  34  31.734  -7.751   1.880
  253   HE21  GLN  34          HE21      GLN  34  31.916  -4.644   0.819
  254   HE22  GLN  34          HE22      GLN  34  30.284  -4.154   1.059
  255    H    THR  35           H        THR  35  35.434  -7.963   1.758
  256    HA   THR  35           HA       THR  35  34.256  -9.874   3.364
  257    HB   THR  35           HB       THR  35  37.224  -9.677   2.856
  258    HG1  THR  35           HG1      THR  35  36.295  -9.397   0.875
  259   HG21  THR  35          HG21      THR  35  35.862 -11.624   4.183
  260   HG22  THR  35          HG22      THR  35  37.385 -11.855   3.322
  261   HG23  THR  35          HG23      THR  35  35.858 -12.239   2.530
  262    H    LYS  36           H        LYS  36  36.986  -7.732   4.242
  263    HA   LYS  36           HA       LYS  36  36.662  -8.600   7.012
  264    HB2  LYS  36           HB2      LYS  36  38.736  -6.965   7.244
  265    HB3  LYS  36           HB3      LYS  36  38.914  -8.630   6.714
  266    HG2  LYS  36           HG2      LYS  36  38.503  -6.532   4.647
  267    HG3  LYS  36           HG3      LYS  36  40.073  -6.626   5.450
  268    HD2  LYS  36           HD2      LYS  36  38.706  -8.954   4.096
  269    HD3  LYS  36           HD3      LYS  36  39.929  -7.938   3.335
  270    HE2  LYS  36           HE2      LYS  36  41.521  -8.573   5.112
  271    HE3  LYS  36           HE3      LYS  36  40.296  -9.635   5.804
  272    HZ1  LYS  36           HZ1      LYS  36  41.041 -11.216   4.466
  273    HZ2  LYS  36           HZ2      LYS  36  42.084 -10.138   3.664
  274    HZ3  LYS  36           HZ3      LYS  36  40.481 -10.325   3.131
  275    H    ASN  37           H        ASN  37  34.594  -7.024   5.949
  276    HA   ASN  37           HA       ASN  37  33.239  -5.306   6.544
  277    HB2  ASN  37           HB2      ASN  37  33.619  -6.153   8.798
  278    HB3  ASN  37           HB3      ASN  37  35.099  -5.205   8.932
  279   HD21  ASN  37          HD21      ASN  37  34.936  -3.394   9.974
  280   HD22  ASN  37          HD22      ASN  37  33.512  -2.449  10.189
  281    H    TYR  38           H        TYR  38  34.573  -4.427   4.590
  282    HA   TYR  38           HA       TYR  38  35.658  -2.708   3.529
  283    HD1  TYR  38           HD1      TYR  38  34.218  -1.120   1.907
  284    HD2  TYR  38           HD2      TYR  38  31.883  -2.133   5.315
  285    HE1  TYR  38           HE1      TYR  38  32.264  -1.466   0.458
  286    HE2  TYR  38           HE2      TYR  38  29.918  -2.471   3.874
  287    HH   TYR  38           HH       TYR  38  29.662  -1.324   0.829
  288    HB2  TYR  38           HB2      TYR  38  34.036  -1.259   5.620
  289    HB3  TYR  38           HB3      TYR  38  34.862  -0.441   4.299
  290    H    ASP  39           H        ASP  39  37.508  -3.847   5.016
  291    HA   ASP  39           HA       ASP  39  38.603  -2.111   7.006
  292    HB2  ASP  39           HB2      ASP  39  38.731  -4.647   6.991
  293    HB3  ASP  39           HB3      ASP  39  39.974  -4.486   5.753
  294    H    ILE  40           H        ILE  40  40.124  -0.647   6.834
  295    HA   ILE  40           HA       ILE  40  41.521  -0.317   4.280
  296    HB   ILE  40           HB       ILE  40  42.585   1.646   5.773
  297   HG12  ILE  40          HG12      ILE  40  40.843   0.848   7.609
  298   HG13  ILE  40          HG13      ILE  40  41.218   2.553   7.387
  299   HG21  ILE  40          HG21      ILE  40  40.703   3.098   4.769
  300   HG22  ILE  40          HG22      ILE  40  40.140   1.586   4.058
  301   HG23  ILE  40          HG23      ILE  40  41.757   2.187   3.688
  302   HD11  ILE  40          HD11      ILE  40  38.837   2.245   7.631
  303   HD12  ILE  40          HD12      ILE  40  38.822   1.094   6.295
  304   HD13  ILE  40          HD13      ILE  40  39.205   2.790   5.992
  305    H    GLY  41           H        GLY  41  41.842  -1.804   7.274
  306    HA2  GLY  41           HA2      GLY  41  44.619  -1.485   7.683
  307    HA3  GLY  41           HA3      GLY  41  43.624  -2.739   8.388
  308    H    ALA  42           H        ALA  42  42.698  -3.887   6.057
  309    HA   ALA  42           HA       ALA  42  45.086  -5.301   5.169
  310    HB1  ALA  42           HB1      ALA  42  42.482  -6.176   4.129
  311    HB2  ALA  42           HB2      ALA  42  42.653  -6.250   5.885
  312    HB3  ALA  42           HB3      ALA  42  43.792  -7.114   4.851
  313    H    ALA  43           H        ALA  43  42.893  -2.933   4.092
  314    HA   ALA  43           HA       ALA  43  43.189  -3.342   1.278
  315    HB1  ALA  43           HB1      ALA  43  41.742  -1.641   1.044
  316    HB2  ALA  43           HB2      ALA  43  42.618  -0.605   2.171
  317    HB3  ALA  43           HB3      ALA  43  41.505  -1.832   2.782
  318    H    LEU  44           H        LEU  44  44.816  -1.349   3.696
  319    HA   LEU  44           HA       LEU  44  46.433   0.097   1.885
  320    HG   LEU  44           HG       LEU  44  46.952   2.185   3.306
  321    HB2  LEU  44           HB2      LEU  44  46.420  -0.378   4.815
  322    HB3  LEU  44           HB3      LEU  44  47.939   0.150   4.103
  323   HD11  LEU  44          HD11      LEU  44  44.351   0.923   4.122
  324   HD12  LEU  44          HD12      LEU  44  44.816   1.597   2.555
  325   HD13  LEU  44          HD13      LEU  44  44.527   2.669   3.927
  326   HD21  LEU  44          HD21      LEU  44  47.202   1.533   5.992
  327   HD22  LEU  44          HD22      LEU  44  45.648   2.361   5.881
  328   HD23  LEU  44          HD23      LEU  44  47.113   3.153   5.301
  329    H    ASP  45           H        ASP  45  46.838  -2.973   3.526
  330    HA   ASP  45           HA       ASP  45  49.517  -3.506   2.965
  331    HB2  ASP  45           HB2      ASP  45  48.249  -4.943   4.426
  332    HB3  ASP  45           HB3      ASP  45  47.130  -5.349   3.130
  333    H    THR  46           H        THR  46  46.661  -3.761   0.906
  334    HA   THR  46           HA       THR  46  48.292  -4.899  -1.213
  335    HB   THR  46           HB       THR  46  45.986  -4.988  -2.381
  336    HG1  THR  46           HG1      THR  46  44.595  -3.898  -1.206
  337   HG21  THR  46          HG21      THR  46  47.177  -6.700  -0.400
  338   HG22  THR  46          HG22      THR  46  46.276  -7.116  -1.858
  339   HG23  THR  46          HG23      THR  46  45.416  -6.797  -0.352
  340    H    ILE  47           H        ILE  47  46.936  -1.789  -0.378
  341    HA   ILE  47           HA       ILE  47  47.187  -0.823  -3.111
  342    HB   ILE  47           HB       ILE  47  46.732   1.455  -2.192
  343   HG12  ILE  47          HG12      ILE  47  46.048  -0.013   0.352
  344   HG13  ILE  47          HG13      ILE  47  47.495   0.971   0.123
  345   HG21  ILE  47          HG21      ILE  47  44.976  -0.611  -2.759
  346   HG22  ILE  47          HG22      ILE  47  44.595   1.107  -2.673
  347   HG23  ILE  47          HG23      ILE  47  44.366   0.085  -1.257
  348   HD11  ILE  47          HD11      ILE  47  44.721   2.046  -0.240
  349   HD12  ILE  47          HD12      ILE  47  46.230   2.946  -0.091
  350   HD13  ILE  47          HD13      ILE  47  45.577   2.081   1.301
  351    H    GLN  48           H        GLN  48  49.535  -1.870  -2.254
  352    HA   GLN  48           HA       GLN  48  51.743  -1.482  -2.495
  353    HB2  GLN  48           HB2      GLN  48  51.051   1.428  -2.919
  354    HB3  GLN  48           HB3      GLN  48  52.519   0.601  -3.421
  355    HG2  GLN  48           HG2      GLN  48  51.588   0.095  -5.370
  356    HG3  GLN  48           HG3      GLN  48  50.287  -0.765  -4.546
  357   HE21  GLN  48          HE21      GLN  48  48.301   0.036  -4.670
  358   HE22  GLN  48          HE22      GLN  48  47.874   1.623  -5.228
  359    H    TYR  49           H        TYR  49  50.261  -1.038   0.108
  360    HA   TYR  49           HA       TYR  49  52.540   0.207   1.502
  361    HD1  TYR  49           HD2      TYR  49  52.420   1.925   0.707
  362    HD2  TYR  49           HD1      TYR  49  49.117   2.716   3.264
  363    HE1  TYR  49           HE2      TYR  49  52.618   4.326   0.216
  364    HE2  TYR  49           HE1      TYR  49  49.305   5.114   2.783
  365    HH   TYR  49           HH       TYR  49  51.949   6.403   0.837
  366    HB2  TYR  49           HB2      TYR  49  49.604   0.389   2.143
  367    HB3  TYR  49           HB3      TYR  49  50.813   0.561   3.411
  368    H    SER  50           H        SER  50  52.889  -2.324   0.919
  369    HA   SER  50           HA       SER  50  51.681  -4.063   2.874
  370    HG   SER  50           HG       SER  50  51.792  -6.252   2.137
  371    HB2  SER  50           HB2      SER  50  52.294  -4.713   0.478
  372    HB3  SER  50           HB3      SER  50  53.966  -4.777   1.038
  373    H    LYS  51           H        LYS  51  53.888  -1.830   3.161
  374    HA   LYS  51           HA       LYS  51  54.848  -2.884   5.626
  375    HB2  LYS  51           HB2      LYS  51  56.554  -3.758   3.976
  376    HB3  LYS  51           HB3      LYS  51  56.954  -2.089   3.594
  377    HG2  LYS  51           HG2      LYS  51  57.102  -3.069   6.420
  378    HG3  LYS  51           HG3      LYS  51  58.413  -3.393   5.284
  379    HD2  LYS  51           HD2      LYS  51  58.864  -1.097   4.989
  380    HD3  LYS  51           HD3      LYS  51  57.333  -0.620   5.722
  381    HE2  LYS  51           HE2      LYS  51  59.185  -0.200   7.237
  382    HE3  LYS  51           HE3      LYS  51  58.111  -1.435   7.889
  383    HZ1  LYS  51           HZ1      LYS  51  60.239  -2.550   6.322
  384    HZ2  LYS  51           HZ2      LYS  51  59.746  -2.921   7.908
  385    HZ3  LYS  51           HZ3      LYS  51  60.812  -1.629   7.628
  386    H    HIS  52           H        HIS  52  54.888  -1.240   7.036
  387    HA   HIS  52           HA       HIS  52  55.109   1.491   5.953
  388    HD1  HIS  52           HD1      HIS  52  51.177   2.618   8.148
  389    HD2  HIS  52           HD2      HIS  52  54.936   3.699   6.719
  390    HE1  HIS  52           HE1      HIS  52  51.224   5.148   8.106
  391    HB2  HIS  52           HB2      HIS  52  52.743   0.753   6.580
  392    HB3  HIS  52           HB3      HIS  52  53.301   0.731   8.249
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1  22.533   1.062   5.087
    2    H2   GLY   1           2H       GLY   1  23.885   0.640   4.153
    3    H3   GLY   1           3H       GLY   1  22.988  -0.564   4.938
    4    HA2  GLY   1           HA2      GLY   1  21.342  -0.567   3.412
    5    HA3  GLY   1           HA3      GLY   1  21.537   1.151   3.087
    6    H    SER   2           H        SER   2  22.133   1.499   1.055
    7    HA   SER   2           HA       SER   2  23.951  -0.445  -0.207
    8    HG   SER   2           HG       SER   2  22.635  -0.349  -3.223
    9    HB2  SER   2           HB2      SER   2  21.746  -0.260  -1.307
   10    HB3  SER   2           HB3      SER   2  22.012   1.470  -1.534
   11    HA   PRO   3           HA       PRO   3  26.753   3.071   0.200
   12    HB2  PRO   3           HB2      PRO   3  28.995   1.692  -0.487
   13    HB3  PRO   3           HB3      PRO   3  28.281   1.622   1.127
   14    HG2  PRO   3           HG2      PRO   3  28.029  -0.317  -1.143
   15    HG3  PRO   3           HG3      PRO   3  28.274  -0.640   0.586
   16    HD2  PRO   3           HD2      PRO   3  25.848  -0.852  -0.588
   17    HD3  PRO   3           HD3      PRO   3  26.054  -0.320   1.092
   18    HA   PRO   4           HA       PRO   4  26.841   3.751  -4.254
   19    HB2  PRO   4           HB2      PRO   4  26.552   6.416  -4.187
   20    HB3  PRO   4           HB3      PRO   4  25.201   5.329  -3.850
   21    HG2  PRO   4           HG2      PRO   4  26.823   6.968  -1.984
   22    HG3  PRO   4           HG3      PRO   4  25.132   6.458  -1.854
   23    HD2  PRO   4           HD2      PRO   4  27.380   5.278  -0.582
   24    HD3  PRO   4           HD3      PRO   4  25.718   4.658  -0.609
   25    H    GLU   5           H        GLU   5  29.243   3.578  -2.470
   26    HA   GLU   5           HA       GLU   5  31.468   3.984  -2.500
   27    HB2  GLU   5           HB2      GLU   5  31.115   3.707  -5.031
   28    HB3  GLU   5           HB3      GLU   5  31.156   5.463  -5.108
   29    HG2  GLU   5           HG2      GLU   5  33.398   5.493  -4.217
   30    HG3  GLU   5           HG3      GLU   5  33.362   3.744  -3.993
   31    H    ALA   6           H        ALA   6  29.240   5.951  -1.832
   32    HA   ALA   6           HA       ALA   6  31.060   8.038  -0.915
   33    HB1  ALA   6           HB1      ALA   6  28.342   8.920  -1.769
   34    HB2  ALA   6           HB2      ALA   6  29.596   8.739  -2.997
   35    HB3  ALA   6           HB3      ALA   6  29.840   9.842  -1.643
   36    H    ASP   7           H        ASP   7  29.902   5.669   0.077
   37    HA   ASP   7           HA       ASP   7  27.786   6.293   1.939
   38    HB2  ASP   7           HB2      ASP   7  28.254   4.036   0.801
   39    HB3  ASP   7           HB3      ASP   7  29.638   3.890   1.870
   40    HA   PRO   8           HA       PRO   8  30.335   7.818   5.317
   41    HB2  PRO   8           HB2      PRO   8  29.211   5.593   6.959
   42    HB3  PRO   8           HB3      PRO   8  29.313   7.320   7.324
   43    HG2  PRO   8           HG2      PRO   8  26.998   6.219   6.595
   44    HG3  PRO   8           HG3      PRO   8  27.454   7.838   6.033
   45    HD2  PRO   8           HD2      PRO   8  27.448   5.246   4.558
   46    HD3  PRO   8           HD3      PRO   8  27.110   6.885   3.962
   47    H    ARG   9           H        ARG   9  30.325   4.474   4.401
   48    HA   ARG   9           HA       ARG   9  32.810   3.822   5.764
   49    HE   ARG   9           HE       ARG   9  30.478   0.435   8.032
   50    HB2  ARG   9           HB2      ARG   9  31.015   2.285   3.888
   51    HB3  ARG   9           HB3      ARG   9  32.510   1.634   4.554
   52    HG2  ARG   9           HG2      ARG   9  30.138   2.550   6.166
   53    HG3  ARG   9           HG3      ARG   9  30.526   0.873   5.766
   54    HD2  ARG   9           HD2      ARG   9  32.789   1.332   6.871
   55    HD3  ARG   9           HD3      ARG   9  32.030   2.782   7.533
   56   HH11  ARG   9          HH11      ARG   9  33.270   2.244   9.057
   57   HH12  ARG   9          HH12      ARG   9  33.220   1.662  10.697
   58   HH21  ARG   9          HH21      ARG   9  30.388  -0.345  10.184
   59   HH22  ARG   9          HH22      ARG   9  31.563   0.194  11.344
   60    H    LEU  10           H        LEU  10  31.757   4.827   2.594
   61    HA   LEU  10           HA       LEU  10  34.287   4.062   1.396
   62    HG   LEU  10           HG       LEU  10  31.836   2.920  -1.138
   63    HB2  LEU  10           HB2      LEU  10  31.626   4.889   0.291
   64    HB3  LEU  10           HB3      LEU  10  33.060   4.979  -0.712
   65   HD11  LEU  10          HD11      LEU  10  34.248   2.866  -1.379
   66   HD12  LEU  10          HD12      LEU  10  33.641   1.313  -0.807
   67   HD13  LEU  10          HD13      LEU  10  34.424   2.423   0.320
   68   HD21  LEU  10          HD21      LEU  10  31.457   2.881   1.648
   69   HD22  LEU  10          HD22      LEU  10  32.415   1.455   1.245
   70   HD23  LEU  10          HD23      LEU  10  30.861   1.729   0.452
   71    H    ILE  11           H        ILE  11  32.424   6.923   2.263
   72    HA   ILE  11           HA       ILE  11  34.308   8.766   1.091
   73    HB   ILE  11           HB       ILE  11  33.309  10.462   2.608
   74   HG12  ILE  11          HG12      ILE  11  31.555   8.156   3.484
   75   HG13  ILE  11          HG13      ILE  11  32.699   9.044   4.488
   76   HG21  ILE  11          HG21      ILE  11  31.346  10.728   1.378
   77   HG22  ILE  11          HG22      ILE  11  31.111   8.990   1.202
   78   HG23  ILE  11          HG23      ILE  11  32.406   9.798   0.316
   79   HD11  ILE  11          HD11      ILE  11  30.915  10.919   3.340
   80   HD12  ILE  11          HD12      ILE  11  31.101  10.465   5.035
   81   HD13  ILE  11          HD13      ILE  11  29.964   9.591   4.006
   82    H    GLU  12           H        GLU  12  34.311   6.607   3.628
   83    HA   GLU  12           HA       GLU  12  36.442   8.032   5.072
   84    HB2  GLU  12           HB2      GLU  12  34.621   6.980   6.409
   85    HB3  GLU  12           HB3      GLU  12  35.114   5.411   5.787
   86    HG2  GLU  12           HG2      GLU  12  37.321   5.711   6.813
   87    HG3  GLU  12           HG3      GLU  12  36.792   7.259   7.471
   88    H    SER  13           H        SER  13  35.871   4.669   4.070
   89    HA   SER  13           HA       SER  13  38.673   4.142   4.101
   90    HG   SER  13           HG       SER  13  38.650   1.301   4.411
   91    HB2  SER  13           HB2      SER  13  37.015   2.537   4.933
   92    HB3  SER  13           HB3      SER  13  36.350   2.369   3.310
   93    H    LEU  14           H        LEU  14  36.445   4.919   1.515
   94    HA   LEU  14           HA       LEU  14  38.338   3.904  -0.464
   95    HG   LEU  14           HG       LEU  14  35.740   3.895  -3.056
   96    HB2  LEU  14           HB2      LEU  14  35.905   3.527  -0.801
   97    HB3  LEU  14           HB3      LEU  14  35.658   5.259  -0.842
   98   HD11  LEU  14          HD11      LEU  14  35.521   6.281  -3.029
   99   HD12  LEU  14          HD12      LEU  14  36.731   5.829  -4.231
  100   HD13  LEU  14          HD13      LEU  14  37.238   6.475  -2.669
  101   HD21  LEU  14          HD21      LEU  14  37.843   3.540  -4.037
  102   HD22  LEU  14          HD22      LEU  14  37.958   2.864  -2.412
  103   HD23  LEU  14          HD23      LEU  14  38.676   4.436  -2.767
  104    H    SER  15           H        SER  15  36.864   6.871   0.734
  105    HA   SER  15           HA       SER  15  38.207   8.585  -1.026
  106    HG   SER  15           HG       SER  15  37.052  11.310   0.247
  107    HB2  SER  15           HB2      SER  15  36.285   9.354   0.257
  108    HB3  SER  15           HB3      SER  15  37.199   9.182   1.756
  109    H    GLN  16           H        GLN  16  39.282   6.926   1.800
  110    HA   GLN  16           HA       GLN  16  41.464   8.475   2.595
  111    HB2  GLN  16           HB2      GLN  16  40.618   6.483   3.815
  112    HB3  GLN  16           HB3      GLN  16  41.255   5.452   2.544
  113    HG2  GLN  16           HG2      GLN  16  43.110   7.302   3.960
  114    HG3  GLN  16           HG3      GLN  16  42.568   5.839   4.778
  115   HE21  GLN  16          HE21      GLN  16  42.421   4.700   1.877
  116   HE22  GLN  16          HE22      GLN  16  44.048   4.196   1.583
  117    H    MET  17           H        MET  17  41.203   6.024   0.050
  118    HA   MET  17           HA       MET  17  43.952   6.578  -0.761
  119    HB2  MET  17           HB2      MET  17  43.406   4.664  -2.427
  120    HB3  MET  17           HB3      MET  17  43.662   4.284  -0.730
  121    HG2  MET  17           HG2      MET  17  41.259   4.173  -0.377
  122    HG3  MET  17           HG3      MET  17  40.981   4.613  -2.063
  123    HE1  MET  17           HE1      MET  17  43.201   2.883  -3.647
  124    HE2  MET  17           HE2      MET  17  41.514   3.179  -4.072
  125    HE3  MET  17           HE3      MET  17  42.137   1.529  -4.034
  126    H    LEU  18           H        LEU  18  40.675   7.111  -1.783
  127    HA   LEU  18           HA       LEU  18  41.156   7.692  -4.503
  128    HG   LEU  18           HG       LEU  18  39.149   9.897  -4.974
  129    HB2  LEU  18           HB2      LEU  18  38.918   7.283  -3.481
  130    HB3  LEU  18           HB3      LEU  18  39.026   8.852  -2.706
  131   HD11  LEU  18          HD11      LEU  18  38.683   7.053  -5.813
  132   HD12  LEU  18          HD12      LEU  18  39.933   8.172  -6.358
  133   HD13  LEU  18          HD13      LEU  18  38.253   8.425  -6.833
  134   HD21  LEU  18          HD21      LEU  18  36.646   8.825  -5.441
  135   HD22  LEU  18          HD22      LEU  18  37.020  10.226  -4.436
  136   HD23  LEU  18          HD23      LEU  18  36.877   8.627  -3.704
  137    H    SER  19           H        SER  19  41.202   9.696  -1.597
  138    HA   SER  19           HA       SER  19  41.786  12.069  -3.159
  139    HG   SER  19           HG       SER  19  39.482  11.556  -0.589
  140    HB2  SER  19           HB2      SER  19  41.530  11.762  -0.158
  141    HB3  SER  19           HB3      SER  19  41.539  13.276  -1.064
  142    H    MET  20           H        MET  20  43.633   9.589  -1.921
  143    HA   MET  20           HA       MET  20  45.888  11.359  -1.284
  144    HB2  MET  20           HB2      MET  20  45.329   9.632   0.387
  145    HB3  MET  20           HB3      MET  20  45.609   8.384  -0.818
  146    HG2  MET  20           HG2      MET  20  47.510   8.578   0.658
  147    HG3  MET  20           HG3      MET  20  47.951   9.063  -0.979
  148    HE1  MET  20           HE1      MET  20  50.272  10.864  -0.092
  149    HE2  MET  20           HE2      MET  20  49.834   9.470   0.893
  150    HE3  MET  20           HE3      MET  20  50.067  11.045   1.650
  151    H    GLY  21           H        GLY  21  44.874   8.835  -3.515
  152    HA2  GLY  21           HA2      GLY  21  45.792   9.009  -5.781
  153    HA3  GLY  21           HA3      GLY  21  47.349   9.368  -5.039
  154    H    PHE  22           H        PHE  22  44.946   6.852  -4.328
  155    HA   PHE  22           HA       PHE  22  46.928   4.845  -5.130
  156    HD1  PHE  22           HD1      PHE  22  48.631   4.145  -3.772
  157    HD2  PHE  22           HD2      PHE  22  45.982   5.741  -0.856
  158    HE1  PHE  22           HE1      PHE  22  50.556   4.862  -2.430
  159    HE2  PHE  22           HE2      PHE  22  47.907   6.464   0.498
  160    HZ   PHE  22           HZ       PHE  22  50.196   6.015  -0.293
  161    HB2  PHE  22           HB2      PHE  22  45.107   4.743  -2.711
  162    HB3  PHE  22           HB3      PHE  22  46.044   3.375  -3.310
  163    H    SER  23           H        SER  23  45.846   2.741  -5.650
  164    HA   SER  23           HA       SER  23  43.057   3.053  -6.391
  165    HG   SER  23           HG       SER  23  44.603   4.273  -9.410
  166    HB2  SER  23           HB2      SER  23  45.194   2.320  -8.421
  167    HB3  SER  23           HB3      SER  23  43.455   2.350  -8.721
  168    H    ASP  24           H        ASP  24  42.269   0.875  -7.400
  169    HA   ASP  24           HA       ASP  24  43.012  -1.206  -5.597
  170    HB2  ASP  24           HB2      ASP  24  41.499  -2.640  -7.034
  171    HB3  ASP  24           HB3      ASP  24  40.745  -1.234  -6.287
  172    H    GLU  25           H        GLU  25  44.369  -2.864  -5.844
  173    HA   GLU  25           HA       GLU  25  46.098  -2.842  -8.188
  174    HB2  GLU  25           HB2      GLU  25  47.022  -3.032  -5.859
  175    HB3  GLU  25           HB3      GLU  25  46.254  -4.606  -5.730
  176    HG2  GLU  25           HG2      GLU  25  47.615  -5.394  -7.630
  177    HG3  GLU  25           HG3      GLU  25  48.422  -3.823  -7.663
  178    H    GLY  26           H        GLY  26  43.781  -3.460  -9.127
  179    HA2  GLY  26           HA2      GLY  26  43.635  -5.553 -10.643
  180    HA3  GLY  26           HA3      GLY  26  43.460  -6.381  -9.099
  181    H    GLY  27           H        GLY  27  41.541  -6.249  -7.983
  182    HA2  GLY  27           HA2      GLY  27  39.453  -4.425  -8.713
  183    HA3  GLY  27           HA3      GLY  27  39.155  -6.042  -9.341
  184    H    TRP  28           H        TRP  28  40.862  -5.479  -6.374
  185    HA   TRP  28           HA       TRP  28  38.869  -7.024  -4.934
  186    HD1  TRP  28           HD1      TRP  28  43.104  -6.672  -5.929
  187    HE1  TRP  28           HE1      TRP  28  44.647  -4.668  -5.542
  188    HE3  TRP  28           HE3      TRP  28  40.694  -4.515  -1.978
  189    HZ2  TRP  28           HZ2      TRP  28  44.831  -2.441  -3.815
  190    HZ3  TRP  28           HZ3      TRP  28  41.608  -2.447  -1.019
  191    HH2  TRP  28           HH2      TRP  28  43.636  -1.434  -1.917
  192    HB2  TRP  28           HB2      TRP  28  40.625  -6.925  -3.097
  193    HB3  TRP  28           HB3      TRP  28  41.132  -7.731  -4.587
  194    H    LEU  29           H        LEU  29  39.686  -3.729  -5.337
  195    HA   LEU  29           HA       LEU  29  39.582  -2.777  -2.783
  196    HG   LEU  29           HG       LEU  29  37.559  -0.286  -3.760
  197    HB2  LEU  29           HB2      LEU  29  40.351  -1.268  -4.315
  198    HB3  LEU  29           HB3      LEU  29  39.021  -1.511  -5.419
  199   HD11  LEU  29          HD11      LEU  29  39.329   1.291  -2.411
  200   HD12  LEU  29          HD12      LEU  29  40.097  -0.292  -2.307
  201   HD13  LEU  29          HD13      LEU  29  38.450  -0.072  -1.717
  202   HD21  LEU  29          HD21      LEU  29  37.958   1.633  -4.863
  203   HD22  LEU  29          HD22      LEU  29  39.057   0.623  -5.803
  204   HD23  LEU  29          HD23      LEU  29  39.681   1.615  -4.487
  205    H    THR  30           H        THR  30  36.874  -3.833  -4.646
  206    HA   THR  30           HA       THR  30  34.977  -2.716  -2.740
  207    HB   THR  30           HB       THR  30  33.290  -4.009  -4.030
  208    HG1  THR  30           HG1      THR  30  34.054  -5.645  -5.079
  209   HG21  THR  30          HG21      THR  30  33.288  -1.998  -5.041
  210   HG22  THR  30          HG22      THR  30  33.985  -2.919  -6.373
  211   HG23  THR  30          HG23      THR  30  35.034  -1.996  -5.296
  212    H    ARG  31           H        ARG  31  36.239  -5.876  -3.720
  213    HA   ARG  31           HA       ARG  31  34.867  -7.476  -1.903
  214    HE   ARG  31           HE       ARG  31  37.613  -9.096  -7.110
  215    HB2  ARG  31           HB2      ARG  31  37.667  -8.119  -2.772
  216    HB3  ARG  31           HB3      ARG  31  36.308  -9.206  -2.538
  217    HG2  ARG  31           HG2      ARG  31  35.224  -8.196  -4.531
  218    HG3  ARG  31           HG3      ARG  31  36.691  -7.251  -4.795
  219    HD2  ARG  31           HD2      ARG  31  37.966  -9.401  -4.886
  220    HD3  ARG  31           HD3      ARG  31  36.425 -10.257  -4.824
  221   HH11  ARG  31          HH11      ARG  31  34.493  -9.540  -5.593
  222   HH12  ARG  31          HH12      ARG  31  33.611  -9.419  -7.084
  223   HH21  ARG  31          HH21      ARG  31  36.456  -8.929  -9.069
  224   HH22  ARG  31          HH22      ARG  31  34.723  -9.103  -9.052
  225    H    LEU  32           H        LEU  32  38.242  -6.366  -1.673
  226    HA   LEU  32           HA       LEU  32  38.924  -7.411   0.761
  227    HG   LEU  32           HG       LEU  32  42.073  -5.473   0.451
  228    HB2  LEU  32           HB2      LEU  32  40.306  -6.120  -0.968
  229    HB3  LEU  32           HB3      LEU  32  39.776  -4.666  -0.145
  230   HD11  LEU  32          HD11      LEU  32  41.138  -3.937   1.932
  231   HD12  LEU  32          HD12      LEU  32  41.684  -5.267   2.952
  232   HD13  LEU  32          HD13      LEU  32  39.974  -5.107   2.554
  233   HD21  LEU  32          HD21      LEU  32  40.482  -7.777   1.507
  234   HD22  LEU  32          HD22      LEU  32  42.022  -7.324   2.238
  235   HD23  LEU  32          HD23      LEU  32  41.957  -7.784   0.537
  236    H    LEU  33           H        LEU  33  37.519  -4.176   0.210
  237    HA   LEU  33           HA       LEU  33  37.378  -3.464   2.926
  238    HG   LEU  33           HG       LEU  33  37.713  -1.032   2.522
  239    HB2  LEU  33           HB2      LEU  33  36.029  -2.465   0.457
  240    HB3  LEU  33           HB3      LEU  33  35.480  -1.915   2.034
  241   HD11  LEU  33          HD11      LEU  33  39.072  -2.559   1.209
  242   HD12  LEU  33          HD12      LEU  33  39.401  -0.885   0.759
  243   HD13  LEU  33          HD13      LEU  33  38.398  -1.899  -0.281
  244   HD21  LEU  33          HD21      LEU  33  37.728   0.738   0.715
  245   HD22  LEU  33          HD22      LEU  33  36.219   0.534   1.605
  246   HD23  LEU  33          HD23      LEU  33  36.385  -0.140  -0.016
  247    H    GLN  34           H        GLN  34  34.642  -4.378   0.811
  248    HA   GLN  34           HA       GLN  34  32.647  -4.557   2.631
  249    HB2  GLN  34           HB2      GLN  34  33.205  -5.800   0.072
  250    HB3  GLN  34           HB3      GLN  34  32.184  -6.812   1.085
  251    HG2  GLN  34           HG2      GLN  34  30.606  -5.584  -0.014
  252    HG3  GLN  34           HG3      GLN  34  30.838  -4.595   1.427
  253   HE21  GLN  34          HE21      GLN  34  31.237  -2.512   1.129
  254   HE22  GLN  34          HE22      GLN  34  31.757  -1.791  -0.354
  255    H    THR  35           H        THR  35  35.032  -7.128   2.046
  256    HA   THR  35           HA       THR  35  33.791  -9.051   3.658
  257    HB   THR  35           HB       THR  35  36.745  -8.811   3.054
  258    HG1  THR  35           HG1      THR  35  35.640  -8.797   1.121
  259   HG21  THR  35          HG21      THR  35  35.835 -10.579   4.744
  260   HG22  THR  35          HG22      THR  35  37.007 -11.034   3.507
  261   HG23  THR  35          HG23      THR  35  35.295 -11.400   3.277
  262    H    LYS  36           H        LYS  36  36.532  -6.903   4.461
  263    HA   LYS  36           HA       LYS  36  36.339  -7.760   7.235
  264    HB2  LYS  36           HB2      LYS  36  38.337  -5.972   5.853
  265    HB3  LYS  36           HB3      LYS  36  38.394  -6.387   7.558
  266    HG2  LYS  36           HG2      LYS  36  39.830  -7.946   6.787
  267    HG3  LYS  36           HG3      LYS  36  38.333  -8.849   6.558
  268    HD2  LYS  36           HD2      LYS  36  38.267  -8.273   4.230
  269    HD3  LYS  36           HD3      LYS  36  39.628  -7.162   4.414
  270    HE2  LYS  36           HE2      LYS  36  39.666 -10.165   4.712
  271    HE3  LYS  36           HE3      LYS  36  40.409  -9.216   3.423
  272    HZ1  LYS  36           HZ1      LYS  36  42.234  -9.007   4.650
  273    HZ2  LYS  36           HZ2      LYS  36  41.539  -9.980   5.855
  274    HZ3  LYS  36           HZ3      LYS  36  41.355  -8.293   5.917
  275    H    ASN  37           H        ASN  37  34.134  -6.286   6.393
  276    HA   ASN  37           HA       ASN  37  32.880  -4.426   6.691
  277    HB2  ASN  37           HB2      ASN  37  32.909  -3.483   9.039
  278    HB3  ASN  37           HB3      ASN  37  32.578  -5.204   8.895
  279   HD21  ASN  37          HD21      ASN  37  34.506  -2.822  10.322
  280   HD22  ASN  37          HD22      ASN  37  35.627  -3.865  11.121
  281    H    TYR  38           H        TYR  38  34.767  -3.752   5.117
  282    HA   TYR  38           HA       TYR  38  35.812  -2.016   4.143
  283    HD1  TYR  38           HD1      TYR  38  32.455  -1.707   6.262
  284    HD2  TYR  38           HD2      TYR  38  33.983   0.091   2.726
  285    HE1  TYR  38           HE1      TYR  38  30.305  -2.094   5.148
  286    HE2  TYR  38           HE2      TYR  38  31.828  -0.281   1.605
  287    HH   TYR  38           HH       TYR  38  29.085  -0.772   3.008
  288    HB2  TYR  38           HB2      TYR  38  34.518  -0.330   6.293
  289    HB3  TYR  38           HB3      TYR  38  35.201   0.258   4.778
  290    H    ASP  39           H        ASP  39  37.702  -3.136   4.903
  291    HA   ASP  39           HA       ASP  39  39.097  -1.896   7.152
  292    HB2  ASP  39           HB2      ASP  39  38.891  -4.471   6.511
  293    HB3  ASP  39           HB3      ASP  39  40.320  -4.095   5.556
  294    H    ILE  40           H        ILE  40  40.443  -0.258   6.785
  295    HA   ILE  40           HA       ILE  40  41.736   0.014   4.180
  296    HB   ILE  40           HB       ILE  40  42.823   2.044   5.555
  297   HG12  ILE  40          HG12      ILE  40  41.261   1.283   7.534
  298   HG13  ILE  40          HG13      ILE  40  41.504   2.992   7.199
  299   HG21  ILE  40          HG21      ILE  40  41.899   2.985   3.781
  300   HG22  ILE  40          HG22      ILE  40  40.399   3.122   4.697
  301   HG23  ILE  40          HG23      ILE  40  40.680   1.715   3.671
  302   HD11  ILE  40          HD11      ILE  40  39.104   1.294   6.646
  303   HD12  ILE  40          HD12      ILE  40  39.369   2.813   5.787
  304   HD13  ILE  40          HD13      ILE  40  39.220   2.807   7.546
  305    H    GLY  41           H        GLY  41  42.229  -1.197   7.314
  306    HA2  GLY  41           HA2      GLY  41  45.007  -0.900   7.546
  307    HA3  GLY  41           HA3      GLY  41  44.050  -2.113   8.364
  308    H    ALA  42           H        ALA  42  43.041  -3.253   5.929
  309    HA   ALA  42           HA       ALA  42  45.424  -4.747   5.109
  310    HB1  ALA  42           HB1      ALA  42  43.143  -5.764   6.026
  311    HB2  ALA  42           HB2      ALA  42  44.138  -6.599   4.832
  312    HB3  ALA  42           HB3      ALA  42  42.729  -5.675   4.313
  313    H    ALA  43           H        ALA  43  43.103  -2.521   3.978
  314    HA   ALA  43           HA       ALA  43  43.317  -3.117   1.186
  315    HB1  ALA  43           HB1      ALA  43  42.594  -0.377   2.096
  316    HB2  ALA  43           HB2      ALA  43  41.516  -1.709   2.519
  317    HB3  ALA  43           HB3      ALA  43  41.882  -1.373   0.827
  318    H    LEU  44           H        LEU  44  44.967  -0.990   3.435
  319    HA   LEU  44           HA       LEU  44  46.427   0.497   1.536
  320    HG   LEU  44           HG       LEU  44  47.006   2.587   2.923
  321    HB2  LEU  44           HB2      LEU  44  46.611   0.011   4.451
  322    HB3  LEU  44           HB3      LEU  44  48.076   0.564   3.652
  323   HD11  LEU  44          HD11      LEU  44  44.477   1.337   3.971
  324   HD12  LEU  44          HD12      LEU  44  44.829   1.877   2.326
  325   HD13  LEU  44          HD13      LEU  44  44.635   3.060   3.619
  326   HD21  LEU  44          HD21      LEU  44  46.121   3.426   5.203
  327   HD22  LEU  44          HD22      LEU  44  47.810   2.943   5.052
  328   HD23  LEU  44          HD23      LEU  44  46.642   1.848   5.792
  329    H    ASP  45           H        ASP  45  46.923  -2.640   2.968
  330    HA   ASP  45           HA       ASP  45  49.614  -3.061   2.376
  331    HB2  ASP  45           HB2      ASP  45  48.137  -4.589   3.702
  332    HB3  ASP  45           HB3      ASP  45  47.406  -5.124   2.193
  333    H    THR  46           H        THR  46  46.754  -3.680   0.367
  334    HA   THR  46           HA       THR  46  48.419  -4.458  -1.850
  335    HB   THR  46           HB       THR  46  46.069  -4.567  -2.972
  336    HG1  THR  46           HG1      THR  46  44.691  -3.637  -1.650
  337   HG21  THR  46          HG21      THR  46  46.217  -6.736  -2.596
  338   HG22  THR  46          HG22      THR  46  45.858  -6.515  -0.883
  339   HG23  THR  46          HG23      THR  46  47.521  -6.399  -1.457
  340    H    ILE  47           H        ILE  47  47.453  -1.462  -0.707
  341    HA   ILE  47           HA       ILE  47  47.576  -0.365  -3.428
  342    HB   ILE  47           HB       ILE  47  46.711   1.777  -2.556
  343   HG12  ILE  47          HG12      ILE  47  46.164   0.200  -0.039
  344   HG13  ILE  47          HG13      ILE  47  47.322   1.519  -0.201
  345   HG21  ILE  47          HG21      ILE  47  44.361   0.577  -1.892
  346   HG22  ILE  47          HG22      ILE  47  45.203  -0.734  -2.715
  347   HG23  ILE  47          HG23      ILE  47  44.941   0.798  -3.542
  348   HD11  ILE  47          HD11      ILE  47  44.556   2.135  -0.991
  349   HD12  ILE  47          HD12      ILE  47  45.728   3.099  -0.091
  350   HD13  ILE  47          HD13      ILE  47  44.826   1.822   0.724
  351    H    GLN  48           H        GLN  48  49.857  -1.282  -2.381
  352    HA   GLN  48           HA       GLN  48  52.030  -0.718  -2.576
  353    HB2  GLN  48           HB2      GLN  48  51.137   2.165  -2.445
  354    HB3  GLN  48           HB3      GLN  48  52.773   1.621  -2.793
  355    HG2  GLN  48           HG2      GLN  48  52.265   1.511  -4.942
  356    HG3  GLN  48           HG3      GLN  48  51.060   0.273  -4.586
  357   HE21  GLN  48          HE21      GLN  48  48.991   0.732  -4.917
  358   HE22  GLN  48          HE22      GLN  48  48.338   2.315  -5.220
  359    H    TYR  49           H        TYR  49  50.563  -1.030   0.023
  360    HA   TYR  49           HA       TYR  49  52.853  -0.158   1.645
  361    HD1  TYR  49           HD1      TYR  49  49.994   1.812   0.639
  362    HD2  TYR  49           HD2      TYR  49  52.197   2.055   4.268
  363    HE1  TYR  49           HE1      TYR  49  50.126   4.247   0.390
  364    HE2  TYR  49           HE2      TYR  49  52.339   4.498   4.024
  365    HH   TYR  49           HH       TYR  49  52.238   6.162   1.999
  366    HB2  TYR  49           HB2      TYR  49  49.954  -0.014   2.496
  367    HB3  TYR  49           HB3      TYR  49  51.294   0.016   3.638
  368    H    SER  50           H        SER  50  52.811  -2.574   0.447
  369    HA   SER  50           HA       SER  50  51.456  -4.535   1.989
  370    HG   SER  50           HG       SER  50  51.490  -6.548   0.960
  371    HB2  SER  50           HB2      SER  50  52.095  -4.734  -0.455
  372    HB3  SER  50           HB3      SER  50  53.742  -5.049   0.092
  373    H    LYS  51           H        LYS  51  53.911  -2.729   2.873
  374    HA   LYS  51           HA       LYS  51  54.817  -4.753   4.781
  375    HB2  LYS  51           HB2      LYS  51  56.656  -4.407   3.169
  376    HB3  LYS  51           HB3      LYS  51  56.624  -2.682   3.510
  377    HG2  LYS  51           HG2      LYS  51  57.252  -3.126   5.830
  378    HG3  LYS  51           HG3      LYS  51  57.288  -4.857   5.487
  379    HD2  LYS  51           HD2      LYS  51  59.085  -4.537   3.898
  380    HD3  LYS  51           HD3      LYS  51  59.009  -2.787   4.125
  381    HE2  LYS  51           HE2      LYS  51  59.739  -4.834   6.220
  382    HE3  LYS  51           HE3      LYS  51  60.856  -3.747   5.394
  383    HZ1  LYS  51           HZ1      LYS  51  60.506  -2.522   7.240
  384    HZ2  LYS  51           HZ2      LYS  51  58.977  -3.193   7.557
  385    HZ3  LYS  51           HZ3      LYS  51  59.142  -1.979   6.379
  386    H    HIS  52           H        HIS  52  53.469  -3.989   6.366
  387    HA   HIS  52           HA       HIS  52  53.284  -1.167   6.901
  388    HD1  HIS  52           HD1      HIS  52  51.400  -4.400   5.977
  389    HD2  HIS  52           HD2      HIS  52  49.680  -0.896   7.410
  390    HE1  HIS  52           HE1      HIS  52  49.314  -4.021   4.604
  391    HB2  HIS  52           HB2      HIS  52  52.192  -3.515   8.467
  392    HB3  HIS  52           HB3      HIS  52  51.808  -1.825   8.769
  Start of MODEL   16
    1    H1   GLY   1           1H       GLY   1  20.040   5.160   3.672
    2    H2   GLY   1           2H       GLY   1  20.165   3.521   3.245
    3    H3   GLY   1           3H       GLY   1  20.158   4.713   2.041
    4    HA2  GLY   1           HA2      GLY   1  22.232   4.827   4.108
    5    HA3  GLY   1           HA3      GLY   1  22.382   3.623   2.836
    6    H    SER   2           H        SER   2  24.196   4.577   1.938
    7    HA   SER   2           HA       SER   2  23.704   7.129   0.545
    8    HG   SER   2           HG       SER   2  25.506   8.435   2.629
    9    HB2  SER   2           HB2      SER   2  26.364   6.094   1.564
   10    HB3  SER   2           HB3      SER   2  26.076   7.645   0.775
   11    HA   PRO   3           HA       PRO   3  24.658   5.020  -3.248
   12    HB2  PRO   3           HB2      PRO   3  26.282   6.828  -4.525
   13    HB3  PRO   3           HB3      PRO   3  24.522   6.970  -4.450
   14    HG2  PRO   3           HG2      PRO   3  26.609   8.350  -2.818
   15    HG3  PRO   3           HG3      PRO   3  25.091   8.991  -3.474
   16    HD2  PRO   3           HD2      PRO   3  25.376   8.283  -0.878
   17    HD3  PRO   3           HD3      PRO   3  23.836   8.132  -1.750
   18    HA   PRO   4           HA       PRO   4  28.251   2.757  -1.957
   19    HB2  PRO   4           HB2      PRO   4  28.133   1.849  -4.806
   20    HB3  PRO   4           HB3      PRO   4  28.295   0.896  -3.326
   21    HG2  PRO   4           HG2      PRO   4  25.955   1.046  -4.575
   22    HG3  PRO   4           HG3      PRO   4  26.039   1.078  -2.803
   23    HD2  PRO   4           HD2      PRO   4  25.511   3.299  -4.718
   24    HD3  PRO   4           HD3      PRO   4  24.890   3.050  -3.074
   25    H    GLU   5           H        GLU   5  29.652   4.494  -1.743
   26    HA   GLU   5           HA       GLU   5  32.070   4.499  -2.804
   27    HB2  GLU   5           HB2      GLU   5  30.894   4.992  -5.052
   28    HB3  GLU   5           HB3      GLU   5  30.660   6.613  -4.418
   29    HG2  GLU   5           HG2      GLU   5  33.095   6.853  -4.181
   30    HG3  GLU   5           HG3      GLU   5  33.302   5.245  -4.875
   31    H    ALA   6           H        ALA   6  29.442   6.261  -1.710
   32    HA   ALA   6           HA       ALA   6  31.188   8.029  -0.130
   33    HB1  ALA   6           HB1      ALA   6  28.726   9.365  -0.520
   34    HB2  ALA   6           HB2      ALA   6  29.296   8.839  -2.104
   35    HB3  ALA   6           HB3      ALA   6  30.328   9.842  -1.084
   36    H    ASP   7           H        ASP   7  29.988   5.499   0.502
   37    HA   ASP   7           HA       ASP   7  27.714   5.883   2.203
   38    HB2  ASP   7           HB2      ASP   7  29.713   3.624   2.394
   39    HB3  ASP   7           HB3      ASP   7  28.019   3.606   2.859
   40    HA   PRO   8           HA       PRO   8  29.848   7.119   5.999
   41    HB2  PRO   8           HB2      PRO   8  28.433   4.929   7.383
   42    HB3  PRO   8           HB3      PRO   8  28.403   6.664   7.709
   43    HG2  PRO   8           HG2      PRO   8  26.291   5.397   6.632
   44    HG3  PRO   8           HG3      PRO   8  26.714   7.060   6.184
   45    HD2  PRO   8           HD2      PRO   8  27.199   4.511   4.689
   46    HD3  PRO   8           HD3      PRO   8  26.715   6.107   4.073
   47    H    ARG   9           H        ARG   9  29.827   4.060   4.533
   48    HA   ARG   9           HA       ARG   9  31.906   2.881   6.193
   49    HE   ARG   9           HE       ARG   9  29.550  -0.257   3.546
   50    HB2  ARG   9           HB2      ARG   9  30.515   1.854   3.705
   51    HB3  ARG   9           HB3      ARG   9  31.614   0.926   4.728
   52    HG2  ARG   9           HG2      ARG   9  29.957   0.357   6.086
   53    HG3  ARG   9           HG3      ARG   9  29.504   2.048   6.320
   54    HD2  ARG   9           HD2      ARG   9  27.655   0.697   5.415
   55    HD3  ARG   9           HD3      ARG   9  28.135   1.995   4.323
   56   HH11  ARG   9          HH11      ARG   9  26.201   0.722   3.789
   57   HH12  ARG   9          HH12      ARG   9  25.678  -0.286   2.475
   58   HH21  ARG   9          HH21      ARG   9  28.863  -1.575   1.811
   59   HH22  ARG   9          HH22      ARG   9  27.191  -1.580   1.350
   60    H    LEU  10           H        LEU  10  31.460   3.851   2.769
   61    HA   LEU  10           HA       LEU  10  34.277   3.403   2.303
   62    HG   LEU  10           HG       LEU  10  32.089   1.578   1.249
   63    HB2  LEU  10           HB2      LEU  10  31.956   3.879   0.453
   64    HB3  LEU  10           HB3      LEU  10  33.616   3.804  -0.108
   65   HD11  LEU  10          HD11      LEU  10  33.259   1.407  -1.481
   66   HD12  LEU  10          HD12      LEU  10  31.736   2.269  -1.262
   67   HD13  LEU  10          HD13      LEU  10  31.864   0.574  -0.789
   68   HD21  LEU  10          HD21      LEU  10  34.206   1.116   1.963
   69   HD22  LEU  10          HD22      LEU  10  34.965   1.939   0.600
   70   HD23  LEU  10          HD23      LEU  10  34.249   0.344   0.378
   71    H    ILE  11           H        ILE  11  32.187   6.056   2.848
   72    HA   ILE  11           HA       ILE  11  33.704   8.049   1.463
   73    HB   ILE  11           HB       ILE  11  31.288   8.053   2.747
   74   HG12  ILE  11          HG12      ILE  11  32.073   9.595   0.968
   75   HG13  ILE  11          HG13      ILE  11  31.165  10.411   2.235
   76   HG21  ILE  11          HG21      ILE  11  31.479   9.742   4.575
   77   HG22  ILE  11          HG22      ILE  11  33.221   9.469   4.562
   78   HG23  ILE  11          HG23      ILE  11  32.125   8.149   4.970
   79   HD11  ILE  11          HD11      ILE  11  32.903  11.858   1.887
   80   HD12  ILE  11          HD12      ILE  11  34.065  10.567   1.577
   81   HD13  ILE  11          HD13      ILE  11  33.521  10.889   3.225
   82    H    GLU  12           H        GLU  12  34.090   6.199   4.295
   83    HA   GLU  12           HA       GLU  12  36.220   7.923   5.325
   84    HB2  GLU  12           HB2      GLU  12  35.090   5.370   6.479
   85    HB3  GLU  12           HB3      GLU  12  36.267   6.422   7.251
   86    HG2  GLU  12           HG2      GLU  12  34.608   8.227   7.299
   87    HG3  GLU  12           HG3      GLU  12  33.428   7.148   6.560
   88    H    SER  13           H        SER  13  35.695   4.603   4.182
   89    HA   SER  13           HA       SER  13  38.508   4.038   4.449
   90    HG   SER  13           HG       SER  13  38.044   0.967   5.019
   91    HB2  SER  13           HB2      SER  13  36.626   2.498   5.162
   92    HB3  SER  13           HB3      SER  13  36.357   2.174   3.451
   93    H    LEU  14           H        LEU  14  36.227   4.378   1.737
   94    HA   LEU  14           HA       LEU  14  38.325   3.608  -0.132
   95    HG   LEU  14           HG       LEU  14  36.549   5.028  -2.513
   96    HB2  LEU  14           HB2      LEU  14  36.166   2.694  -0.630
   97    HB3  LEU  14           HB3      LEU  14  35.400   4.264  -0.475
   98   HD11  LEU  14          HD11      LEU  14  38.524   3.539  -2.287
   99   HD12  LEU  14          HD12      LEU  14  37.804   3.533  -3.896
  100   HD13  LEU  14          HD13      LEU  14  37.510   2.188  -2.795
  101   HD21  LEU  14          HD21      LEU  14  34.553   2.942  -2.358
  102   HD22  LEU  14          HD22      LEU  14  35.450   2.873  -3.874
  103   HD23  LEU  14          HD23      LEU  14  34.627   4.359  -3.403
  104    H    SER  15           H        SER  15  36.275   6.329   0.730
  105    HA   SER  15           HA       SER  15  37.130   8.040  -1.259
  106    HG   SER  15           HG       SER  15  36.375  10.742   0.802
  107    HB2  SER  15           HB2      SER  15  35.132   8.449   0.099
  108    HB3  SER  15           HB3      SER  15  36.151   8.783   1.498
  109    H    GLN  16           H        GLN  16  38.746   7.154   1.697
  110    HA   GLN  16           HA       GLN  16  40.481   9.425   1.736
  111    HB2  GLN  16           HB2      GLN  16  41.725   8.273   3.457
  112    HB3  GLN  16           HB3      GLN  16  40.008   8.122   3.776
  113    HG2  GLN  16           HG2      GLN  16  40.674   6.001   4.226
  114    HG3  GLN  16           HG3      GLN  16  40.329   5.829   2.505
  115   HE21  GLN  16          HE21      GLN  16  41.788   4.519   1.656
  116   HE22  GLN  16          HE22      GLN  16  43.495   4.586   1.926
  117    H    MET  17           H        MET  17  40.569   6.299   0.149
  118    HA   MET  17           HA       MET  17  43.324   6.769  -0.683
  119    HB2  MET  17           HB2      MET  17  43.221   4.581  -1.765
  120    HB3  MET  17           HB3      MET  17  42.718   4.467  -0.086
  121    HG2  MET  17           HG2      MET  17  40.374   4.431  -0.804
  122    HG3  MET  17           HG3      MET  17  40.903   4.509  -2.485
  123    HE1  MET  17           HE1      MET  17  40.793   2.319   0.792
  124    HE2  MET  17           HE2      MET  17  42.519   2.550   0.507
  125    HE3  MET  17           HE3      MET  17  41.800   0.951   0.317
  126    H    LEU  18           H        LEU  18  40.072   7.038  -1.844
  127    HA   LEU  18           HA       LEU  18  40.603   7.194  -4.617
  128    HG   LEU  18           HG       LEU  18  38.461   9.188  -5.483
  129    HB2  LEU  18           HB2      LEU  18  38.363   6.902  -3.507
  130    HB3  LEU  18           HB3      LEU  18  38.420   8.603  -3.083
  131   HD11  LEU  18          HD11      LEU  18  38.843   6.313  -5.729
  132   HD12  LEU  18          HD12      LEU  18  39.192   7.607  -6.876
  133   HD13  LEU  18          HD13      LEU  18  37.563   6.937  -6.772
  134   HD21  LEU  18          HD21      LEU  18  36.105   7.644  -5.691
  135   HD22  LEU  18          HD22      LEU  18  36.264   9.337  -5.222
  136   HD23  LEU  18          HD23      LEU  18  36.301   8.074  -3.992
  137    H    SER  19           H        SER  19  40.943   9.476  -2.008
  138    HA   SER  19           HA       SER  19  41.344  11.686  -3.859
  139    HG   SER  19           HG       SER  19  40.273  10.846  -0.465
  140    HB2  SER  19           HB2      SER  19  41.643  12.980  -1.662
  141    HB3  SER  19           HB3      SER  19  40.040  12.327  -2.011
  142    H    MET  20           H        MET  20  43.191   9.893  -1.393
  143    HA   MET  20           HA       MET  20  45.516  11.478  -1.655
  144    HB2  MET  20           HB2      MET  20  45.154   8.695  -0.541
  145    HB3  MET  20           HB3      MET  20  46.652   9.609  -0.437
  146    HG2  MET  20           HG2      MET  20  44.004  10.380   0.767
  147    HG3  MET  20           HG3      MET  20  45.418   9.770   1.628
  148    HE1  MET  20           HE1      MET  20  45.710  12.539   3.290
  149    HE2  MET  20           HE2      MET  20  44.198  11.782   2.788
  150    HE3  MET  20           HE3      MET  20  44.497  13.480   2.423
  151    H    GLY  21           H        GLY  21  44.347   8.802  -3.520
  152    HA2  GLY  21           HA2      GLY  21  45.260   8.442  -5.722
  153    HA3  GLY  21           HA3      GLY  21  46.828   8.961  -5.107
  154    H    PHE  22           H        PHE  22  44.490   6.576  -3.892
  155    HA   PHE  22           HA       PHE  22  46.490   4.478  -4.343
  156    HD1  PHE  22           HD1      PHE  22  48.213   3.930  -2.934
  157    HD2  PHE  22           HD2      PHE  22  45.755   6.195  -0.302
  158    HE1  PHE  22           HE1      PHE  22  50.218   4.794  -1.812
  159    HE2  PHE  22           HE2      PHE  22  47.761   7.069   0.825
  160    HZ   PHE  22           HZ       PHE  22  49.999   6.360   0.068
  161    HB2  PHE  22           HB2      PHE  22  44.762   4.884  -1.892
  162    HB3  PHE  22           HB3      PHE  22  45.622   3.384  -2.241
  163    H    SER  23           H        SER  23  45.584   2.499  -5.035
  164    HA   SER  23           HA       SER  23  42.695   2.534  -5.459
  165    HG   SER  23           HG       SER  23  44.376   4.093  -8.317
  166    HB2  SER  23           HB2      SER  23  44.678   2.048  -7.698
  167    HB3  SER  23           HB3      SER  23  42.920   2.136  -7.835
  168    H    ASP  24           H        ASP  24  41.986   0.435  -6.548
  169    HA   ASP  24           HA       ASP  24  43.071  -1.820  -5.140
  170    HB2  ASP  24           HB2      ASP  24  41.421  -3.124  -6.505
  171    HB3  ASP  24           HB3      ASP  24  40.695  -1.815  -5.575
  172    H    GLU  25           H        GLU  25  44.557  -3.223  -5.831
  173    HA   GLU  25           HA       GLU  25  46.098  -2.574  -8.109
  174    HB2  GLU  25           HB2      GLU  25  46.961  -3.669  -6.017
  175    HB3  GLU  25           HB3      GLU  25  46.199  -5.157  -6.564
  176    HG2  GLU  25           HG2      GLU  25  48.587  -5.103  -7.057
  177    HG3  GLU  25           HG3      GLU  25  47.610  -5.203  -8.521
  178    H    GLY  26           H        GLY  26  44.514  -5.659  -7.460
  179    HA2  GLY  26           HA2      GLY  26  44.266  -6.072 -10.351
  180    HA3  GLY  26           HA3      GLY  26  44.107  -7.315  -9.115
  181    H    GLY  27           H        GLY  27  42.294  -5.331  -7.624
  182    HA2  GLY  27           HA2      GLY  27  40.030  -4.471  -8.332
  183    HA3  GLY  27           HA3      GLY  27  39.885  -5.999  -9.198
  184    H    TRP  28           H        TRP  28  41.411  -5.646  -6.103
  185    HA   TRP  28           HA       TRP  28  39.536  -7.554  -4.969
  186    HD1  TRP  28           HD1      TRP  28  43.881  -7.114  -5.702
  187    HE1  TRP  28           HE1      TRP  28  45.325  -5.053  -5.178
  188    HE3  TRP  28           HE3      TRP  28  41.059  -5.038  -1.989
  189    HZ2  TRP  28           HZ2      TRP  28  45.277  -2.844  -3.444
  190    HZ3  TRP  28           HZ3      TRP  28  41.824  -2.951  -0.950
  191    HH2  TRP  28           HH2      TRP  28  43.892  -1.886  -1.664
  192    HB2  TRP  28           HB2      TRP  28  41.273  -7.548  -3.083
  193    HB3  TRP  28           HB3      TRP  28  41.793  -8.187  -4.646
  194    H    LEU  29           H        LEU  29  39.793  -4.239  -5.078
  195    HA   LEU  29           HA       LEU  29  39.617  -3.461  -2.425
  196    HG   LEU  29           HG       LEU  29  37.203  -1.351  -3.166
  197    HB2  LEU  29           HB2      LEU  29  40.087  -1.764  -3.906
  198    HB3  LEU  29           HB3      LEU  29  38.794  -2.197  -5.000
  199   HD11  LEU  29          HD11      LEU  29  38.422   0.530  -1.858
  200   HD12  LEU  29          HD12      LEU  29  39.860  -0.454  -2.128
  201   HD13  LEU  29          HD13      LEU  29  38.484  -1.126  -1.254
  202   HD21  LEU  29          HD21      LEU  29  38.640  -0.056  -5.248
  203   HD22  LEU  29          HD22      LEU  29  38.439   1.082  -3.914
  204   HD23  LEU  29          HD23      LEU  29  37.026   0.302  -4.628
  205    H    THR  30           H        THR  30  37.091  -4.641  -4.533
  206    HA   THR  30           HA       THR  30  34.983  -4.045  -2.639
  207    HB   THR  30           HB       THR  30  34.817  -5.945  -4.981
  208    HG1  THR  30           HG1      THR  30  34.889  -3.123  -4.926
  209   HG21  THR  30          HG21      THR  30  32.754  -6.082  -4.062
  210   HG22  THR  30          HG22      THR  30  32.517  -4.633  -5.040
  211   HG23  THR  30          HG23      THR  30  32.853  -4.487  -3.314
  212    H    ARG  31           H        ARG  31  37.352  -6.450  -3.029
  213    HA   ARG  31           HA       ARG  31  35.810  -8.508  -1.640
  214    HE   ARG  31           HE       ARG  31  39.769  -9.784  -3.631
  215    HB2  ARG  31           HB2      ARG  31  38.666  -8.890  -2.415
  216    HB3  ARG  31           HB3      ARG  31  37.343 -10.047  -2.427
  217    HG2  ARG  31           HG2      ARG  31  36.398  -8.819  -4.398
  218    HG3  ARG  31           HG3      ARG  31  37.871  -7.858  -4.425
  219    HD2  ARG  31           HD2      ARG  31  37.573 -10.815  -4.882
  220    HD3  ARG  31           HD3      ARG  31  38.168  -9.593  -6.006
  221   HH11  ARG  31          HH11      ARG  31  39.204 -11.120  -6.811
  222   HH12  ARG  31          HH12      ARG  31  40.765 -11.869  -6.921
  223   HH21  ARG  31          HH21      ARG  31  41.823 -10.762  -3.762
  224   HH22  ARG  31          HH22      ARG  31  42.261 -11.666  -5.179
  225    H    LEU  32           H        LEU  32  39.046  -7.098  -1.369
  226    HA   LEU  32           HA       LEU  32  39.859  -8.043   1.061
  227    HG   LEU  32           HG       LEU  32  42.782  -5.764   0.666
  228    HB2  LEU  32           HB2      LEU  32  41.090  -6.661  -0.689
  229    HB3  LEU  32           HB3      LEU  32  40.391  -5.245   0.065
  230   HD11  LEU  32          HD11      LEU  32  40.594  -5.158   2.515
  231   HD12  LEU  32          HD12      LEU  32  42.098  -4.293   2.196
  232   HD13  LEU  32          HD13      LEU  32  42.095  -5.686   3.279
  233   HD21  LEU  32          HD21      LEU  32  41.485  -8.039   2.143
  234   HD22  LEU  32          HD22      LEU  32  43.132  -7.466   2.411
  235   HD23  LEU  32          HD23      LEU  32  42.677  -8.145   0.847
  236    H    LEU  33           H        LEU  33  38.772  -4.669   0.754
  237    HA   LEU  33           HA       LEU  33  38.506  -4.201   3.457
  238    HG   LEU  33           HG       LEU  33  39.515  -2.066   2.746
  239    HB2  LEU  33           HB2      LEU  33  37.100  -2.882   1.138
  240    HB3  LEU  33           HB3      LEU  33  36.977  -2.300   2.787
  241   HD11  LEU  33          HD11      LEU  33  38.986  -2.874  -0.053
  242   HD12  LEU  33          HD12      LEU  33  40.393  -3.165   0.971
  243   HD13  LEU  33          HD13      LEU  33  40.162  -1.588   0.217
  244   HD21  LEU  33          HD21      LEU  33  37.563  -0.418   1.219
  245   HD22  LEU  33          HD22      LEU  33  39.273   0.008   1.168
  246   HD23  LEU  33          HD23      LEU  33  38.425  -0.053   2.714
  247    H    GLN  34           H        GLN  34  35.981  -5.160   1.175
  248    HA   GLN  34           HA       GLN  34  33.731  -4.928   2.704
  249    HB2  GLN  34           HB2      GLN  34  34.512  -6.277   0.346
  250    HB3  GLN  34           HB3      GLN  34  33.548  -7.397   1.296
  251    HG2  GLN  34           HG2      GLN  34  32.029  -6.311  -0.113
  252    HG3  GLN  34           HG3      GLN  34  31.819  -5.557   1.465
  253   HE21  GLN  34          HE21      GLN  34  34.699  -4.525   0.144
  254   HE22  GLN  34          HE22      GLN  34  34.158  -3.044  -0.557
  255    H    THR  35           H        THR  35  35.781  -7.839   2.541
  256    HA   THR  35           HA       THR  35  34.257  -9.199   4.546
  257    HB   THR  35           HB       THR  35  37.022  -9.984   3.651
  258    HG1  THR  35           HG1      THR  35  36.223  -9.796   1.690
  259   HG21  THR  35          HG21      THR  35  36.508 -11.836   4.752
  260   HG22  THR  35          HG22      THR  35  35.296 -12.149   3.509
  261   HG23  THR  35          HG23      THR  35  34.841 -11.311   4.992
  262    H    LYS  36           H        LYS  36  36.543  -6.782   4.730
  263    HA   LYS  36           HA       LYS  36  37.381  -7.600   7.430
  264    HB2  LYS  36           HB2      LYS  36  38.771  -5.964   5.330
  265    HB3  LYS  36           HB3      LYS  36  39.227  -5.853   7.020
  266    HG2  LYS  36           HG2      LYS  36  39.823  -8.192   7.059
  267    HG3  LYS  36           HG3      LYS  36  39.249  -8.394   5.399
  268    HD2  LYS  36           HD2      LYS  36  40.974  -7.001   4.546
  269    HD3  LYS  36           HD3      LYS  36  41.416  -6.448   6.162
  270    HE2  LYS  36           HE2      LYS  36  43.015  -8.083   5.267
  271    HE3  LYS  36           HE3      LYS  36  42.223  -8.657   6.735
  272    HZ1  LYS  36           HZ1      LYS  36  42.417 -10.017   4.378
  273    HZ2  LYS  36           HZ2      LYS  36  40.827  -9.431   4.353
  274    HZ3  LYS  36           HZ3      LYS  36  41.358 -10.381   5.657
  275    H    ASN  37           H        ASN  37  34.894  -6.379   6.938
  276    HA   ASN  37           HA       ASN  37  33.525  -4.675   7.508
  277    HB2  ASN  37           HB2      ASN  37  33.756  -3.841   9.737
  278    HB3  ASN  37           HB3      ASN  37  34.302  -5.513   9.720
  279   HD21  ASN  37          HD21      ASN  37  36.336  -5.973  10.384
  280   HD22  ASN  37          HD22      ASN  37  37.486  -4.787  10.901
  281    H    TYR  38           H        TYR  38  35.452  -3.931   5.543
  282    HA   TYR  38           HA       TYR  38  36.087  -2.110   4.361
  283    HD1  TYR  38           HD1      TYR  38  34.621  -1.139   2.612
  284    HD2  TYR  38           HD2      TYR  38  32.109  -1.597   6.013
  285    HE1  TYR  38           HE1      TYR  38  32.792  -1.877   1.152
  286    HE2  TYR  38           HE2      TYR  38  30.269  -2.340   4.559
  287    HH   TYR  38           HH       TYR  38  30.749  -2.759   1.067
  288    HB2  TYR  38           HB2      TYR  38  34.232  -0.724   6.300
  289    HB3  TYR  38           HB3      TYR  38  34.988   0.087   4.932
  290    H    ASP  39           H        ASP  39  38.200  -2.685   5.421
  291    HA   ASP  39           HA       ASP  39  39.028  -0.508   7.229
  292    HB2  ASP  39           HB2      ASP  39  40.866  -1.938   7.991
  293    HB3  ASP  39           HB3      ASP  39  39.293  -2.680   8.277
  294    H    ILE  40           H        ILE  40  40.778   0.687   6.885
  295    HA   ILE  40           HA       ILE  40  42.085   0.458   4.278
  296    HB   ILE  40           HB       ILE  40  43.197   2.646   4.972
  297   HG12  ILE  40          HG12      ILE  40  42.257   2.236   7.429
  298   HG13  ILE  40          HG13      ILE  40  42.465   3.859   6.784
  299   HG21  ILE  40          HG21      ILE  40  40.240   2.954   4.727
  300   HG22  ILE  40          HG22      ILE  40  41.161   2.194   3.430
  301   HG23  ILE  40          HG23      ILE  40  41.532   3.846   3.926
  302   HD11  ILE  40          HD11      ILE  40  39.850   2.413   6.549
  303   HD12  ILE  40          HD12      ILE  40  40.172   4.143   6.439
  304   HD13  ILE  40          HD13      ILE  40  40.282   3.322   7.999
  305    H    GLY  41           H        GLY  41  42.407  -0.598   7.387
  306    HA2  GLY  41           HA2      GLY  41  45.143  -0.170   7.893
  307    HA3  GLY  41           HA3      GLY  41  44.144  -1.378   8.672
  308    H    ALA  42           H        ALA  42  43.421  -2.874   6.497
  309    HA   ALA  42           HA       ALA  42  45.968  -4.154   5.826
  310    HB1  ALA  42           HB1      ALA  42  44.254  -5.943   4.916
  311    HB2  ALA  42           HB2      ALA  42  43.160  -5.117   6.028
  312    HB3  ALA  42           HB3      ALA  42  44.651  -5.843   6.632
  313    H    ALA  43           H        ALA  43  43.509  -2.243   4.490
  314    HA   ALA  43           HA       ALA  43  43.811  -3.024   1.756
  315    HB1  ALA  43           HB1      ALA  43  42.932  -0.267   2.366
  316    HB2  ALA  43           HB2      ALA  43  41.944  -1.577   3.017
  317    HB3  ALA  43           HB3      ALA  43  42.235  -1.470   1.280
  318    H    LEU  44           H        LEU  44  45.387  -0.754   3.895
  319    HA   LEU  44           HA       LEU  44  46.726   0.790   1.943
  320    HG   LEU  44           HG       LEU  44  48.742   2.139   2.998
  321    HB2  LEU  44           HB2      LEU  44  46.447   1.005   4.597
  322    HB3  LEU  44           HB3      LEU  44  48.044   0.271   4.554
  323   HD11  LEU  44          HD11      LEU  44  47.154   4.205   3.509
  324   HD12  LEU  44          HD12      LEU  44  45.940   2.927   3.589
  325   HD13  LEU  44          HD13      LEU  44  46.895   3.150   2.121
  326   HD21  LEU  44          HD21      LEU  44  47.829   3.344   5.559
  327   HD22  LEU  44          HD22      LEU  44  49.398   3.442   4.762
  328   HD23  LEU  44          HD23      LEU  44  48.936   1.972   5.623
  329    H    ASP  45           H        ASP  45  47.385  -2.281   3.435
  330    HA   ASP  45           HA       ASP  45  50.092  -2.492   2.536
  331    HB2  ASP  45           HB2      ASP  45  49.338  -3.719   4.497
  332    HB3  ASP  45           HB3      ASP  45  48.131  -4.566   3.539
  333    H    THR  46           H        THR  46  46.966  -3.208   1.172
  334    HA   THR  46           HA       THR  46  48.190  -4.822  -0.911
  335    HB   THR  46           HB       THR  46  45.767  -5.180  -1.593
  336    HG1  THR  46           HG1      THR  46  44.615  -3.628  -0.666
  337   HG21  THR  46          HG21      THR  46  47.137  -6.695  -0.055
  338   HG22  THR  46          HG22      THR  46  45.379  -6.849  -0.029
  339   HG23  THR  46          HG23      THR  46  46.208  -5.970   1.258
  340    H    ILE  47           H        ILE  47  46.657  -1.644  -0.597
  341    HA   ILE  47           HA       ILE  47  45.930  -1.336  -3.272
  342    HB   ILE  47           HB       ILE  47  46.153   1.190  -2.807
  343   HG12  ILE  47          HG12      ILE  47  46.722   0.052  -0.071
  344   HG13  ILE  47          HG13      ILE  47  47.704   1.188  -0.992
  345   HG21  ILE  47          HG21      ILE  47  44.066  -0.281  -2.669
  346   HG22  ILE  47          HG22      ILE  47  44.042   1.263  -1.819
  347   HG23  ILE  47          HG23      ILE  47  44.305  -0.226  -0.920
  348   HD11  ILE  47          HD11      ILE  47  44.961   2.058  -0.384
  349   HD12  ILE  47          HD12      ILE  47  46.476   2.960  -0.353
  350   HD13  ILE  47          HD13      ILE  47  46.052   1.903   0.994
  351    H    GLN  48           H        GLN  48  49.081  -0.910  -1.824
  352    HA   GLN  48           HA       GLN  48  50.317  -0.886  -4.379
  353    HB2  GLN  48           HB2      GLN  48  49.816   1.717  -3.116
  354    HB3  GLN  48           HB3      GLN  48  51.501   1.454  -3.536
  355    HG2  GLN  48           HG2      GLN  48  51.069   1.967  -5.639
  356    HG3  GLN  48           HG3      GLN  48  49.913   0.640  -5.743
  357   HE21  GLN  48          HE21      GLN  48  48.017   1.248  -6.430
  358   HE22  GLN  48          HE22      GLN  48  47.249   2.772  -6.121
  359    H    TYR  49           H        TYR  49  50.633  -0.177  -0.939
  360    HA   TYR  49           HA       TYR  49  53.453  -0.697  -0.893
  361    HD1  TYR  49           HD1      TYR  49  54.429   1.363  -0.032
  362    HD2  TYR  49           HD2      TYR  49  50.426   1.617   1.391
  363    HE1  TYR  49           HE1      TYR  49  54.466   3.795  -0.373
  364    HE2  TYR  49           HE2      TYR  49  50.455   4.053   1.052
  365    HH   TYR  49           HH       TYR  49  52.821   5.860   0.929
  366    HB2  TYR  49           HB2      TYR  49  51.467  -0.436   1.378
  367    HB3  TYR  49           HB3      TYR  49  53.222  -0.441   1.549
  368    H    SER  50           H        SER  50  53.604  -2.169   1.531
  369    HA   SER  50           HA       SER  50  52.278  -4.632   1.513
  370    HG   SER  50           HG       SER  50  55.032  -3.992  -0.986
  371    HB2  SER  50           HB2      SER  50  54.205  -6.055   0.665
  372    HB3  SER  50           HB3      SER  50  53.317  -5.167  -0.572
  373    H    LYS  51           H        LYS  51  53.083  -2.784   3.434
  374    HA   LYS  51           HA       LYS  51  54.970  -4.383   5.021
  375    HB2  LYS  51           HB2      LYS  51  56.072  -2.424   3.845
  376    HB3  LYS  51           HB3      LYS  51  55.068  -1.369   4.829
  377    HG2  LYS  51           HG2      LYS  51  56.112  -2.259   6.850
  378    HG3  LYS  51           HG3      LYS  51  57.116  -3.324   5.862
  379    HD2  LYS  51           HD2      LYS  51  58.350  -1.329   6.530
  380    HD3  LYS  51           HD3      LYS  51  58.117  -1.372   4.780
  381    HE2  LYS  51           HE2      LYS  51  56.188   0.154   5.041
  382    HE3  LYS  51           HE3      LYS  51  56.526   0.243   6.770
  383    HZ1  LYS  51           HZ1      LYS  51  57.652   2.064   6.074
  384    HZ2  LYS  51           HZ2      LYS  51  57.963   1.441   4.525
  385    HZ3  LYS  51           HZ3      LYS  51  58.889   0.927   5.851
  386    H    HIS  52           H        HIS  52  51.995  -3.669   4.904
  387    HA   HIS  52           HA       HIS  52  50.263  -3.387   6.341
  388    HD1  HIS  52           HD1      HIS  52  49.121  -5.572   7.077
  389    HD2  HIS  52           HD2      HIS  52  53.062  -6.612   7.901
  390    HE1  HIS  52           HE1      HIS  52  49.322  -8.043   6.588
  391    HB2  HIS  52           HB2      HIS  52  52.403  -4.068   8.358
  392    HB3  HIS  52           HB3      HIS  52  50.700  -3.895   8.770
  Start of MODEL   17
    1    H1   GLY   1           1H       GLY   1  18.528   5.624  -4.546
    2    H2   GLY   1           2H       GLY   1  19.836   4.946  -3.713
    3    H3   GLY   1           3H       GLY   1  20.046   5.512  -5.297
    4    HA2  GLY   1           HA2      GLY   1  19.979   7.722  -4.687
    5    HA3  GLY   1           HA3      GLY   1  19.142   7.353  -3.185
    6    H    SER   2           H        SER   2  20.603   5.554  -1.917
    7    HA   SER   2           HA       SER   2  23.033   6.991  -1.276
    8    HG   SER   2           HG       SER   2  21.361   4.002  -0.888
    9    HB2  SER   2           HB2      SER   2  23.181   5.103   0.490
   10    HB3  SER   2           HB3      SER   2  21.874   6.280   0.643
   11    HA   PRO   3           HA       PRO   3  25.192   4.170  -3.991
   12    HB2  PRO   3           HB2      PRO   3  27.398   5.663  -4.341
   13    HB3  PRO   3           HB3      PRO   3  25.856   6.082  -5.095
   14    HG2  PRO   3           HG2      PRO   3  27.185   7.267  -2.706
   15    HG3  PRO   3           HG3      PRO   3  26.209   8.058  -3.956
   16    HD2  PRO   3           HD2      PRO   3  25.317   7.311  -1.421
   17    HD3  PRO   3           HD3      PRO   3  24.280   7.692  -2.809
   18    HA   PRO   4           HA       PRO   4  27.932   2.105  -1.118
   19    HB2  PRO   4           HB2      PRO   4  28.752   0.350  -3.245
   20    HB3  PRO   4           HB3      PRO   4  27.634   0.012  -1.923
   21    HG2  PRO   4           HG2      PRO   4  26.895   0.174  -4.564
   22    HG3  PRO   4           HG3      PRO   4  25.797   0.460  -3.202
   23    HD2  PRO   4           HD2      PRO   4  27.237   2.443  -4.929
   24    HD3  PRO   4           HD3      PRO   4  25.574   2.494  -4.298
   25    H    GLU   5           H        GLU   5  28.935   4.465  -2.261
   26    HA   GLU   5           HA       GLU   5  31.756   3.933  -2.233
   27    HB2  GLU   5           HB2      GLU   5  30.959   3.539  -4.659
   28    HB3  GLU   5           HB3      GLU   5  30.683   5.273  -4.719
   29    HG2  GLU   5           HG2      GLU   5  33.071   5.624  -4.167
   30    HG3  GLU   5           HG3      GLU   5  33.308   3.878  -4.259
   31    H    ALA   6           H        ALA   6  29.601   5.379  -0.879
   32    HA   ALA   6           HA       ALA   6  30.891   7.812  -0.250
   33    HB1  ALA   6           HB1      ALA   6  30.045   9.234  -1.762
   34    HB2  ALA   6           HB2      ALA   6  28.430   8.861  -1.153
   35    HB3  ALA   6           HB3      ALA   6  29.101   7.938  -2.499
   36    H    ASP   7           H        ASP   7  30.047   5.627   1.071
   37    HA   ASP   7           HA       ASP   7  27.531   6.292   2.408
   38    HB2  ASP   7           HB2      ASP   7  27.764   4.021   1.501
   39    HB3  ASP   7           HB3      ASP   7  29.276   3.803   2.369
   40    HA   PRO   8           HA       PRO   8  29.463   7.988   6.041
   41    HB2  PRO   8           HB2      PRO   8  28.050   5.811   7.529
   42    HB3  PRO   8           HB3      PRO   8  28.150   7.538   7.893
   43    HG2  PRO   8           HG2      PRO   8  25.954   6.507   6.787
   44    HG3  PRO   8           HG3      PRO   8  26.556   8.105   6.305
   45    HD2  PRO   8           HD2      PRO   8  26.643   5.525   4.832
   46    HD3  PRO   8           HD3      PRO   8  26.586   7.185   4.209
   47    H    ARG   9           H        ARG   9  29.580   4.534   5.455
   48    HA   ARG   9           HA       ARG   9  31.891   4.171   7.208
   49    HE   ARG   9           HE       ARG   9  31.101  -0.585   7.434
   50    HB2  ARG   9           HB2      ARG   9  30.309   2.239   5.510
   51    HB3  ARG   9           HB3      ARG   9  31.683   1.779   6.528
   52    HG2  ARG   9           HG2      ARG   9  30.395   2.762   8.477
   53    HG3  ARG   9           HG3      ARG   9  29.000   2.824   7.397
   54    HD2  ARG   9           HD2      ARG   9  29.020   0.792   8.786
   55    HD3  ARG   9           HD3      ARG   9  29.099   0.429   7.062
   56   HH11  ARG   9          HH11      ARG   9  30.506   1.589  10.120
   57   HH12  ARG   9          HH12      ARG   9  31.951   1.124  10.970
   58   HH21  ARG   9          HH21      ARG   9  33.007  -1.180   8.565
   59   HH22  ARG   9          HH22      ARG   9  33.366  -0.414  10.082
   60    H    LEU  10           H        LEU  10  31.099   4.218   3.769
   61    HA   LEU  10           HA       LEU  10  33.755   3.371   3.030
   62    HG   LEU  10           HG       LEU  10  31.199   1.925   2.537
   63    HB2  LEU  10           HB2      LEU  10  31.345   4.141   1.396
   64    HB3  LEU  10           HB3      LEU  10  32.877   3.641   0.701
   65   HD11  LEU  10          HD11      LEU  10  31.585   1.311  -0.339
   66   HD12  LEU  10          HD12      LEU  10  30.396   2.538   0.101
   67   HD13  LEU  10          HD13      LEU  10  30.253   0.901   0.741
   68   HD21  LEU  10          HD21      LEU  10  33.799   1.672   2.274
   69   HD22  LEU  10          HD22      LEU  10  33.350   0.911   0.747
   70   HD23  LEU  10          HD23      LEU  10  32.745   0.257   2.270
   71    H    ILE  11           H        ILE  11  32.098   6.270   3.613
   72    HA   ILE  11           HA       ILE  11  33.680   8.059   2.047
   73    HB   ILE  11           HB       ILE  11  31.643   8.245   4.129
   74   HG12  ILE  11          HG12      ILE  11  31.408   8.941   1.757
   75   HG13  ILE  11          HG13      ILE  11  30.975  10.205   2.903
   76   HG21  ILE  11          HG21      ILE  11  33.754  10.391   4.188
   77   HG22  ILE  11          HG22      ILE  11  33.524   9.168   5.437
   78   HG23  ILE  11          HG23      ILE  11  32.253  10.348   5.113
   79   HD11  ILE  11          HD11      ILE  11  32.220  11.445   1.492
   80   HD12  ILE  11          HD12      ILE  11  33.199  10.075   0.968
   81   HD13  ILE  11          HD13      ILE  11  33.528  10.855   2.517
   82    H    GLU  12           H        GLU  12  34.092   6.253   4.935
   83    HA   GLU  12           HA       GLU  12  36.474   7.683   5.800
   84    HB2  GLU  12           HB2      GLU  12  35.337   5.074   6.817
   85    HB3  GLU  12           HB3      GLU  12  36.546   6.073   7.606
   86    HG2  GLU  12           HG2      GLU  12  33.767   7.057   7.039
   87    HG3  GLU  12           HG3      GLU  12  34.190   6.186   8.513
   88    H    SER  13           H        SER  13  35.619   4.516   4.460
   89    HA   SER  13           HA       SER  13  38.404   3.749   4.430
   90    HG   SER  13           HG       SER  13  34.962   2.475   4.693
   91    HB2  SER  13           HB2      SER  13  37.389   1.517   3.698
   92    HB3  SER  13           HB3      SER  13  36.980   2.105   5.311
   93    H    LEU  14           H        LEU  14  35.842   4.140   1.970
   94    HA   LEU  14           HA       LEU  14  37.730   3.366  -0.098
   95    HG   LEU  14           HG       LEU  14  36.606   2.057  -1.811
   96    HB2  LEU  14           HB2      LEU  14  35.163   2.748   0.142
   97    HB3  LEU  14           HB3      LEU  14  34.937   4.292  -0.652
   98   HD11  LEU  14          HD11      LEU  14  33.797   2.790  -2.591
   99   HD12  LEU  14          HD12      LEU  14  34.182   1.478  -1.477
  100   HD13  LEU  14          HD13      LEU  14  34.763   1.420  -3.142
  101   HD21  LEU  14          HD21      LEU  14  36.686   3.286  -3.780
  102   HD22  LEU  14          HD22      LEU  14  36.904   4.518  -2.537
  103   HD23  LEU  14          HD23      LEU  14  35.332   4.316  -3.312
  104    H    SER  15           H        SER  15  35.715   6.085   0.888
  105    HA   SER  15           HA       SER  15  36.627   7.793  -1.147
  106    HG   SER  15           HG       SER  15  33.966   8.561  -0.915
  107    HB2  SER  15           HB2      SER  15  35.378   8.532   1.496
  108    HB3  SER  15           HB3      SER  15  35.543   9.600   0.101
  109    H    GLN  16           H        GLN  16  38.101   6.685   1.657
  110    HA   GLN  16           HA       GLN  16  39.882   8.838   2.246
  111    HB2  GLN  16           HB2      GLN  16  39.526   6.856   3.735
  112    HB3  GLN  16           HB3      GLN  16  40.306   5.844   2.536
  113    HG2  GLN  16           HG2      GLN  16  41.708   8.151   3.865
  114    HG3  GLN  16           HG3      GLN  16  41.683   6.529   4.550
  115   HE21  GLN  16          HE21      GLN  16  42.662   4.821   3.321
  116   HE22  GLN  16          HE22      GLN  16  43.937   5.170   2.200
  117    H    MET  17           H        MET  17  40.457   5.769   0.576
  118    HA   MET  17           HA       MET  17  42.833   6.541  -0.660
  119    HB2  MET  17           HB2      MET  17  40.850   4.365  -1.328
  120    HB3  MET  17           HB3      MET  17  42.444   4.503  -2.060
  121    HG2  MET  17           HG2      MET  17  43.491   4.243   0.114
  122    HG3  MET  17           HG3      MET  17  41.909   4.166   0.884
  123    HE1  MET  17           HE1      MET  17  40.204   2.432   0.521
  124    HE2  MET  17           HE2      MET  17  40.475   0.811  -0.121
  125    HE3  MET  17           HE3      MET  17  40.254   2.170  -1.223
  126    H    LEU  18           H        LEU  18  39.476   6.632  -1.805
  127    HA   LEU  18           HA       LEU  18  40.031   7.144  -4.496
  128    HG   LEU  18           HG       LEU  18  37.686   9.009  -5.233
  129    HB2  LEU  18           HB2      LEU  18  37.824   6.515  -3.530
  130    HB3  LEU  18           HB3      LEU  18  37.663   8.154  -2.931
  131   HD11  LEU  18          HD11      LEU  18  38.461   6.247  -5.801
  132   HD12  LEU  18          HD12      LEU  18  38.747   7.724  -6.725
  133   HD13  LEU  18          HD13      LEU  18  37.204   6.883  -6.862
  134   HD21  LEU  18          HD21      LEU  18  35.675   7.234  -4.117
  135   HD22  LEU  18          HD22      LEU  18  35.589   7.349  -5.874
  136   HD23  LEU  18          HD23      LEU  18  35.493   8.811  -4.888
  137    H    SER  19           H        SER  19  39.884   9.361  -1.764
  138    HA   SER  19           HA       SER  19  40.136  11.644  -3.555
  139    HG   SER  19           HG       SER  19  40.279  13.627  -0.751
  140    HB2  SER  19           HB2      SER  19  38.540  11.738  -1.660
  141    HB3  SER  19           HB3      SER  19  39.889  11.578  -0.536
  142    H    MET  20           H        MET  20  42.219   9.541  -1.971
  143    HA   MET  20           HA       MET  20  44.273  11.600  -1.597
  144    HB2  MET  20           HB2      MET  20  43.846  10.071   0.290
  145    HB3  MET  20           HB3      MET  20  44.271   8.703  -0.729
  146    HG2  MET  20           HG2      MET  20  46.091   9.331   0.768
  147    HG3  MET  20           HG3      MET  20  46.544   9.510  -0.926
  148    HE1  MET  20           HE1      MET  20  45.949  11.994   2.480
  149    HE2  MET  20           HE2      MET  20  44.558  11.284   1.661
  150    HE3  MET  20           HE3      MET  20  44.927  12.997   1.450
  151    H    GLY  21           H        GLY  21  43.543   8.744  -3.498
  152    HA2  GLY  21           HA2      GLY  21  44.548   8.672  -5.749
  153    HA3  GLY  21           HA3      GLY  21  46.052   9.203  -4.998
  154    H    PHE  22           H        PHE  22  43.847   6.857  -3.655
  155    HA   PHE  22           HA       PHE  22  45.762   4.700  -4.216
  156    HD1  PHE  22           HD1      PHE  22  46.074   7.214  -2.146
  157    HD2  PHE  22           HD2      PHE  22  46.696   3.230  -0.790
  158    HE1  PHE  22           HE1      PHE  22  48.146   7.921  -1.026
  159    HE2  PHE  22           HE2      PHE  22  48.769   3.929   0.328
  160    HZ   PHE  22           HZ       PHE  22  49.496   6.275   0.213
  161    HB2  PHE  22           HB2      PHE  22  44.150   5.222  -1.705
  162    HB3  PHE  22           HB3      PHE  22  44.874   3.660  -2.064
  163    H    SER  23           H        SER  23  44.813   2.844  -5.010
  164    HA   SER  23           HA       SER  23  41.886   2.883  -5.196
  165    HG   SER  23           HG       SER  23  43.129   4.251  -8.285
  166    HB2  SER  23           HB2      SER  23  43.809   2.368  -7.481
  167    HB3  SER  23           HB3      SER  23  42.064   2.140  -7.572
  168    H    ASP  24           H        ASP  24  42.771   0.565  -7.233
  169    HA   ASP  24           HA       ASP  24  43.254  -1.466  -5.176
  170    HB2  ASP  24           HB2      ASP  24  42.011  -3.083  -6.661
  171    HB3  ASP  24           HB3      ASP  24  41.005  -1.862  -5.885
  172    H    GLU  25           H        GLU  25  44.885  -2.854  -5.591
  173    HA   GLU  25           HA       GLU  25  46.773  -2.113  -7.555
  174    HB2  GLU  25           HB2      GLU  25  47.114  -3.353  -5.268
  175    HB3  GLU  25           HB3      GLU  25  46.875  -4.801  -6.238
  176    HG2  GLU  25           HG2      GLU  25  48.739  -4.058  -7.701
  177    HG3  GLU  25           HG3      GLU  25  49.013  -2.712  -6.596
  178    H    GLY  26           H        GLY  26  44.431  -4.692  -7.361
  179    HA2  GLY  26           HA2      GLY  26  44.775  -5.148 -10.238
  180    HA3  GLY  26           HA3      GLY  26  44.932  -6.525  -9.154
  181    H    GLY  27           H        GLY  27  42.653  -4.575  -7.770
  182    HA2  GLY  27           HA2      GLY  27  40.322  -4.330  -8.623
  183    HA3  GLY  27           HA3      GLY  27  40.487  -5.985  -9.193
  184    H    TRP  28           H        TRP  28  41.801  -4.961  -6.138
  185    HA   TRP  28           HA       TRP  28  39.996  -6.818  -4.818
  186    HD1  TRP  28           HD1      TRP  28  44.453  -5.933  -5.076
  187    HE1  TRP  28           HE1      TRP  28  45.647  -3.790  -4.302
  188    HE3  TRP  28           HE3      TRP  28  40.912  -4.122  -1.866
  189    HZ2  TRP  28           HZ2      TRP  28  45.132  -1.609  -2.595
  190    HZ3  TRP  28           HZ3      TRP  28  41.341  -1.999  -0.709
  191    HH2  TRP  28           HH2      TRP  28  43.413  -0.770  -1.070
  192    HB2  TRP  28           HB2      TRP  28  41.549  -6.642  -2.887
  193    HB3  TRP  28           HB3      TRP  28  42.338  -7.200  -4.363
  194    H    LEU  29           H        LEU  29  40.190  -3.498  -5.324
  195    HA   LEU  29           HA       LEU  29  39.532  -2.557  -2.755
  196    HG   LEU  29           HG       LEU  29  37.393  -0.418  -4.130
  197    HB2  LEU  29           HB2      LEU  29  40.359  -0.951  -4.221
  198    HB3  LEU  29           HB3      LEU  29  39.261  -1.393  -5.508
  199   HD11  LEU  29          HD11      LEU  29  38.404   1.338  -2.449
  200   HD12  LEU  29          HD12      LEU  29  39.687   0.134  -2.325
  201   HD13  LEU  29          HD13      LEU  29  38.022  -0.308  -1.942
  202   HD21  LEU  29          HD21      LEU  29  37.736   1.266  -5.528
  203   HD22  LEU  29          HD22      LEU  29  39.459   0.902  -5.607
  204   HD23  LEU  29          HD23      LEU  29  38.842   1.972  -4.349
  205    H    THR  30           H        THR  30  37.728  -4.258  -5.031
  206    HA   THR  30           HA       THR  30  35.171  -3.598  -3.766
  207    HB   THR  30           HB       THR  30  34.858  -3.693  -6.077
  208    HG1  THR  30           HG1      THR  30  34.341  -6.312  -5.145
  209   HG21  THR  30          HG21      THR  30  36.749  -6.013  -6.112
  210   HG22  THR  30          HG22      THR  30  36.867  -4.470  -6.961
  211   HG23  THR  30          HG23      THR  30  35.663  -5.660  -7.458
  212    H    ARG  31           H        ARG  31  37.734  -5.828  -3.610
  213    HA   ARG  31           HA       ARG  31  36.126  -7.974  -2.441
  214    HE   ARG  31           HE       ARG  31  40.214 -10.591  -3.978
  215    HB2  ARG  31           HB2      ARG  31  39.108  -7.989  -2.855
  216    HB3  ARG  31           HB3      ARG  31  38.025  -9.364  -2.707
  217    HG2  ARG  31           HG2      ARG  31  37.073  -8.886  -4.887
  218    HG3  ARG  31           HG3      ARG  31  38.067  -7.440  -5.028
  219    HD2  ARG  31           HD2      ARG  31  38.888  -9.516  -6.245
  220    HD3  ARG  31           HD3      ARG  31  40.050  -8.690  -5.211
  221   HH11  ARG  31          HH11      ARG  31  37.142 -10.678  -5.657
  222   HH12  ARG  31          HH12      ARG  31  36.746 -12.283  -5.112
  223   HH21  ARG  31          HH21      ARG  31  39.711 -12.689  -3.276
  224   HH22  ARG  31          HH22      ARG  31  38.214 -13.429  -3.756
  225    H    LEU  32           H        LEU  32  39.228  -6.528  -1.682
  226    HA   LEU  32           HA       LEU  32  39.727  -7.496   0.761
  227    HG   LEU  32           HG       LEU  32  42.682  -5.272   0.801
  228    HB2  LEU  32           HB2      LEU  32  41.127  -6.030  -0.774
  229    HB3  LEU  32           HB3      LEU  32  40.366  -4.652  -0.007
  230   HD11  LEU  32          HD11      LEU  32  41.713  -5.260   3.318
  231   HD12  LEU  32          HD12      LEU  32  40.314  -4.679   2.418
  232   HD13  LEU  32          HD13      LEU  32  41.856  -3.830   2.293
  233   HD21  LEU  32          HD21      LEU  32  43.135  -7.261   1.664
  234   HD22  LEU  32          HD22      LEU  32  41.573  -7.794   1.037
  235   HD23  LEU  32          HD23      LEU  32  41.706  -7.216   2.698
  236    H    LEU  33           H        LEU  33  38.679  -4.101   0.566
  237    HA   LEU  33           HA       LEU  33  38.189  -3.728   3.217
  238    HG   LEU  33           HG       LEU  33  39.086  -1.538   2.558
  239    HB2  LEU  33           HB2      LEU  33  36.770  -2.470   0.868
  240    HB3  LEU  33           HB3      LEU  33  36.555  -1.928   2.523
  241   HD11  LEU  33          HD11      LEU  33  39.742  -0.912   0.068
  242   HD12  LEU  33          HD12      LEU  33  38.646  -2.245  -0.287
  243   HD13  LEU  33          HD13      LEU  33  40.053  -2.511   0.745
  244   HD21  LEU  33          HD21      LEU  33  38.742   0.643   2.012
  245   HD22  LEU  33          HD22      LEU  33  37.065   0.108   2.147
  246   HD23  LEU  33          HD23      LEU  33  37.821   0.250   0.560
  247    H    GLN  34           H        GLN  34  35.773  -4.610   0.807
  248    HA   GLN  34           HA       GLN  34  33.509  -4.724   2.337
  249    HB2  GLN  34           HB2      GLN  34  34.473  -6.244  -0.025
  250    HB3  GLN  34           HB3      GLN  34  32.911  -6.652   0.677
  251    HG2  GLN  34           HG2      GLN  34  32.692  -5.124  -1.212
  252    HG3  GLN  34           HG3      GLN  34  32.134  -4.379   0.285
  253   HE21  GLN  34          HE21      GLN  34  32.634  -2.319   0.315
  254   HE22  GLN  34          HE22      GLN  34  34.111  -1.614  -0.244
  255    H    THR  35           H        THR  35  35.993  -7.222   2.045
  256    HA   THR  35           HA       THR  35  34.466  -9.076   3.654
  257    HB   THR  35           HB       THR  35  37.333  -9.381   2.745
  258    HG1  THR  35           HG1      THR  35  36.286  -8.965   0.872
  259   HG21  THR  35          HG21      THR  35  36.943 -11.713   2.742
  260   HG22  THR  35          HG22      THR  35  35.215 -11.494   3.020
  261   HG23  THR  35          HG23      THR  35  36.371 -11.102   4.295
  262    H    LYS  36           H        LYS  36  36.421  -6.468   4.318
  263    HA   LYS  36           HA       LYS  36  37.151  -7.561   6.953
  264    HB2  LYS  36           HB2      LYS  36  38.733  -5.625   5.259
  265    HB3  LYS  36           HB3      LYS  36  39.144  -6.101   6.900
  266    HG2  LYS  36           HG2      LYS  36  39.333  -8.447   6.129
  267    HG3  LYS  36           HG3      LYS  36  39.045  -7.890   4.477
  268    HD2  LYS  36           HD2      LYS  36  41.042  -6.560   4.519
  269    HD3  LYS  36           HD3      LYS  36  41.285  -6.905   6.233
  270    HE2  LYS  36           HE2      LYS  36  41.495  -9.325   5.637
  271    HE3  LYS  36           HE3      LYS  36  41.423  -8.864   3.939
  272    HZ1  LYS  36           HZ1      LYS  36  43.453  -7.596   4.205
  273    HZ2  LYS  36           HZ2      LYS  36  43.707  -9.189   4.739
  274    HZ3  LYS  36           HZ3      LYS  36  43.494  -7.942   5.868
  275    H    ASN  37           H        ASN  37  34.738  -6.246   6.434
  276    HA   ASN  37           HA       ASN  37  33.347  -4.650   7.163
  277    HB2  ASN  37           HB2      ASN  37  33.552  -3.881   9.396
  278    HB3  ASN  37           HB3      ASN  37  34.252  -5.492   9.352
  279   HD21  ASN  37          HD21      ASN  37  36.193  -5.752  10.214
  280   HD22  ASN  37          HD22      ASN  37  37.281  -4.480  10.655
  281    H    TYR  38           H        TYR  38  35.492  -3.864   5.310
  282    HA   TYR  38           HA       TYR  38  35.959  -2.032   4.065
  283    HD1  TYR  38           HD1      TYR  38  34.159  -2.422   2.820
  284    HD2  TYR  38           HD2      TYR  38  31.945  -0.435   5.857
  285    HE1  TYR  38           HE1      TYR  38  32.075  -3.345   1.900
  286    HE2  TYR  38           HE2      TYR  38  29.856  -1.353   4.947
  287    HH   TYR  38           HH       TYR  38  29.587  -3.848   3.155
  288    HB2  TYR  38           HB2      TYR  38  34.254  -0.402   5.958
  289    HB3  TYR  38           HB3      TYR  38  34.766   0.050   4.339
  290    H    ASP  39           H        ASP  39  38.073  -2.486   5.045
  291    HA   ASP  39           HA       ASP  39  38.828  -0.307   6.886
  292    HB2  ASP  39           HB2      ASP  39  40.659  -1.710   7.709
  293    HB3  ASP  39           HB3      ASP  39  39.088  -2.465   7.952
  294    H    ILE  40           H        ILE  40  40.623   0.893   6.587
  295    HA   ILE  40           HA       ILE  40  41.842   0.785   3.934
  296    HB   ILE  40           HB       ILE  40  43.004   2.918   4.690
  297   HG12  ILE  40          HG12      ILE  40  42.297   2.414   7.163
  298   HG13  ILE  40          HG13      ILE  40  42.352   4.073   6.582
  299   HG21  ILE  40          HG21      ILE  40  40.700   4.201   4.521
  300   HG22  ILE  40          HG22      ILE  40  40.124   2.594   4.082
  301   HG23  ILE  40          HG23      ILE  40  41.405   3.357   3.140
  302   HD11  ILE  40          HD11      ILE  40  39.790   3.439   6.023
  303   HD12  ILE  40          HD12      ILE  40  40.323   4.188   7.529
  304   HD13  ILE  40          HD13      ILE  40  40.072   2.444   7.450
  305    H    GLY  41           H        GLY  41  42.376  -0.042   7.191
  306    HA2  GLY  41           HA2      GLY  41  45.140   0.213   7.387
  307    HA3  GLY  41           HA3      GLY  41  44.172  -0.906   8.322
  308    H    ALA  42           H        ALA  42  43.194  -2.400   6.173
  309    HA   ALA  42           HA       ALA  42  45.603  -3.892   5.446
  310    HB1  ALA  42           HB1      ALA  42  42.707  -4.720   5.284
  311    HB2  ALA  42           HB2      ALA  42  43.838  -5.158   6.565
  312    HB3  ALA  42           HB3      ALA  42  44.100  -5.741   4.920
  313    H    ALA  43           H        ALA  43  43.470  -1.651   4.186
  314    HA   ALA  43           HA       ALA  43  43.417  -2.542   1.462
  315    HB1  ALA  43           HB1      ALA  43  43.024   0.308   2.300
  316    HB2  ALA  43           HB2      ALA  43  41.795  -0.918   2.618
  317    HB3  ALA  43           HB3      ALA  43  42.288  -0.571   0.960
  318    H    LEU  44           H        LEU  44  45.298  -0.090   3.246
  319    HA   LEU  44           HA       LEU  44  46.877   0.781   1.085
  320    HG   LEU  44           HG       LEU  44  47.414   3.022   1.980
  321    HB2  LEU  44           HB2      LEU  44  47.165   0.831   4.049
  322    HB3  LEU  44           HB3      LEU  44  48.595   1.151   3.081
  323   HD11  LEU  44          HD11      LEU  44  45.335   3.721   3.530
  324   HD12  LEU  44          HD12      LEU  44  45.160   1.965   3.544
  325   HD13  LEU  44          HD13      LEU  44  45.175   2.838   2.011
  326   HD21  LEU  44          HD21      LEU  44  48.196   4.377   3.556
  327   HD22  LEU  44          HD22      LEU  44  48.508   2.930   4.512
  328   HD23  LEU  44          HD23      LEU  44  47.002   3.823   4.729
  329    H    ASP  45           H        ASP  45  47.106  -1.964   3.196
  330    HA   ASP  45           HA       ASP  45  49.674  -2.930   2.669
  331    HB2  ASP  45           HB2      ASP  45  48.291  -3.887   4.401
  332    HB3  ASP  45           HB3      ASP  45  47.060  -4.346   3.234
  333    H    THR  46           H        THR  46  46.624  -3.476   0.953
  334    HA   THR  46           HA       THR  46  47.888  -5.264  -0.878
  335    HB   THR  46           HB       THR  46  45.454  -5.111  -1.888
  336    HG1  THR  46           HG1      THR  46  44.739  -3.359  -0.684
  337   HG21  THR  46          HG21      THR  46  46.657  -6.831  -0.165
  338   HG22  THR  46          HG22      THR  46  45.028  -7.015  -0.818
  339   HG23  THR  46          HG23      THR  46  45.265  -6.289   0.772
  340    H    ILE  47           H        ILE  47  47.727  -1.873  -0.984
  341    HA   ILE  47           HA       ILE  47  47.726  -1.984  -3.940
  342    HB   ILE  47           HB       ILE  47  47.731   0.689  -3.403
  343   HG12  ILE  47          HG12      ILE  47  46.081  -0.677  -1.279
  344   HG13  ILE  47          HG13      ILE  47  47.382   0.489  -1.053
  345   HG21  ILE  47          HG21      ILE  47  46.208   0.342  -4.980
  346   HG22  ILE  47          HG22      ILE  47  45.045   0.162  -3.664
  347   HG23  ILE  47          HG23      ILE  47  45.811  -1.264  -4.371
  348   HD11  ILE  47          HD11      ILE  47  46.053   2.266  -1.829
  349   HD12  ILE  47          HD12      ILE  47  45.033   1.336  -0.730
  350   HD13  ILE  47          HD13      ILE  47  44.833   1.168  -2.474
  351    H    GLN  48           H        GLN  48  49.664  -1.107  -1.170
  352    HA   GLN  48           HA       GLN  48  51.971  -0.745  -2.898
  353    HB2  GLN  48           HB2      GLN  48  50.808   1.505  -1.260
  354    HB3  GLN  48           HB3      GLN  48  52.516   1.459  -1.666
  355    HG2  GLN  48           HG2      GLN  48  52.053   2.450  -3.582
  356    HG3  GLN  48           HG3      GLN  48  51.123   1.033  -4.067
  357   HE21  GLN  48          HE21      GLN  48  49.112   1.416  -4.627
  358   HE22  GLN  48          HE22      GLN  48  48.122   2.735  -4.087
  359    H    TYR  49           H        TYR  49  50.698  -0.514   0.398
  360    HA   TYR  49           HA       TYR  49  53.299  -0.933   1.551
  361    HD1  TYR  49           HD1      TYR  49  50.337   1.175   1.094
  362    HD2  TYR  49           HD2      TYR  49  53.052   1.165   4.372
  363    HE1  TYR  49           HE1      TYR  49  50.457   3.628   0.995
  364    HE2  TYR  49           HE2      TYR  49  53.177   3.617   4.280
  365    HH   TYR  49           HH       TYR  49  51.960   5.433   1.668
  366    HB2  TYR  49           HB2      TYR  49  50.567  -0.796   2.851
  367    HB3  TYR  49           HB3      TYR  49  52.097  -0.836   3.720
  368    H    SER  50           H        SER  50  52.911  -3.095  -0.002
  369    HA   SER  50           HA       SER  50  51.808  -5.261   1.548
  370    HG   SER  50           HG       SER  50  52.915  -4.759  -2.169
  371    HB2  SER  50           HB2      SER  50  52.729  -6.660  -0.375
  372    HB3  SER  50           HB3      SER  50  51.496  -5.471  -0.798
  373    H    LYS  51           H        LYS  51  54.436  -3.551   1.887
  374    HA   LYS  51           HA       LYS  51  55.988  -5.784   2.999
  375    HB2  LYS  51           HB2      LYS  51  57.289  -4.755   1.210
  376    HB3  LYS  51           HB3      LYS  51  56.997  -3.153   1.874
  377    HG2  LYS  51           HG2      LYS  51  58.286  -3.780   3.879
  378    HG3  LYS  51           HG3      LYS  51  58.626  -5.347   3.142
  379    HD2  LYS  51           HD2      LYS  51  59.834  -4.295   1.341
  380    HD3  LYS  51           HD3      LYS  51  59.367  -2.692   1.913
  381    HE2  LYS  51           HE2      LYS  51  61.683  -3.281   2.521
  382    HE3  LYS  51           HE3      LYS  51  60.663  -2.986   3.929
  383    HZ1  LYS  51           HZ1      LYS  51  62.142  -4.969   4.103
  384    HZ2  LYS  51           HZ2      LYS  51  61.238  -5.701   2.866
  385    HZ3  LYS  51           HZ3      LYS  51  60.492  -5.306   4.343
  386    H    HIS  52           H        HIS  52  56.032  -5.715   5.175
  387    HA   HIS  52           HA       HIS  52  54.981  -3.291   6.414
  388    HD1  HIS  52           HD1      HIS  52  52.577  -3.820   6.100
  389    HD2  HIS  52           HD2      HIS  52  53.500  -7.816   6.775
  390    HE1  HIS  52           HE1      HIS  52  50.731  -5.164   5.014
  391    HB2  HIS  52           HB2      HIS  52  55.295  -6.040   7.640
  392    HB3  HIS  52           HB3      HIS  52  54.393  -4.686   8.311
  Start of MODEL   18
    1    H1   GLY   1           1H       GLY   1  19.218   7.372   1.303
    2    H2   GLY   1           2H       GLY   1  20.359   7.905   2.437
    3    H3   GLY   1           3H       GLY   1  19.138   6.826   2.907
    4    HA2  GLY   1           HA2      GLY   1  20.942   5.429   2.687
    5    HA3  GLY   1           HA3      GLY   1  20.122   5.274   1.139
    6    H    SER   2           H        SER   2  22.991   4.967   1.948
    7    HA   SER   2           HA       SER   2  24.178   7.083   0.288
    8    HG   SER   2           HG       SER   2  25.607   7.979   2.545
    9    HB2  SER   2           HB2      SER   2  25.449   5.221   2.306
   10    HB3  SER   2           HB3      SER   2  26.332   6.399   1.335
   11    HA   PRO   3           HA       PRO   3  25.111   4.157  -2.892
   12    HB2  PRO   3           HB2      PRO   3  27.364   5.754  -3.754
   13    HB3  PRO   3           HB3      PRO   3  25.774   5.605  -4.503
   14    HG2  PRO   3           HG2      PRO   3  26.688   7.890  -3.301
   15    HG3  PRO   3           HG3      PRO   3  24.974   7.473  -3.463
   16    HD2  PRO   3           HD2      PRO   3  26.773   7.210  -1.089
   17    HD3  PRO   3           HD3      PRO   3  25.065   7.695  -1.166
   18    HA   PRO   4           HA       PRO   4  28.578   1.758  -1.477
   19    HB2  PRO   4           HB2      PRO   4  29.010   0.192  -3.638
   20    HB3  PRO   4           HB3      PRO   4  27.611  -0.016  -2.582
   21    HG2  PRO   4           HG2      PRO   4  27.796   1.310  -5.252
   22    HG3  PRO   4           HG3      PRO   4  26.504   0.286  -4.597
   23    HD2  PRO   4           HD2      PRO   4  26.416   3.036  -4.700
   24    HD3  PRO   4           HD3      PRO   4  25.489   2.050  -3.551
   25    H    GLU   5           H        GLU   5  28.977   4.356  -3.059
   26    HA   GLU   5           HA       GLU   5  31.843   3.957  -3.461
   27    HB2  GLU   5           HB2      GLU   5  30.046   5.415  -5.414
   28    HB3  GLU   5           HB3      GLU   5  31.793   5.581  -5.397
   29    HG2  GLU   5           HG2      GLU   5  31.455   4.055  -7.078
   30    HG3  GLU   5           HG3      GLU   5  31.791   3.010  -5.699
   31    H    ALA   6           H        ALA   6  29.671   5.224  -1.660
   32    HA   ALA   6           HA       ALA   6  31.212   7.463  -0.770
   33    HB1  ALA   6           HB1      ALA   6  30.239   9.135  -1.870
   34    HB2  ALA   6           HB2      ALA   6  28.672   8.644  -1.226
   35    HB3  ALA   6           HB3      ALA   6  29.241   7.983  -2.757
   36    H    ASP   7           H        ASP   7  30.605   5.275   0.523
   37    HA   ASP   7           HA       ASP   7  28.153   5.521   2.035
   38    HB2  ASP   7           HB2      ASP   7  30.046   3.451   1.435
   39    HB3  ASP   7           HB3      ASP   7  29.948   3.622   3.183
   40    HA   PRO   8           HA       PRO   8  30.052   7.664   5.516
   41    HB2  PRO   8           HB2      PRO   8  28.902   6.271   7.598
   42    HB3  PRO   8           HB3      PRO   8  28.136   7.623   6.763
   43    HG2  PRO   8           HG2      PRO   8  27.625   4.714   6.514
   44    HG3  PRO   8           HG3      PRO   8  26.517   6.075   6.292
   45    HD2  PRO   8           HD2      PRO   8  27.658   4.609   4.241
   46    HD3  PRO   8           HD3      PRO   8  27.006   6.246   4.063
   47    H    ARG   9           H        ARG   9  30.179   4.370   4.798
   48    HA   ARG   9           HA       ARG   9  32.346   3.720   6.647
   49    HE   ARG   9           HE       ARG   9  28.990   1.251   4.408
   50    HB2  ARG   9           HB2      ARG   9  30.914   2.033   4.574
   51    HB3  ARG   9           HB3      ARG   9  32.084   1.441   5.755
   52    HG2  ARG   9           HG2      ARG   9  30.601   1.965   7.571
   53    HG3  ARG   9           HG3      ARG   9  29.466   2.748   6.473
   54    HD2  ARG   9           HD2      ARG   9  30.216  -0.175   6.423
   55    HD3  ARG   9           HD3      ARG   9  28.749   0.484   7.144
   56   HH11  ARG   9          HH11      ARG   9  28.054  -1.389   6.513
   57   HH12  ARG   9          HH12      ARG   9  27.074  -2.168   5.305
   58   HH21  ARG   9          HH21      ARG   9  27.657   0.264   2.843
   59   HH22  ARG   9          HH22      ARG   9  26.838  -1.225   3.232
   60    H    LEU  10           H        LEU  10  31.722   4.393   3.256
   61    HA   LEU  10           HA       LEU  10  34.402   3.578   2.525
   62    HG   LEU  10           HG       LEU  10  31.830   2.114   1.879
   63    HB2  LEU  10           HB2      LEU  10  32.022   4.355   0.850
   64    HB3  LEU  10           HB3      LEU  10  33.589   3.906   0.194
   65   HD11  LEU  10          HD11      LEU  10  32.258   2.345  -1.073
   66   HD12  LEU  10          HD12      LEU  10  30.747   2.244  -0.169
   67   HD13  LEU  10          HD13      LEU  10  31.776   0.820  -0.330
   68   HD21  LEU  10          HD21      LEU  10  33.970   0.920   0.301
   69   HD22  LEU  10          HD22      LEU  10  33.495   0.635   1.976
   70   HD23  LEU  10          HD23      LEU  10  34.552   1.989   1.579
   71    H    ILE  11           H        ILE  11  32.677   6.466   3.193
   72    HA   ILE  11           HA       ILE  11  34.424   8.246   1.740
   73    HB   ILE  11           HB       ILE  11  32.693   8.763   4.181
   74   HG12  ILE  11          HG12      ILE  11  31.426   8.140   2.153
   75   HG13  ILE  11          HG13      ILE  11  31.142   9.815   2.616
   76   HG21  ILE  11          HG21      ILE  11  33.369  11.052   2.514
   77   HG22  ILE  11          HG22      ILE  11  34.776  10.322   3.290
   78   HG23  ILE  11          HG23      ILE  11  33.415  10.872   4.269
   79   HD11  ILE  11          HD11      ILE  11  32.855  10.473   0.908
   80   HD12  ILE  11          HD12      ILE  11  31.372   9.767   0.263
   81   HD13  ILE  11          HD13      ILE  11  32.841   8.797   0.360
   82    H    GLU  12           H        GLU  12  34.619   6.222   4.409
   83    HA   GLU  12           HA       GLU  12  36.922   7.605   5.570
   84    HB2  GLU  12           HB2      GLU  12  35.277   6.691   7.132
   85    HB3  GLU  12           HB3      GLU  12  35.488   5.088   6.443
   86    HG2  GLU  12           HG2      GLU  12  37.825   5.088   7.197
   87    HG3  GLU  12           HG3      GLU  12  37.578   6.679   7.916
   88    H    SER  13           H        SER  13  36.103   4.352   4.347
   89    HA   SER  13           HA       SER  13  38.918   3.711   4.286
   90    HG   SER  13           HG       SER  13  38.798   1.296   3.059
   91    HB2  SER  13           HB2      SER  13  37.256   2.159   5.265
   92    HB3  SER  13           HB3      SER  13  36.540   1.944   3.668
   93    H    LEU  14           H        LEU  14  36.446   4.380   1.868
   94    HA   LEU  14           HA       LEU  14  38.184   3.341  -0.232
   95    HG   LEU  14           HG       LEU  14  37.145   3.420  -2.514
   96    HB2  LEU  14           HB2      LEU  14  35.766   2.809  -0.287
   97    HB3  LEU  14           HB3      LEU  14  35.399   4.518  -0.375
   98   HD11  LEU  14          HD11      LEU  14  35.243   2.558  -3.757
   99   HD12  LEU  14          HD12      LEU  14  34.173   2.901  -2.397
  100   HD13  LEU  14          HD13      LEU  14  35.431   1.676  -2.241
  101   HD21  LEU  14          HD21      LEU  14  35.507   5.725  -2.018
  102   HD22  LEU  14          HD22      LEU  14  34.963   4.910  -3.484
  103   HD23  LEU  14          HD23      LEU  14  36.642   5.427  -3.336
  104    H    SER  15           H        SER  15  36.561   6.294   0.784
  105    HA   SER  15           HA       SER  15  37.642   7.946  -1.172
  106    HG   SER  15           HG       SER  15  37.396  10.603   0.959
  107    HB2  SER  15           HB2      SER  15  35.690   8.598   0.168
  108    HB3  SER  15           HB3      SER  15  36.715   8.714   1.600
  109    H    GLN  16           H        GLN  16  38.932   6.784   1.825
  110    HA   GLN  16           HA       GLN  16  40.942   8.575   2.426
  111    HB2  GLN  16           HB2      GLN  16  40.355   6.564   3.768
  112    HB3  GLN  16           HB3      GLN  16  41.123   5.553   2.555
  113    HG2  GLN  16           HG2      GLN  16  42.748   7.709   3.783
  114    HG3  GLN  16           HG3      GLN  16  42.353   6.307   4.775
  115   HE21  GLN  16          HE21      GLN  16  42.349   4.933   1.917
  116   HE22  GLN  16          HE22      GLN  16  44.015   4.529   1.717
  117    H    MET  17           H        MET  17  40.972   5.957   0.048
  118    HA   MET  17           HA       MET  17  43.656   6.742  -0.767
  119    HB2  MET  17           HB2      MET  17  43.647   4.629  -2.037
  120    HB3  MET  17           HB3      MET  17  43.308   4.387  -0.330
  121    HG2  MET  17           HG2      MET  17  40.861   4.345  -0.943
  122    HG3  MET  17           HG3      MET  17  41.378   4.282  -2.627
  123    HE1  MET  17           HE1      MET  17  42.617   1.093   0.447
  124    HE2  MET  17           HE2      MET  17  41.356   2.262   0.846
  125    HE3  MET  17           HE3      MET  17  43.003   2.810   0.531
  126    H    LEU  18           H        LEU  18  40.348   6.716  -1.962
  127    HA   LEU  18           HA       LEU  18  40.968   7.018  -4.695
  128    HG   LEU  18           HG       LEU  18  37.455   6.121  -4.803
  129    HB2  LEU  18           HB2      LEU  18  38.581   7.299  -3.016
  130    HB3  LEU  18           HB3      LEU  18  38.568   8.294  -4.459
  131   HD11  LEU  18          HD11      LEU  18  38.107   6.808  -6.850
  132   HD12  LEU  18          HD12      LEU  18  39.171   5.406  -6.727
  133   HD13  LEU  18          HD13      LEU  18  39.791   7.015  -6.366
  134   HD21  LEU  18          HD21      LEU  18  38.865   4.817  -3.245
  135   HD22  LEU  18          HD22      LEU  18  40.188   4.917  -4.408
  136   HD23  LEU  18          HD23      LEU  18  38.704   4.062  -4.832
  137    H    SER  19           H        SER  19  40.693   9.396  -2.125
  138    HA   SER  19           HA       SER  19  41.037  11.537  -4.090
  139    HG   SER  19           HG       SER  19  39.859  10.731  -0.730
  140    HB2  SER  19           HB2      SER  19  40.599  13.061  -2.161
  141    HB3  SER  19           HB3      SER  19  39.280  11.938  -2.493
  142    H    MET  20           H        MET  20  42.940   9.652  -2.023
  143    HA   MET  20           HA       MET  20  44.885  11.740  -1.500
  144    HB2  MET  20           HB2      MET  20  44.322   9.893   0.140
  145    HB3  MET  20           HB3      MET  20  45.185   8.792  -0.924
  146    HG2  MET  20           HG2      MET  20  46.579   9.523   0.926
  147    HG3  MET  20           HG3      MET  20  47.229  10.067  -0.620
  148    HE1  MET  20           HE1      MET  20  47.943  12.065   2.511
  149    HE2  MET  20           HE2      MET  20  48.570  12.851   1.062
  150    HE3  MET  20           HE3      MET  20  48.611  11.094   1.200
  151    H    GLY  21           H        GLY  21  44.355   9.235  -3.825
  152    HA2  GLY  21           HA2      GLY  21  45.539   9.516  -5.949
  153    HA3  GLY  21           HA3      GLY  21  46.986   9.873  -5.012
  154    H    PHE  22           H        PHE  22  44.595   7.277  -4.651
  155    HA   PHE  22           HA       PHE  22  46.742   5.329  -5.167
  156    HD1  PHE  22           HD1      PHE  22  45.763   7.265  -2.468
  157    HD2  PHE  22           HD2      PHE  22  46.964   3.201  -2.112
  158    HE1  PHE  22           HE1      PHE  22  47.204   7.859  -0.564
  159    HE2  PHE  22           HE2      PHE  22  48.404   3.790  -0.213
  160    HZ   PHE  22           HZ       PHE  22  48.527   6.122   0.564
  161    HB2  PHE  22           HB2      PHE  22  44.358   5.077  -3.305
  162    HB3  PHE  22           HB3      PHE  22  45.436   3.748  -3.719
  163    H    SER  23           H        SER  23  45.296   3.074  -5.581
  164    HA   SER  23           HA       SER  23  43.048   3.727  -7.274
  165    HG   SER  23           HG       SER  23  44.746   4.958  -8.319
  166    HB2  SER  23           HB2      SER  23  45.504   2.371  -8.431
  167    HB3  SER  23           HB3      SER  23  43.970   2.593  -9.271
  168    H    ASP  24           H        ASP  24  42.961   1.262  -8.655
  169    HA   ASP  24           HA       ASP  24  42.633  -0.662  -6.453
  170    HB2  ASP  24           HB2      ASP  24  40.447  -0.161  -7.219
  171    HB3  ASP  24           HB3      ASP  24  40.952  -0.168  -8.907
  172    H    GLU  25           H        GLU  25  43.938  -2.437  -6.624
  173    HA   GLU  25           HA       GLU  25  45.034  -3.006  -9.295
  174    HB2  GLU  25           HB2      GLU  25  46.589  -2.062  -7.487
  175    HB3  GLU  25           HB3      GLU  25  46.414  -3.613  -6.682
  176    HG2  GLU  25           HG2      GLU  25  47.455  -4.761  -8.483
  177    HG3  GLU  25           HG3      GLU  25  47.402  -3.323  -9.506
  178    H    GLY  26           H        GLY  26  43.195  -4.436  -9.602
  179    HA2  GLY  26           HA2      GLY  26  43.310  -6.901  -9.906
  180    HA3  GLY  26           HA3      GLY  26  43.560  -7.000  -8.171
  181    H    GLY  27           H        GLY  27  41.378  -4.608  -8.384
  182    HA2  GLY  27           HA2      GLY  27  39.021  -4.559  -8.482
  183    HA3  GLY  27           HA3      GLY  27  39.017  -6.298  -8.759
  184    H    TRP  28           H        TRP  28  41.091  -5.380  -6.307
  185    HA   TRP  28           HA       TRP  28  39.747  -6.793  -4.295
  186    HD1  TRP  28           HD1      TRP  28  42.766  -4.156  -5.973
  187    HE1  TRP  28           HE1      TRP  28  43.324  -1.742  -5.273
  188    HE3  TRP  28           HE3      TRP  28  41.269  -4.282  -1.107
  189    HZ2  TRP  28           HZ2      TRP  28  43.167  -0.117  -3.023
  190    HZ3  TRP  28           HZ3      TRP  28  41.499  -2.257   0.246
  191    HH2  TRP  28           HH2      TRP  28  42.431  -0.214  -0.693
  192    HB2  TRP  28           HB2      TRP  28  41.517  -6.024  -2.824
  193    HB3  TRP  28           HB3      TRP  28  42.233  -6.373  -4.405
  194    H    LEU  29           H        LEU  29  39.850  -3.365  -5.106
  195    HA   LEU  29           HA       LEU  29  39.304  -2.303  -2.691
  196    HG   LEU  29           HG       LEU  29  37.170  -0.087  -3.676
  197    HB2  LEU  29           HB2      LEU  29  39.959  -0.914  -4.472
  198    HB3  LEU  29           HB3      LEU  29  38.537  -1.292  -5.415
  199   HD11  LEU  29          HD11      LEU  29  39.824   0.106  -2.449
  200   HD12  LEU  29          HD12      LEU  29  38.220   0.189  -1.719
  201   HD13  LEU  29          HD13      LEU  29  38.915   1.617  -2.487
  202   HD21  LEU  29          HD21      LEU  29  38.391   0.873  -5.853
  203   HD22  LEU  29          HD22      LEU  29  39.143   1.893  -4.629
  204   HD23  LEU  29          HD23      LEU  29  37.388   1.864  -4.796
  205    H    THR  30           H        THR  30  36.955  -3.997  -4.592
  206    HA   THR  30           HA       THR  30  34.807  -2.999  -2.870
  207    HB   THR  30           HB       THR  30  33.271  -4.211  -4.319
  208    HG1  THR  30           HG1      THR  30  34.208  -5.968  -5.067
  209   HG21  THR  30          HG21      THR  30  34.915  -2.092  -5.215
  210   HG22  THR  30          HG22      THR  30  33.272  -2.498  -5.711
  211   HG23  THR  30          HG23      THR  30  34.650  -3.183  -6.573
  212    H    ARG  31           H        ARG  31  36.711  -5.874  -3.490
  213    HA   ARG  31           HA       ARG  31  35.032  -7.496  -1.765
  214    HE   ARG  31           HE       ARG  31  40.135  -8.606  -4.686
  215    HB2  ARG  31           HB2      ARG  31  36.567  -9.340  -2.487
  216    HB3  ARG  31           HB3      ARG  31  35.721  -8.536  -3.798
  217    HG2  ARG  31           HG2      ARG  31  37.762  -7.224  -4.252
  218    HG3  ARG  31           HG3      ARG  31  38.591  -8.126  -2.979
  219    HD2  ARG  31           HD2      ARG  31  37.931 -10.225  -4.267
  220    HD3  ARG  31           HD3      ARG  31  37.511  -9.143  -5.596
  221   HH11  ARG  31          HH11      ARG  31  38.288 -10.950  -6.503
  222   HH12  ARG  31          HH12      ARG  31  39.658 -11.512  -7.413
  223   HH21  ARG  31          HH21      ARG  31  41.934  -9.318  -5.892
  224   HH22  ARG  31          HH22      ARG  31  41.716 -10.550  -7.102
  225    H    LEU  32           H        LEU  32  38.328  -6.264  -1.787
  226    HA   LEU  32           HA       LEU  32  39.357  -7.641   0.428
  227    HG   LEU  32           HG       LEU  32  42.436  -5.562  -0.177
  228    HB2  LEU  32           HB2      LEU  32  40.549  -6.309  -1.370
  229    HB3  LEU  32           HB3      LEU  32  40.072  -4.862  -0.508
  230   HD11  LEU  32          HD11      LEU  32  42.322  -5.430   2.377
  231   HD12  LEU  32          HD12      LEU  32  40.582  -5.257   2.145
  232   HD13  LEU  32          HD13      LEU  32  41.689  -4.086   1.424
  233   HD21  LEU  32          HD21      LEU  32  41.106  -8.010   0.753
  234   HD22  LEU  32          HD22      LEU  32  42.475  -7.449   1.716
  235   HD23  LEU  32          HD23      LEU  32  42.678  -7.775  -0.008
  236    H    LEU  33           H        LEU  33  38.097  -4.295   0.239
  237    HA   LEU  33           HA       LEU  33  38.154  -3.703   2.966
  238    HG   LEU  33           HG       LEU  33  38.458  -1.311   2.430
  239    HB2  LEU  33           HB2      LEU  33  36.419  -2.733   0.714
  240    HB3  LEU  33           HB3      LEU  33  36.114  -2.204   2.359
  241   HD11  LEU  33          HD11      LEU  33  39.496  -2.629   0.719
  242   HD12  LEU  33          HD12      LEU  33  39.553  -0.934   0.236
  243   HD13  LEU  33          HD13      LEU  33  38.372  -2.020  -0.496
  244   HD21  LEU  33          HD21      LEU  33  37.865   0.504   0.604
  245   HD22  LEU  33          HD22      LEU  33  36.964   0.384   2.118
  246   HD23  LEU  33          HD23      LEU  33  36.305  -0.319   0.640
  247    H    GLN  34           H        GLN  34  35.535  -5.005   1.011
  248    HA   GLN  34           HA       GLN  34  33.493  -5.186   2.786
  249    HB2  GLN  34           HB2      GLN  34  33.528  -5.780   0.370
  250    HB3  GLN  34           HB3      GLN  34  34.235  -7.327   0.801
  251    HG2  GLN  34           HG2      GLN  34  31.964  -7.767   0.515
  252    HG3  GLN  34           HG3      GLN  34  32.199  -7.701   2.260
  253   HE21  GLN  34          HE21      GLN  34  32.409  -4.609   1.130
  254   HE22  GLN  34          HE22      GLN  34  30.774  -4.114   1.362
  255    H    THR  35           H        THR  35  35.922  -7.756   2.270
  256    HA   THR  35           HA       THR  35  34.881  -9.356   4.385
  257    HB   THR  35           HB       THR  35  37.589  -9.559   3.050
  258    HG1  THR  35           HG1      THR  35  36.429  -9.906   1.337
  259   HG21  THR  35          HG21      THR  35  37.243 -12.001   3.419
  260   HG22  THR  35          HG22      THR  35  35.878 -11.591   4.460
  261   HG23  THR  35          HG23      THR  35  37.505 -11.062   4.887
  262    H    LYS  36           H        LYS  36  37.175  -6.784   4.219
  263    HA   LYS  36           HA       LYS  36  38.228  -7.381   6.882
  264    HB2  LYS  36           HB2      LYS  36  39.034  -5.517   4.682
  265    HB3  LYS  36           HB3      LYS  36  39.524  -5.157   6.331
  266    HG2  LYS  36           HG2      LYS  36  41.295  -6.318   5.212
  267    HG3  LYS  36           HG3      LYS  36  40.616  -7.368   6.454
  268    HD2  LYS  36           HD2      LYS  36  39.390  -8.612   4.792
  269    HD3  LYS  36           HD3      LYS  36  39.912  -7.497   3.524
  270    HE2  LYS  36           HE2      LYS  36  42.227  -8.157   3.873
  271    HE3  LYS  36           HE3      LYS  36  41.741  -9.230   5.185
  272    HZ1  LYS  36           HZ1      LYS  36  41.024 -10.795   3.751
  273    HZ2  LYS  36           HZ2      LYS  36  42.093 -10.034   2.677
  274    HZ3  LYS  36           HZ3      LYS  36  40.432  -9.677   2.616
  275    H    ASN  37           H        ASN  37  35.444  -6.619   6.594
  276    HA   ASN  37           HA       ASN  37  33.858  -5.171   7.333
  277    HB2  ASN  37           HB2      ASN  37  34.117  -4.445   9.637
  278    HB3  ASN  37           HB3      ASN  37  34.743  -6.078   9.447
  279   HD21  ASN  37          HD21      ASN  37  36.779  -6.492  10.071
  280   HD22  ASN  37          HD22      ASN  37  37.911  -5.297  10.608
  281    H    TYR  38           H        TYR  38  35.521  -3.996   5.387
  282    HA   TYR  38           HA       TYR  38  35.872  -2.013   4.351
  283    HD1  TYR  38           HD1      TYR  38  34.091  -1.012   2.913
  284    HD2  TYR  38           HD2      TYR  38  32.153  -1.881   6.596
  285    HE1  TYR  38           HE1      TYR  38  32.101  -1.760   1.682
  286    HE2  TYR  38           HE2      TYR  38  30.158  -2.635   5.373
  287    HH   TYR  38           HH       TYR  38  29.669  -2.017   2.092
  288    HB2  TYR  38           HB2      TYR  38  34.242  -0.893   6.641
  289    HB3  TYR  38           HB3      TYR  38  34.761   0.040   5.241
  290    H    ASP  39           H        ASP  39  38.076  -2.654   5.083
  291    HA   ASP  39           HA       ASP  39  39.117  -0.713   7.053
  292    HB2  ASP  39           HB2      ASP  39  39.113  -3.095   7.785
  293    HB3  ASP  39           HB3      ASP  39  40.227  -3.458   6.470
  294    H    ILE  40           H        ILE  40  40.865   0.435   6.646
  295    HA   ILE  40           HA       ILE  40  42.061   0.302   3.991
  296    HB   ILE  40           HB       ILE  40  43.344   2.361   4.849
  297   HG12  ILE  40          HG12      ILE  40  42.452   1.821   7.264
  298   HG13  ILE  40          HG13      ILE  40  42.651   3.489   6.742
  299   HG21  ILE  40          HG21      ILE  40  40.681   2.052   3.793
  300   HG22  ILE  40          HG22      ILE  40  41.940   3.210   3.363
  301   HG23  ILE  40          HG23      ILE  40  40.844   3.553   4.700
  302   HD11  ILE  40          HD11      ILE  40  40.451   2.611   7.951
  303   HD12  ILE  40          HD12      ILE  40  40.003   2.245   6.285
  304   HD13  ILE  40          HD13      ILE  40  40.419   3.896   6.742
  305    H    GLY  41           H        GLY  41  42.543  -0.942   7.049
  306    HA2  GLY  41           HA2      GLY  41  45.299  -0.665   7.400
  307    HA3  GLY  41           HA3      GLY  41  44.324  -1.943   8.096
  308    H    ALA  42           H        ALA  42  43.447  -3.234   5.933
  309    HA   ALA  42           HA       ALA  42  45.884  -4.434   4.844
  310    HB1  ALA  42           HB1      ALA  42  44.437  -6.065   5.777
  311    HB2  ALA  42           HB2      ALA  42  44.289  -6.214   4.026
  312    HB3  ALA  42           HB3      ALA  42  43.031  -5.393   4.950
  313    H    ALA  43           H        ALA  43  43.537  -2.204   4.030
  314    HA   ALA  43           HA       ALA  43  43.179  -2.740   1.271
  315    HB1  ALA  43           HB1      ALA  43  43.020   0.007   2.450
  316    HB2  ALA  43           HB2      ALA  43  41.806  -1.220   2.823
  317    HB3  ALA  43           HB3      ALA  43  42.062  -0.707   1.153
  318    H    LEU  44           H        LEU  44  45.375  -0.509   2.984
  319    HA   LEU  44           HA       LEU  44  46.547   0.447   0.573
  320    HG   LEU  44           HG       LEU  44  46.597   2.747   1.393
  321    HB2  LEU  44           HB2      LEU  44  47.292   0.665   3.472
  322    HB3  LEU  44           HB3      LEU  44  48.400   1.218   2.227
  323   HD11  LEU  44          HD11      LEU  44  45.156   1.567   3.728
  324   HD12  LEU  44          HD12      LEU  44  44.561   1.960   2.113
  325   HD13  LEU  44          HD13      LEU  44  44.864   3.249   3.280
  326   HD21  LEU  44          HD21      LEU  44  46.804   4.344   3.297
  327   HD22  LEU  44          HD22      LEU  44  48.332   3.661   2.744
  328   HD23  LEU  44          HD23      LEU  44  47.579   3.058   4.222
  329    H    ASP  45           H        ASP  45  47.030  -2.358   2.467
  330    HA   ASP  45           HA       ASP  45  49.753  -2.879   1.846
  331    HB2  ASP  45           HB2      ASP  45  48.363  -3.853   3.742
  332    HB3  ASP  45           HB3      ASP  45  47.635  -4.916   2.544
  333    H    THR  46           H        THR  46  46.805  -3.324   0.081
  334    HA   THR  46           HA       THR  46  48.021  -5.322  -1.634
  335    HB   THR  46           HB       THR  46  45.735  -5.368  -2.706
  336    HG1  THR  46           HG1      THR  46  44.621  -3.636  -2.230
  337   HG21  THR  46          HG21      THR  46  46.024  -7.080  -1.176
  338   HG22  THR  46          HG22      THR  46  44.580  -6.252  -0.591
  339   HG23  THR  46          HG23      THR  46  46.134  -5.972   0.191
  340    H    ILE  47           H        ILE  47  47.351  -1.889  -1.801
  341    HA   ILE  47           HA       ILE  47  47.555  -2.016  -4.719
  342    HB   ILE  47           HB       ILE  47  47.069   0.542  -4.420
  343   HG12  ILE  47          HG12      ILE  47  46.027  -0.638  -1.835
  344   HG13  ILE  47          HG13      ILE  47  47.287   0.581  -1.989
  345   HG21  ILE  47          HG21      ILE  47  45.587  -0.847  -5.599
  346   HG22  ILE  47          HG22      ILE  47  44.617  -0.025  -4.375
  347   HG23  ILE  47          HG23      ILE  47  45.101  -1.704  -4.135
  348   HD11  ILE  47          HD11      ILE  47  44.852   1.380  -3.323
  349   HD12  ILE  47          HD12      ILE  47  45.796   2.218  -2.090
  350   HD13  ILE  47          HD13      ILE  47  44.590   1.022  -1.615
  351    H    GLN  48           H        GLN  48  49.440  -0.806  -2.014
  352    HA   GLN  48           HA       GLN  48  51.597  -0.171  -3.840
  353    HB2  GLN  48           HB2      GLN  48  50.104   1.975  -2.352
  354    HB3  GLN  48           HB3      GLN  48  51.807   2.177  -2.736
  355    HG2  GLN  48           HG2      GLN  48  51.325   2.781  -4.816
  356    HG3  GLN  48           HG3      GLN  48  50.370   1.316  -5.069
  357   HE21  GLN  48          HE21      GLN  48  48.344   1.581  -5.503
  358   HE22  GLN  48          HE22      GLN  48  47.377   2.964  -5.115
  359    H    TYR  49           H        TYR  49  50.506   0.323  -0.483
  360    HA   TYR  49           HA       TYR  49  53.172  -0.080   0.544
  361    HD1  TYR  49           HD1      TYR  49  50.538   2.243   0.221
  362    HD2  TYR  49           HD2      TYR  49  53.061   1.767   3.613
  363    HE1  TYR  49           HE1      TYR  49  50.905   4.669   0.283
  364    HE2  TYR  49           HE2      TYR  49  53.434   4.192   3.685
  365    HH   TYR  49           HH       TYR  49  51.906   6.310   2.779
  366    HB2  TYR  49           HB2      TYR  49  50.481   0.162   1.910
  367    HB3  TYR  49           HB3      TYR  49  51.994  -0.083   2.780
  368    H    SER  50           H        SER  50  53.260  -1.733   2.455
  369    HA   SER  50           HA       SER  50  51.730  -4.013   2.599
  370    HG   SER  50           HG       SER  50  51.569  -5.899   1.300
  371    HB2  SER  50           HB2      SER  50  52.704  -4.220   0.157
  372    HB3  SER  50           HB3      SER  50  54.165  -4.748   0.993
  373    H    LYS  51           H        LYS  51  52.506  -3.066   4.677
  374    HA   LYS  51           HA       LYS  51  54.688  -4.604   5.750
  375    HB2  LYS  51           HB2      LYS  51  55.934  -2.732   4.759
  376    HB3  LYS  51           HB3      LYS  51  54.907  -1.585   5.609
  377    HG2  LYS  51           HG2      LYS  51  55.727  -2.641   7.756
  378    HG3  LYS  51           HG3      LYS  51  56.931  -3.476   6.774
  379    HD2  LYS  51           HD2      LYS  51  57.850  -1.371   6.033
  380    HD3  LYS  51           HD3      LYS  51  56.578  -0.482   6.876
  381    HE2  LYS  51           HE2      LYS  51  58.695  -2.216   8.156
  382    HE3  LYS  51           HE3      LYS  51  58.651  -0.454   8.160
  383    HZ1  LYS  51           HZ1      LYS  51  56.558  -0.556   9.410
  384    HZ2  LYS  51           HZ2      LYS  51  57.826  -1.323  10.240
  385    HZ3  LYS  51           HZ3      LYS  51  56.654  -2.252   9.446
  386    H    HIS  52           H        HIS  52  54.576  -4.752   7.964
  387    HA   HIS  52           HA       HIS  52  52.468  -3.164   9.258
  388    HD1  HIS  52           HD1      HIS  52  52.431  -6.174   7.129
  389    HD2  HIS  52           HD2      HIS  52  49.541  -5.473  10.039
  390    HE1  HIS  52           HE1      HIS  52  50.207  -6.759   6.077
  391    HB2  HIS  52           HB2      HIS  52  53.220  -6.042   9.850
  392    HB3  HIS  52           HB3      HIS  52  52.079  -5.086  10.790
  Start of MODEL   19
    1    H1   GLY   1           1H       GLY   1  24.786  -5.967  -4.382
    2    H2   GLY   1           2H       GLY   1  25.421  -7.525  -4.566
    3    H3   GLY   1           3H       GLY   1  26.171  -6.211  -5.328
    4    HA2  GLY   1           HA2      GLY   1  25.902  -6.354  -2.389
    5    HA3  GLY   1           HA3      GLY   1  27.255  -7.102  -3.224
    6    H    SER   2           H        SER   2  25.613  -4.093  -4.069
    7    HA   SER   2           HA       SER   2  28.147  -2.697  -4.088
    8    HG   SER   2           HG       SER   2  26.491  -1.874  -6.904
    9    HB2  SER   2           HB2      SER   2  25.349  -1.692  -4.678
   10    HB3  SER   2           HB3      SER   2  26.857  -0.849  -5.046
   11    HA   PRO   3           HA       PRO   3  27.587  -0.873  -0.124
   12    HB2  PRO   3           HB2      PRO   3  29.362   1.098  -0.205
   13    HB3  PRO   3           HB3      PRO   3  29.882  -0.575  -0.449
   14    HG2  PRO   3           HG2      PRO   3  29.432   1.586  -2.470
   15    HG3  PRO   3           HG3      PRO   3  30.718   0.367  -2.400
   16    HD2  PRO   3           HD2      PRO   3  28.406   0.202  -3.946
   17    HD3  PRO   3           HD3      PRO   3  29.462  -1.152  -3.517
   18    HA   PRO   4           HA       PRO   4  24.880   2.656   0.108
   19    HB2  PRO   4           HB2      PRO   4  26.597   3.914   2.142
   20    HB3  PRO   4           HB3      PRO   4  24.920   3.372   2.265
   21    HG2  PRO   4           HG2      PRO   4  26.904   2.048   3.487
   22    HG3  PRO   4           HG3      PRO   4  25.520   1.196   2.774
   23    HD2  PRO   4           HD2      PRO   4  28.290   1.553   1.687
   24    HD3  PRO   4           HD3      PRO   4  27.255   0.108   1.677
   25    H    GLU   5           H        GLU   5  24.719   4.911  -0.340
   26    HA   GLU   5           HA       GLU   5  26.617   5.681  -2.319
   27    HB2  GLU   5           HB2      GLU   5  24.174   6.050  -2.530
   28    HB3  GLU   5           HB3      GLU   5  24.259   7.233  -1.233
   29    HG2  GLU   5           HG2      GLU   5  25.681   8.651  -2.587
   30    HG3  GLU   5           HG3      GLU   5  25.678   7.452  -3.880
   31    H    ALA   6           H        ALA   6  28.571   6.124  -1.375
   32    HA   ALA   6           HA       ALA   6  30.195   7.284  -0.291
   33    HB1  ALA   6           HB1      ALA   6  30.240   9.482  -0.719
   34    HB2  ALA   6           HB2      ALA   6  28.699   9.771   0.091
   35    HB3  ALA   6           HB3      ALA   6  28.724   9.190  -1.574
   36    H    ASP   7           H        ASP   7  29.369   5.720   1.355
   37    HA   ASP   7           HA       ASP   7  28.116   6.942   3.683
   38    HB2  ASP   7           HB2      ASP   7  27.407   4.700   2.790
   39    HB3  ASP   7           HB3      ASP   7  29.008   4.085   3.172
   40    HA   PRO   8           HA       PRO   8  31.870   7.813   5.875
   41    HB2  PRO   8           HB2      PRO   8  30.747   6.157   8.082
   42    HB3  PRO   8           HB3      PRO   8  31.402   7.797   8.123
   43    HG2  PRO   8           HG2      PRO   8  28.758   7.336   8.206
   44    HG3  PRO   8           HG3      PRO   8  29.438   8.749   7.382
   45    HD2  PRO   8           HD2      PRO   8  28.243   6.288   6.235
   46    HD3  PRO   8           HD3      PRO   8  28.341   7.924   5.556
   47    H    ARG   9           H        ARG   9  30.813   4.619   5.260
   48    HA   ARG   9           HA       ARG   9  33.121   3.224   6.235
   49    HE   ARG   9           HE       ARG   9  31.470  -0.286   8.450
   50    HB2  ARG   9           HB2      ARG   9  31.025   2.473   4.188
   51    HB3  ARG   9           HB3      ARG   9  32.270   1.378   4.794
   52    HG2  ARG   9           HG2      ARG   9  30.022   2.625   6.368
   53    HG3  ARG   9           HG3      ARG   9  30.207   0.926   5.929
   54    HD2  ARG   9           HD2      ARG   9  32.527   1.298   7.226
   55    HD3  ARG   9           HD3      ARG   9  31.545   2.504   8.055
   56   HH11  ARG   9          HH11      ARG   9  29.297   2.452   8.233
   57   HH12  ARG   9          HH12      ARG   9  28.071   1.711   9.216
   58   HH21  ARG   9          HH21      ARG   9  29.901  -1.231   9.766
   59   HH22  ARG   9          HH22      ARG   9  28.426  -0.379  10.105
   60    H    LEU  10           H        LEU  10  32.073   4.362   3.004
   61    HA   LEU  10           HA       LEU  10  34.726   3.734   1.991
   62    HG   LEU  10           HG       LEU  10  32.069   2.116   1.207
   63    HB2  LEU  10           HB2      LEU  10  32.166   4.403   0.562
   64    HB3  LEU  10           HB3      LEU  10  33.707   4.183  -0.247
   65   HD11  LEU  10          HD11      LEU  10  31.357   1.704  -0.848
   66   HD12  LEU  10          HD12      LEU  10  33.000   1.212  -1.261
   67   HD13  LEU  10          HD13      LEU  10  32.485   2.878  -1.529
   68   HD21  LEU  10          HD21      LEU  10  34.375   1.799   1.896
   69   HD22  LEU  10          HD22      LEU  10  34.906   1.871   0.216
   70   HD23  LEU  10          HD23      LEU  10  33.895   0.535   0.764
   71    H    ILE  11           H        ILE  11  32.467   6.478   2.260
   72    HA   ILE  11           HA       ILE  11  34.082   8.290   0.831
   73    HB   ILE  11           HB       ILE  11  31.671   8.676   1.429
   74   HG12  ILE  11          HG12      ILE  11  33.625  10.874   2.134
   75   HG13  ILE  11          HG13      ILE  11  33.074  10.462   0.513
   76   HG21  ILE  11          HG21      ILE  11  32.816   9.476   4.101
   77   HG22  ILE  11          HG22      ILE  11  31.763   8.093   3.791
   78   HG23  ILE  11          HG23      ILE  11  31.154   9.734   3.568
   79   HD11  ILE  11          HD11      ILE  11  30.886  11.222   0.968
   80   HD12  ILE  11          HD12      ILE  11  31.992  12.460   1.563
   81   HD13  ILE  11          HD13      ILE  11  31.217  11.352   2.697
   82    H    GLU  12           H        GLU  12  34.336   6.965   3.976
   83    HA   GLU  12           HA       GLU  12  36.415   8.916   4.709
   84    HB2  GLU  12           HB2      GLU  12  34.759   7.047   6.254
   85    HB3  GLU  12           HB3      GLU  12  36.447   7.090   6.737
   86    HG2  GLU  12           HG2      GLU  12  35.312   8.635   8.100
   87    HG3  GLU  12           HG3      GLU  12  36.234   9.576   6.934
   88    H    SER  13           H        SER  13  36.077   5.351   4.673
   89    HA   SER  13           HA       SER  13  38.914   5.085   4.861
   90    HG   SER  13           HG       SER  13  37.738   2.899   6.958
   91    HB2  SER  13           HB2      SER  13  36.776   2.972   4.583
   92    HB3  SER  13           HB3      SER  13  38.465   2.665   4.986
   93    H    LEU  14           H        LEU  14  36.703   4.858   2.125
   94    HA   LEU  14           HA       LEU  14  38.799   3.538   0.566
   95    HG   LEU  14           HG       LEU  14  38.145   2.778  -1.682
   96    HB2  LEU  14           HB2      LEU  14  36.414   2.811   0.328
   97    HB3  LEU  14           HB3      LEU  14  36.035   4.396  -0.310
   98   HD11  LEU  14          HD11      LEU  14  35.779   2.228  -3.024
   99   HD12  LEU  14          HD12      LEU  14  35.399   1.946  -1.325
  100   HD13  LEU  14          HD13      LEU  14  36.748   1.094  -2.081
  101   HD21  LEU  14          HD21      LEU  14  36.270   4.994  -2.332
  102   HD22  LEU  14          HD22      LEU  14  36.721   3.883  -3.624
  103   HD23  LEU  14          HD23      LEU  14  37.968   4.785  -2.762
  104    H    SER  15           H        SER  15  36.974   6.503   0.851
  105    HA   SER  15           HA       SER  15  38.274   7.822  -1.284
  106    HG   SER  15           HG       SER  15  36.544  10.541  -0.986
  107    HB2  SER  15           HB2      SER  15  36.095   8.567  -0.419
  108    HB3  SER  15           HB3      SER  15  36.866   9.035   1.096
  109    H    GLN  16           H        GLN  16  39.279   6.976   1.850
  110    HA   GLN  16           HA       GLN  16  41.123   8.987   2.506
  111    HB2  GLN  16           HB2      GLN  16  40.533   7.154   4.041
  112    HB3  GLN  16           HB3      GLN  16  41.302   5.993   2.970
  113    HG2  GLN  16           HG2      GLN  16  42.922   8.245   4.062
  114    HG3  GLN  16           HG3      GLN  16  42.518   6.892   5.111
  115   HE21  GLN  16          HE21      GLN  16  42.577   5.230   2.490
  116   HE22  GLN  16          HE22      GLN  16  44.259   4.887   2.280
  117    H    MET  17           H        MET  17  41.430   6.110   0.486
  118    HA   MET  17           HA       MET  17  44.117   6.932  -0.297
  119    HB2  MET  17           HB2      MET  17  44.148   4.630  -1.373
  120    HB3  MET  17           HB3      MET  17  44.065   4.680   0.382
  121    HG2  MET  17           HG2      MET  17  41.587   4.356   0.175
  122    HG3  MET  17           HG3      MET  17  41.840   4.075  -1.547
  123    HE1  MET  17           HE1      MET  17  43.544   0.853  -1.921
  124    HE2  MET  17           HE2      MET  17  44.754   1.997  -1.347
  125    HE3  MET  17           HE3      MET  17  43.485   2.535  -2.448
  126    H    LEU  18           H        LEU  18  40.904   6.861  -1.509
  127    HA   LEU  18           HA       LEU  18  41.373   6.620  -4.262
  128    HG   LEU  18           HG       LEU  18  39.291   8.660  -5.322
  129    HB2  LEU  18           HB2      LEU  18  39.149   6.534  -3.177
  130    HB3  LEU  18           HB3      LEU  18  39.250   8.259  -2.879
  131   HD11  LEU  18          HD11      LEU  18  39.799   5.866  -5.406
  132   HD12  LEU  18          HD12      LEU  18  39.745   7.018  -6.739
  133   HD13  LEU  18          HD13      LEU  18  38.277   6.177  -6.241
  134   HD21  LEU  18          HD21      LEU  18  36.944   6.961  -4.499
  135   HD22  LEU  18          HD22      LEU  18  36.965   8.261  -5.690
  136   HD23  LEU  18          HD23      LEU  18  37.184   8.630  -3.979
  137    H    SER  19           H        SER  19  41.184   9.548  -2.244
  138    HA   SER  19           HA       SER  19  42.164  11.130  -4.501
  139    HG   SER  19           HG       SER  19  39.938  12.204  -1.336
  140    HB2  SER  19           HB2      SER  19  41.605  13.060  -2.946
  141    HB3  SER  19           HB3      SER  19  40.241  12.080  -3.487
  142    H    MET  20           H        MET  20  43.667   9.341  -2.349
  143    HA   MET  20           HA       MET  20  45.559  11.312  -1.344
  144    HB2  MET  20           HB2      MET  20  44.748   9.453   0.100
  145    HB3  MET  20           HB3      MET  20  45.528   8.309  -0.984
  146    HG2  MET  20           HG2      MET  20  47.700   9.275  -0.458
  147    HG3  MET  20           HG3      MET  20  46.927  10.441   0.614
  148    HE1  MET  20           HE1      MET  20  48.819   9.703   1.975
  149    HE2  MET  20           HE2      MET  20  49.305   8.008   1.943
  150    HE3  MET  20           HE3      MET  20  48.482   8.662   3.359
  151    H    GLY  21           H        GLY  21  45.308   8.873  -3.798
  152    HA2  GLY  21           HA2      GLY  21  46.848   9.097  -5.724
  153    HA3  GLY  21           HA3      GLY  21  48.124   9.371  -4.539
  154    H    PHE  22           H        PHE  22  45.531   7.056  -4.220
  155    HA   PHE  22           HA       PHE  22  47.436   4.853  -4.584
  156    HD1  PHE  22           HD2      PHE  22  48.689   5.213  -3.321
  157    HD2  PHE  22           HD1      PHE  22  45.823   4.542  -0.252
  158    HE1  PHE  22           HE2      PHE  22  50.438   5.525  -1.626
  159    HE2  PHE  22           HE1      PHE  22  47.569   4.848   1.451
  160    HZ   PHE  22           HZ       PHE  22  49.880   5.344   0.768
  161    HB2  PHE  22           HB2      PHE  22  45.171   5.155  -2.602
  162    HB3  PHE  22           HB3      PHE  22  45.867   3.585  -3.007
  163    H    SER  23           H        SER  23  45.726   2.753  -4.850
  164    HA   SER  23           HA       SER  23  43.521   3.502  -6.535
  165    HG   SER  23           HG       SER  23  46.284   1.430  -8.527
  166    HB2  SER  23           HB2      SER  23  44.432   2.408  -8.588
  167    HB3  SER  23           HB3      SER  23  45.342   3.827  -8.114
  168    H    ASP  24           H        ASP  24  43.336   1.176  -8.016
  169    HA   ASP  24           HA       ASP  24  43.438  -0.958  -6.016
  170    HB2  ASP  24           HB2      ASP  24  41.665  -2.087  -7.522
  171    HB3  ASP  24           HB3      ASP  24  41.132  -0.800  -6.443
  172    H    GLU  25           H        GLU  25  45.093  -2.193  -6.451
  173    HA   GLU  25           HA       GLU  25  46.726  -2.037  -8.637
  174    HB2  GLU  25           HB2      GLU  25  47.216  -3.221  -6.455
  175    HB3  GLU  25           HB3      GLU  25  46.331  -4.597  -7.096
  176    HG2  GLU  25           HG2      GLU  25  47.928  -4.602  -9.026
  177    HG3  GLU  25           HG3      GLU  25  48.880  -3.410  -8.146
  178    H    GLY  26           H        GLY  26  43.913  -4.026  -8.253
  179    HA2  GLY  26           HA2      GLY  26  44.066  -4.659 -11.130
  180    HA3  GLY  26           HA3      GLY  26  43.472  -5.851  -9.973
  181    H    GLY  27           H        GLY  27  41.672  -5.003  -8.541
  182    HA2  GLY  27           HA2      GLY  27  40.049  -2.842  -9.344
  183    HA3  GLY  27           HA3      GLY  27  39.431  -4.320 -10.076
  184    H    TRP  28           H        TRP  28  41.077  -4.280  -7.040
  185    HA   TRP  28           HA       TRP  28  38.750  -5.490  -5.816
  186    HD1  TRP  28           HD1      TRP  28  43.015  -6.167  -6.719
  187    HE1  TRP  28           HE1      TRP  28  45.021  -4.695  -6.060
  188    HE3  TRP  28           HE3      TRP  28  41.012  -3.776  -2.672
  189    HZ2  TRP  28           HZ2      TRP  28  45.665  -2.787  -4.103
  190    HZ3  TRP  28           HZ3      TRP  28  42.380  -2.140  -1.464
  191    HH2  TRP  28           HH2      TRP  28  44.659  -1.654  -2.165
  192    HB2  TRP  28           HB2      TRP  28  40.430  -6.053  -3.997
  193    HB3  TRP  28           HB3      TRP  28  40.749  -6.755  -5.586
  194    H    LEU  29           H        LEU  29  40.144  -2.399  -5.817
  195    HA   LEU  29           HA       LEU  29  40.325  -1.724  -3.195
  196    HG   LEU  29           HG       LEU  29  38.506   1.067  -3.726
  197    HB2  LEU  29           HB2      LEU  29  41.133  -0.123  -4.609
  198    HB3  LEU  29           HB3      LEU  29  39.708  -0.111  -5.619
  199   HD11  LEU  29          HD11      LEU  29  41.105   0.623  -2.488
  200   HD12  LEU  29          HD12      LEU  29  39.550   1.011  -1.754
  201   HD13  LEU  29          HD13      LEU  29  40.566   2.299  -2.401
  202   HD21  LEU  29          HD21      LEU  29  38.969   2.981  -4.771
  203   HD22  LEU  29          HD22      LEU  29  40.089   2.037  -5.754
  204   HD23  LEU  29          HD23      LEU  29  40.676   2.904  -4.335
  205    H    THR  30           H        THR  30  37.358  -2.211  -4.903
  206    HA   THR  30           HA       THR  30  35.779  -1.176  -2.681
  207    HB   THR  30           HB       THR  30  33.857  -2.132  -4.020
  208    HG1  THR  30           HG1      THR  30  34.238  -3.121  -5.857
  209   HG21  THR  30          HG21      THR  30  35.606   0.065  -4.908
  210   HG22  THR  30          HG22      THR  30  33.885   0.061  -4.522
  211   HG23  THR  30          HG23      THR  30  34.440  -0.530  -6.089
  212    H    ARG  31           H        ARG  31  36.272  -4.280  -4.333
  213    HA   ARG  31           HA       ARG  31  34.909  -5.977  -2.668
  214    HE   ARG  31           HE       ARG  31  34.113  -7.714  -3.754
  215    HB2  ARG  31           HB2      ARG  31  37.526  -6.634  -4.027
  216    HB3  ARG  31           HB3      ARG  31  36.258  -7.766  -3.576
  217    HG2  ARG  31           HG2      ARG  31  35.168  -5.711  -5.251
  218    HG3  ARG  31           HG3      ARG  31  36.584  -6.428  -6.021
  219    HD2  ARG  31           HD2      ARG  31  34.415  -7.545  -6.569
  220    HD3  ARG  31           HD3      ARG  31  35.642  -8.615  -5.887
  221   HH11  ARG  31          HH11      ARG  31  33.599  -9.525  -6.694
  222   HH12  ARG  31          HH12      ARG  31  32.310 -10.489  -6.038
  223   HH21  ARG  31          HH21      ARG  31  32.431  -8.979  -2.869
  224   HH22  ARG  31          HH22      ARG  31  31.652 -10.182  -3.850
  225    H    LEU  32           H        LEU  32  38.361  -5.189  -2.434
  226    HA   LEU  32           HA       LEU  32  39.112  -6.787  -0.340
  227    HG   LEU  32           HG       LEU  32  42.353  -4.986  -0.445
  228    HB2  LEU  32           HB2      LEU  32  40.503  -5.280  -1.826
  229    HB3  LEU  32           HB3      LEU  32  40.062  -3.954  -0.772
  230   HD11  LEU  32          HD11      LEU  32  41.657  -3.536   1.221
  231   HD12  LEU  32          HD12      LEU  32  42.085  -5.009   2.090
  232   HD13  LEU  32          HD13      LEU  32  40.389  -4.628   1.784
  233   HD21  LEU  32          HD21      LEU  32  42.563  -7.012   0.770
  234   HD22  LEU  32          HD22      LEU  32  41.548  -7.336  -0.635
  235   HD23  LEU  32          HD23      LEU  32  40.816  -7.154   0.961
  236    H    LEU  33           H        LEU  33  38.185  -3.348   0.004
  237    HA   LEU  33           HA       LEU  33  38.118  -3.400   2.811
  238    HG   LEU  33           HG       LEU  33  39.135  -1.204   2.781
  239    HB2  LEU  33           HB2      LEU  33  36.899  -1.548   0.784
  240    HB3  LEU  33           HB3      LEU  33  36.607  -1.332   2.501
  241   HD11  LEU  33          HD11      LEU  33  39.993  -2.112   0.808
  242   HD12  LEU  33          HD12      LEU  33  40.271  -0.376   0.657
  243   HD13  LEU  33          HD13      LEU  33  38.934  -1.134  -0.210
  244   HD21  LEU  33          HD21      LEU  33  38.067   0.984   1.035
  245   HD22  LEU  33          HD22      LEU  33  39.148   1.098   2.423
  246   HD23  LEU  33          HD23      LEU  33  37.443   0.718   2.662
  247    H    GLN  34           H        GLN  34  35.537  -3.769   0.423
  248    HA   GLN  34           HA       GLN  34  33.310  -3.776   2.010
  249    HB2  GLN  34           HB2      GLN  34  34.006  -4.595  -0.593
  250    HB3  GLN  34           HB3      GLN  34  33.062  -5.903   0.110
  251    HG2  GLN  34           HG2      GLN  34  31.442  -4.610  -0.880
  252    HG3  GLN  34           HG3      GLN  34  31.414  -4.019   0.780
  253   HE21  GLN  34          HE21      GLN  34  31.733  -1.913   1.130
  254   HE22  GLN  34          HE22      GLN  34  32.208  -0.765  -0.073
  255    H    THR  35           H        THR  35  35.390  -6.597   1.338
  256    HA   THR  35           HA       THR  35  33.773  -8.313   2.979
  257    HB   THR  35           HB       THR  35  36.544  -8.917   1.947
  258    HG1  THR  35           HG1      THR  35  35.806  -8.928  -0.011
  259   HG21  THR  35          HG21      THR  35  34.163 -10.584   2.662
  260   HG22  THR  35          HG22      THR  35  35.829 -10.726   3.223
  261   HG23  THR  35          HG23      THR  35  35.415 -11.176   1.568
  262    H    LYS  36           H        LYS  36  36.541  -6.306   3.480
  263    HA   LYS  36           HA       LYS  36  37.193  -7.673   5.982
  264    HB2  LYS  36           HB2      LYS  36  38.699  -5.631   4.354
  265    HB3  LYS  36           HB3      LYS  36  39.251  -6.242   5.911
  266    HG2  LYS  36           HG2      LYS  36  39.388  -8.480   5.041
  267    HG3  LYS  36           HG3      LYS  36  38.695  -7.961   3.502
  268    HD2  LYS  36           HD2      LYS  36  40.609  -6.627   3.011
  269    HD3  LYS  36           HD3      LYS  36  41.266  -6.881   4.629
  270    HE2  LYS  36           HE2      LYS  36  40.828  -9.035   2.561
  271    HE3  LYS  36           HE3      LYS  36  42.377  -8.269   2.917
  272    HZ1  LYS  36           HZ1      LYS  36  42.075  -9.077   5.256
  273    HZ2  LYS  36           HZ2      LYS  36  42.312 -10.299   4.097
  274    HZ3  LYS  36           HZ3      LYS  36  40.757 -10.001   4.711
  275    H    ASN  37           H        ASN  37  34.835  -6.193   6.009
  276    HA   ASN  37           HA       ASN  37  33.672  -4.582   7.086
  277    HB2  ASN  37           HB2      ASN  37  34.155  -4.289   9.404
  278    HB3  ASN  37           HB3      ASN  37  34.574  -5.944   8.979
  279   HD21  ASN  37          HD21      ASN  37  36.555  -6.655   9.434
  280   HD22  ASN  37          HD22      ASN  37  37.853  -5.680  10.029
  281    H    TYR  38           H        TYR  38  35.605  -3.615   5.178
  282    HA   TYR  38           HA       TYR  38  36.209  -1.614   4.313
  283    HD1  TYR  38           HD1      TYR  38  34.374  -0.019   3.136
  284    HD2  TYR  38           HD2      TYR  38  32.757  -1.505   6.777
  285    HE1  TYR  38           HE1      TYR  38  32.238  -0.443   2.008
  286    HE2  TYR  38           HE2      TYR  38  30.608  -1.930   5.657
  287    HH   TYR  38           HH       TYR  38  29.365  -1.320   3.740
  288    HB2  TYR  38           HB2      TYR  38  34.877  -0.469   6.780
  289    HB3  TYR  38           HB3      TYR  38  35.416   0.474   5.392
  290    H    ASP  39           H        ASP  39  38.300  -2.612   4.832
  291    HA   ASP  39           HA       ASP  39  39.689  -1.177   7.009
  292    HB2  ASP  39           HB2      ASP  39  39.505  -3.732   7.070
  293    HB3  ASP  39           HB3      ASP  39  40.671  -3.726   5.750
  294    H    ILE  40           H        ILE  40  41.338   0.077   6.607
  295    HA   ILE  40           HA       ILE  40  42.472   0.165   3.914
  296    HB   ILE  40           HB       ILE  40  43.845   2.105   5.017
  297   HG12  ILE  40          HG12      ILE  40  42.675   1.502   7.295
  298   HG13  ILE  40          HG13      ILE  40  42.978   3.183   6.871
  299   HG21  ILE  40          HG21      ILE  40  41.281   3.277   4.660
  300   HG22  ILE  40          HG22      ILE  40  41.458   1.944   3.519
  301   HG23  ILE  40          HG23      ILE  40  42.650   3.243   3.550
  302   HD11  ILE  40          HD11      ILE  40  40.690   3.487   6.214
  303   HD12  ILE  40          HD12      ILE  40  40.733   2.782   7.832
  304   HD13  ILE  40          HD13      ILE  40  40.357   1.769   6.438
  305    H    GLY  41           H        GLY  41  42.987  -1.061   7.037
  306    HA2  GLY  41           HA2      GLY  41  45.788  -1.092   7.149
  307    HA3  GLY  41           HA3      GLY  41  44.735  -2.206   7.995
  308    H    ALA  42           H        ALA  42  43.498  -3.190   5.616
  309    HA   ALA  42           HA       ALA  42  45.662  -4.901   4.636
  310    HB1  ALA  42           HB1      ALA  42  43.903  -6.210   5.519
  311    HB2  ALA  42           HB2      ALA  42  43.760  -6.320   3.764
  312    HB3  ALA  42           HB3      ALA  42  42.680  -5.262   4.672
  313    H    ALA  43           H        ALA  43  43.694  -2.308   3.717
  314    HA   ALA  43           HA       ALA  43  43.596  -2.809   0.900
  315    HB1  ALA  43           HB1      ALA  43  42.588  -0.733   0.683
  316    HB2  ALA  43           HB2      ALA  43  43.436  -0.060   2.076
  317    HB3  ALA  43           HB3      ALA  43  42.121  -1.214   2.315
  318    H    LEU  44           H        LEU  44  45.744  -1.034   3.059
  319    HA   LEU  44           HA       LEU  44  47.366  -0.044   0.903
  320    HG   LEU  44           HG       LEU  44  47.575   2.146   1.747
  321    HB2  LEU  44           HB2      LEU  44  47.549   0.022   3.888
  322    HB3  LEU  44           HB3      LEU  44  48.980   0.382   2.937
  323   HD11  LEU  44          HD11      LEU  44  45.609   1.096   3.625
  324   HD12  LEU  44          HD12      LEU  44  45.387   2.075   2.174
  325   HD13  LEU  44          HD13      LEU  44  45.788   2.849   3.706
  326   HD21  LEU  44          HD21      LEU  44  48.960   3.309   3.051
  327   HD22  LEU  44          HD22      LEU  44  48.772   2.189   4.399
  328   HD23  LEU  44          HD23      LEU  44  47.588   3.471   4.148
  329    H    ASP  45           H        ASP  45  47.107  -2.938   2.629
  330    HA   ASP  45           HA       ASP  45  49.771  -3.925   2.331
  331    HB2  ASP  45           HB2      ASP  45  48.218  -4.855   3.987
  332    HB3  ASP  45           HB3      ASP  45  47.124  -5.355   2.705
  333    H    THR  46           H        THR  46  46.863  -3.934   0.371
  334    HA   THR  46           HA       THR  46  48.097  -5.725  -1.538
  335    HB   THR  46           HB       THR  46  45.765  -5.472  -2.637
  336    HG1  THR  46           HG1      THR  46  44.641  -3.976  -1.680
  337   HG21  THR  46          HG21      THR  46  45.474  -7.454  -1.719
  338   HG22  THR  46          HG22      THR  46  44.974  -6.672  -0.220
  339   HG23  THR  46          HG23      THR  46  46.669  -7.085  -0.476
  340    H    ILE  47           H        ILE  47  48.071  -2.356  -1.204
  341    HA   ILE  47           HA       ILE  47  47.989  -1.952  -4.118
  342    HB   ILE  47           HB       ILE  47  48.264   0.510  -3.477
  343   HG12  ILE  47          HG12      ILE  47  47.480  -0.626  -0.791
  344   HG13  ILE  47          HG13      ILE  47  49.004   0.166  -1.180
  345   HG21  ILE  47          HG21      ILE  47  45.717   0.245  -2.439
  346   HG22  ILE  47          HG22      ILE  47  45.932  -1.192  -3.431
  347   HG23  ILE  47          HG23      ILE  47  46.149   0.403  -4.141
  348   HD11  ILE  47          HD11      ILE  47  46.787   1.856  -1.857
  349   HD12  ILE  47          HD12      ILE  47  48.140   2.155  -0.767
  350   HD13  ILE  47          HD13      ILE  47  46.693   1.336  -0.176
  351    H    GLN  48           H        GLN  48  50.246  -1.796  -1.426
  352    HA   GLN  48           HA       GLN  48  52.519  -1.739  -3.195
  353    HB2  GLN  48           HB2      GLN  48  51.821   0.717  -1.572
  354    HB3  GLN  48           HB3      GLN  48  53.467   0.369  -2.063
  355    HG2  GLN  48           HG2      GLN  48  53.086   1.439  -3.955
  356    HG3  GLN  48           HG3      GLN  48  51.901   0.207  -4.389
  357   HE21  GLN  48          HE21      GLN  48  50.020   1.007  -4.941
  358   HE22  GLN  48          HE22      GLN  48  49.281   2.448  -4.313
  359    H    TYR  49           H        TYR  49  51.393  -1.024   0.065
  360    HA   TYR  49           HA       TYR  49  53.856  -1.798   1.297
  361    HD1  TYR  49           HD1      TYR  49  54.332   0.725   2.301
  362    HD2  TYR  49           HD2      TYR  49  50.138   0.531   1.619
  363    HE1  TYR  49           HE1      TYR  49  54.343   3.072   1.579
  364    HE2  TYR  49           HE2      TYR  49  50.137   2.879   0.907
  365    HH   TYR  49           HH       TYR  49  51.976   4.481  -0.125
  366    HB2  TYR  49           HB2      TYR  49  51.200  -1.266   2.645
  367    HB3  TYR  49           HB3      TYR  49  52.812  -1.079   3.338
  368    H    SER  50           H        SER  50  53.042  -3.075   3.606
  369    HA   SER  50           HA       SER  50  51.580  -5.472   2.824
  370    HG   SER  50           HG       SER  50  54.913  -5.425   2.034
  371    HB2  SER  50           HB2      SER  50  54.346  -5.637   4.061
  372    HB3  SER  50           HB3      SER  50  53.303  -6.997   3.642
  373    H    LYS  51           H        LYS  51  50.128  -4.248   4.229
  374    HA   LYS  51           HA       LYS  51  49.001  -3.948   6.172
  375    HB2  LYS  51           HB2      LYS  51  49.771  -6.364   6.614
  376    HB3  LYS  51           HB3      LYS  51  51.052  -5.655   7.585
  377    HG2  LYS  51           HG2      LYS  51  49.236  -6.336   9.007
  378    HG3  LYS  51           HG3      LYS  51  49.360  -4.575   9.005
  379    HD2  LYS  51           HD2      LYS  51  47.031  -5.288   8.870
  380    HD3  LYS  51           HD3      LYS  51  47.515  -4.445   7.397
  381    HE2  LYS  51           HE2      LYS  51  46.174  -6.421   6.888
  382    HE3  LYS  51           HE3      LYS  51  47.812  -6.583   6.260
  383    HZ1  LYS  51           HZ1      LYS  51  47.765  -8.561   7.268
  384    HZ2  LYS  51           HZ2      LYS  51  46.440  -8.158   8.250
  385    HZ3  LYS  51           HZ3      LYS  51  48.010  -7.705   8.717
  386    H    HIS  52           H        HIS  52  50.700  -2.127   5.253
  387    HA   HIS  52           HA       HIS  52  51.756  -0.210   5.768
  388    HD1  HIS  52           HD1      HIS  52  50.417   1.987   6.397
  389    HD2  HIS  52           HD2      HIS  52  48.502  -0.803   8.816
  390    HE1  HIS  52           HE1      HIS  52  47.972   2.646   6.448
  391    HB2  HIS  52           HB2      HIS  52  51.159  -1.040   8.612
  392    HB3  HIS  52           HB3      HIS  52  51.961   0.471   8.197
  Start of MODEL   20
    1    H1   GLY   1           1H       GLY   1  20.058   7.663  -2.081
    2    H2   GLY   1           2H       GLY   1  19.789   9.141  -1.293
    3    H3   GLY   1           3H       GLY   1  18.622   7.915  -1.213
    4    HA2  GLY   1           HA2      GLY   1  19.886   8.077   0.849
    5    HA3  GLY   1           HA3      GLY   1  20.098   6.518   0.057
    6    H    SER   2           H        SER   2  22.101   6.194   1.114
    7    HA   SER   2           HA       SER   2  24.247   8.067   0.459
    8    HG   SER   2           HG       SER   2  23.815   8.351   2.758
    9    HB2  SER   2           HB2      SER   2  24.316   5.606   2.223
   10    HB3  SER   2           HB3      SER   2  25.579   6.830   2.081
   11    HA   PRO   3           HA       PRO   3  25.170   5.351  -3.037
   12    HB2  PRO   3           HB2      PRO   3  27.414   7.254  -3.336
   13    HB3  PRO   3           HB3      PRO   3  26.177   6.786  -4.507
   14    HG2  PRO   3           HG2      PRO   3  26.153   9.198  -3.348
   15    HG3  PRO   3           HG3      PRO   3  24.647   8.330  -3.706
   16    HD2  PRO   3           HD2      PRO   3  26.083   8.645  -1.095
   17    HD3  PRO   3           HD3      PRO   3  24.338   8.688  -1.436
   18    HA   PRO   4           HA       PRO   4  28.120   2.920  -0.838
   19    HB2  PRO   4           HB2      PRO   4  28.486   1.426  -3.355
   20    HB3  PRO   4           HB3      PRO   4  27.875   0.873  -1.794
   21    HG2  PRO   4           HG2      PRO   4  26.238   1.192  -3.888
   22    HG3  PRO   4           HG3      PRO   4  25.716   1.577  -2.236
   23    HD2  PRO   4           HD2      PRO   4  26.620   3.425  -4.417
   24    HD3  PRO   4           HD3      PRO   4  25.265   3.604  -3.281
   25    H    GLU   5           H        GLU   5  29.146   5.304  -2.328
   26    HA   GLU   5           HA       GLU   5  31.919   4.437  -2.269
   27    HB2  GLU   5           HB2      GLU   5  31.198   4.501  -4.695
   28    HB3  GLU   5           HB3      GLU   5  30.922   6.224  -4.500
   29    HG2  GLU   5           HG2      GLU   5  33.302   6.501  -3.903
   30    HG3  GLU   5           HG3      GLU   5  33.547   4.785  -4.214
   31    H    ALA   6           H        ALA   6  29.675   6.147  -0.974
   32    HA   ALA   6           HA       ALA   6  31.477   8.112   0.128
   33    HB1  ALA   6           HB1      ALA   6  29.917   9.993  -0.172
   34    HB2  ALA   6           HB2      ALA   6  28.895   8.972  -1.184
   35    HB3  ALA   6           HB3      ALA   6  30.525   9.389  -1.713
   36    H    ASP   7           H        ASP   7  29.990   5.681   0.771
   37    HA   ASP   7           HA       ASP   7  28.003   6.450   2.739
   38    HB2  ASP   7           HB2      ASP   7  27.662   4.404   1.432
   39    HB3  ASP   7           HB3      ASP   7  29.226   3.788   1.938
   40    HA   PRO   8           HA       PRO   8  30.691   7.206   6.181
   41    HB2  PRO   8           HB2      PRO   8  29.120   5.015   7.488
   42    HB3  PRO   8           HB3      PRO   8  29.582   6.597   8.127
   43    HG2  PRO   8           HG2      PRO   8  27.115   6.135   7.196
   44    HG3  PRO   8           HG3      PRO   8  27.915   7.701   6.968
   45    HD2  PRO   8           HD2      PRO   8  27.316   5.589   4.991
   46    HD3  PRO   8           HD3      PRO   8  27.613   7.321   4.740
   47    H    ARG   9           H        ARG   9  30.169   3.915   5.102
   48    HA   ARG   9           HA       ARG   9  32.482   2.851   6.471
   49    HE   ARG   9           HE       ARG   9  28.476   1.690   4.678
   50    HB2  ARG   9           HB2      ARG   9  30.638   1.665   4.395
   51    HB3  ARG   9           HB3      ARG   9  31.911   0.779   5.234
   52    HG2  ARG   9           HG2      ARG   9  30.796   0.880   7.284
   53    HG3  ARG   9           HG3      ARG   9  29.725   2.175   6.740
   54    HD2  ARG   9           HD2      ARG   9  29.733  -0.649   5.677
   55    HD3  ARG   9           HD3      ARG   9  28.593  -0.009   6.860
   56   HH11  ARG   9          HH11      ARG   9  27.891  -1.700   5.307
   57   HH12  ARG   9          HH12      ARG   9  26.631  -1.832   4.121
   58   HH21  ARG   9          HH21      ARG   9  26.798   1.539   3.152
   59   HH22  ARG   9          HH22      ARG   9  25.995   0.016   2.894
   60    H    LEU  10           H        LEU  10  31.622   3.672   3.107
   61    HA   LEU  10           HA       LEU  10  34.266   2.866   2.243
   62    HG   LEU  10           HG       LEU  10  32.690   1.105   1.654
   63    HB2  LEU  10           HB2      LEU  10  31.880   3.733   0.612
   64    HB3  LEU  10           HB3      LEU  10  33.394   3.125  -0.032
   65   HD11  LEU  10          HD11      LEU  10  30.491   0.849   1.938
   66   HD12  LEU  10          HD12      LEU  10  30.113   1.439   0.318
   67   HD13  LEU  10          HD13      LEU  10  30.408   2.583   1.628
   68   HD21  LEU  10          HD21      LEU  10  31.525   0.364  -0.723
   69   HD22  LEU  10          HD22      LEU  10  33.231   0.194  -0.299
   70   HD23  LEU  10          HD23      LEU  10  32.682   1.607  -1.203
   71    H    ILE  11           H        ILE  11  32.588   5.727   3.045
   72    HA   ILE  11           HA       ILE  11  34.310   7.477   1.505
   73    HB   ILE  11           HB       ILE  11  32.019   8.182   2.348
   74   HG12  ILE  11          HG12      ILE  11  34.389   9.889   3.144
   75   HG13  ILE  11          HG13      ILE  11  33.652   9.819   1.545
   76   HG21  ILE  11          HG21      ILE  11  33.485   8.182   4.979
   77   HG22  ILE  11          HG22      ILE  11  31.997   7.330   4.562
   78   HG23  ILE  11          HG23      ILE  11  31.999   9.089   4.694
   79   HD11  ILE  11          HD11      ILE  11  32.975  11.804   2.785
   80   HD12  ILE  11          HD12      ILE  11  32.297  10.780   4.050
   81   HD13  ILE  11          HD13      ILE  11  31.602  10.758   2.430
   82    H    GLU  12           H        GLU  12  34.489   5.470   4.139
   83    HA   GLU  12           HA       GLU  12  36.737   6.849   5.406
   84    HB2  GLU  12           HB2      GLU  12  34.935   5.779   6.797
   85    HB3  GLU  12           HB3      GLU  12  35.447   4.219   6.167
   86    HG2  GLU  12           HG2      GLU  12  36.400   4.518   8.331
   87    HG3  GLU  12           HG3      GLU  12  37.695   4.624   7.136
   88    H    SER  13           H        SER  13  35.946   3.703   3.923
   89    HA   SER  13           HA       SER  13  38.751   2.994   3.943
   90    HG   SER  13           HG       SER  13  35.304   1.611   3.823
   91    HB2  SER  13           HB2      SER  13  37.894   0.759   3.197
   92    HB3  SER  13           HB3      SER  13  37.230   1.325   4.730
   93    H    LEU  14           H        LEU  14  36.315   3.725   1.478
   94    HA   LEU  14           HA       LEU  14  38.162   2.923  -0.623
   95    HG   LEU  14           HG       LEU  14  37.059   2.370  -2.758
   96    HB2  LEU  14           HB2      LEU  14  35.654   2.402  -0.614
   97    HB3  LEU  14           HB3      LEU  14  35.398   4.104  -0.936
   98   HD11  LEU  14          HD11      LEU  14  34.270   3.031  -3.479
   99   HD12  LEU  14          HD12      LEU  14  34.500   1.759  -2.280
  100   HD13  LEU  14          HD13      LEU  14  35.241   1.612  -3.874
  101   HD21  LEU  14          HD21      LEU  14  36.632   4.068  -4.392
  102   HD22  LEU  14          HD22      LEU  14  37.242   4.851  -2.936
  103   HD23  LEU  14          HD23      LEU  14  35.519   4.902  -3.308
  104    H    SER  15           H        SER  15  36.428   5.736   0.615
  105    HA   SER  15           HA       SER  15  37.470   7.522  -1.277
  106    HG   SER  15           HG       SER  15  37.277  10.056   0.553
  107    HB2  SER  15           HB2      SER  15  35.434   7.959   0.102
  108    HB3  SER  15           HB3      SER  15  36.488   8.230   1.490
  109    H    GLN  16           H        GLN  16  38.823   6.140   1.543
  110    HA   GLN  16           HA       GLN  16  40.788   8.019   2.243
  111    HB2  GLN  16           HB2      GLN  16  40.410   6.146   3.682
  112    HB3  GLN  16           HB3      GLN  16  40.716   5.001   2.389
  113    HG2  GLN  16           HG2      GLN  16  42.902   6.835   3.260
  114    HG3  GLN  16           HG3      GLN  16  42.498   5.428   4.243
  115   HE21  GLN  16          HE21      GLN  16  44.707   6.358   2.185
  116   HE22  GLN  16          HE22      GLN  16  44.989   4.905   1.291
  117    H    MET  17           H        MET  17  41.014   5.226   0.031
  118    HA   MET  17           HA       MET  17  43.571   6.116  -0.916
  119    HB2  MET  17           HB2      MET  17  43.496   4.161  -2.380
  120    HB3  MET  17           HB3      MET  17  43.100   3.729  -0.723
  121    HG2  MET  17           HG2      MET  17  40.700   3.768  -1.347
  122    HG3  MET  17           HG3      MET  17  41.181   4.053  -3.020
  123    HE1  MET  17           HE1      MET  17  42.455   2.095  -0.100
  124    HE2  MET  17           HE2      MET  17  42.641   0.436  -0.666
  125    HE3  MET  17           HE3      MET  17  41.054   1.026  -0.174
  126    H    LEU  18           H        LEU  18  40.258   6.462  -1.903
  127    HA   LEU  18           HA       LEU  18  40.710   7.150  -4.620
  128    HG   LEU  18           HG       LEU  18  38.489   9.225  -5.024
  129    HB2  LEU  18           HB2      LEU  18  38.498   6.556  -3.604
  130    HB3  LEU  18           HB3      LEU  18  38.495   8.119  -2.810
  131   HD11  LEU  18          HD11      LEU  18  39.263   8.009  -6.728
  132   HD12  LEU  18          HD12      LEU  18  37.648   7.307  -6.783
  133   HD13  LEU  18          HD13      LEU  18  38.933   6.481  -5.907
  134   HD21  LEU  18          HD21      LEU  18  36.229   9.096  -5.221
  135   HD22  LEU  18          HD22      LEU  18  36.403   8.257  -3.679
  136   HD23  LEU  18          HD23      LEU  18  36.214   7.333  -5.169
  137    H    SER  19           H        SER  19  40.982   8.903  -1.629
  138    HA   SER  19           HA       SER  19  41.287  11.453  -3.016
  139    HG   SER  19           HG       SER  19  42.145  12.937  -0.423
  140    HB2  SER  19           HB2      SER  19  39.932  11.244  -0.901
  141    HB3  SER  19           HB3      SER  19  41.432  10.893  -0.044
  142    H    MET  20           H        MET  20  43.214   8.893  -1.884
  143    HA   MET  20           HA       MET  20  45.536  10.596  -1.414
  144    HB2  MET  20           HB2      MET  20  44.843   8.605   0.059
  145    HB3  MET  20           HB3      MET  20  45.480   7.593  -1.230
  146    HG2  MET  20           HG2      MET  20  47.126   7.891   0.515
  147    HG3  MET  20           HG3      MET  20  47.666   8.643  -0.988
  148    HE1  MET  20           HE1      MET  20  45.315   9.280   1.780
  149    HE2  MET  20           HE2      MET  20  45.322  11.036   1.946
  150    HE3  MET  20           HE3      MET  20  46.409  10.054   2.931
  151    H    GLY  21           H        GLY  21  44.330   8.253  -3.740
  152    HA2  GLY  21           HA2      GLY  21  45.115   8.556  -6.054
  153    HA3  GLY  21           HA3      GLY  21  46.728   8.787  -5.384
  154    H    PHE  22           H        PHE  22  44.364   6.360  -4.404
  155    HA   PHE  22           HA       PHE  22  45.988   4.272  -5.649
  156    HD1  PHE  22           HD1      PHE  22  46.368   6.402  -2.454
  157    HD2  PHE  22           HD2      PHE  22  48.128   2.722  -3.640
  158    HE1  PHE  22           HE1      PHE  22  48.581   7.247  -1.786
  159    HE2  PHE  22           HE2      PHE  22  50.337   3.556  -2.977
  160    HZ   PHE  22           HZ       PHE  22  50.572   5.814  -2.048
  161    HB2  PHE  22           HB2      PHE  22  45.035   4.249  -2.765
  162    HB3  PHE  22           HB3      PHE  22  45.817   2.902  -3.590
  163    H    SER  23           H        SER  23  44.746   2.211  -5.781
  164    HA   SER  23           HA       SER  23  41.885   2.472  -5.431
  165    HG   SER  23           HG       SER  23  41.337   3.988  -8.143
  166    HB2  SER  23           HB2      SER  23  43.087   2.005  -8.181
  167    HB3  SER  23           HB3      SER  23  41.369   1.926  -7.791
  168    H    ASP  24           H        ASP  24  41.175   0.270  -7.087
  169    HA   ASP  24           HA       ASP  24  42.090  -1.952  -5.526
  170    HB2  ASP  24           HB2      ASP  24  40.778  -3.331  -7.118
  171    HB3  ASP  24           HB3      ASP  24  39.835  -2.008  -6.439
  172    H    GLU  25           H        GLU  25  43.940  -3.007  -5.800
  173    HA   GLU  25           HA       GLU  25  45.308  -2.715  -8.389
  174    HB2  GLU  25           HB2      GLU  25  46.387  -2.117  -6.081
  175    HB3  GLU  25           HB3      GLU  25  46.606  -3.855  -5.933
  176    HG2  GLU  25           HG2      GLU  25  47.855  -3.843  -8.063
  177    HG3  GLU  25           HG3      GLU  25  47.697  -2.086  -8.110
  178    H    GLY  26           H        GLY  26  43.384  -4.322  -8.794
  179    HA2  GLY  26           HA2      GLY  26  44.074  -6.672  -9.783
  180    HA3  GLY  26           HA3      GLY  26  44.083  -7.063  -8.068
  181    H    GLY  27           H        GLY  27  41.794  -4.822  -8.155
  182    HA2  GLY  27           HA2      GLY  27  39.495  -4.832  -8.735
  183    HA3  GLY  27           HA3      GLY  27  39.636  -6.540  -9.139
  184    H    TRP  28           H        TRP  28  41.183  -5.642  -6.262
  185    HA   TRP  28           HA       TRP  28  39.213  -7.170  -4.782
  186    HD1  TRP  28           HD1      TRP  28  43.585  -6.995  -5.663
  187    HE1  TRP  28           HE1      TRP  28  45.207  -5.058  -5.185
  188    HE3  TRP  28           HE3      TRP  28  40.982  -4.665  -1.938
  189    HZ2  TRP  28           HZ2      TRP  28  45.336  -2.810  -3.482
  190    HZ3  TRP  28           HZ3      TRP  28  41.911  -2.625  -0.942
  191    HH2  TRP  28           HH2      TRP  28  44.044  -1.720  -1.693
  192    HB2  TRP  28           HB2      TRP  28  40.978  -7.165  -2.986
  193    HB3  TRP  28           HB3      TRP  28  41.461  -7.924  -4.505
  194    H    LEU  29           H        LEU  29  39.773  -3.866  -5.255
  195    HA   LEU  29           HA       LEU  29  39.654  -2.891  -2.655
  196    HG   LEU  29           HG       LEU  29  37.279  -0.740  -3.811
  197    HB2  LEU  29           HB2      LEU  29  40.233  -1.242  -4.097
  198    HB3  LEU  29           HB3      LEU  29  39.085  -1.723  -5.317
  199   HD11  LEU  29          HD11      LEU  29  39.730   0.317  -2.419
  200   HD12  LEU  29          HD12      LEU  29  38.419  -0.638  -1.721
  201   HD13  LEU  29          HD13      LEU  29  38.123   1.019  -2.252
  202   HD21  LEU  29          HD21      LEU  29  39.396   0.805  -5.231
  203   HD22  LEU  29          HD22      LEU  29  38.109   1.662  -4.383
  204   HD23  LEU  29          HD23      LEU  29  37.713   0.531  -5.677
  205    H    THR  30           H        THR  30  37.120  -4.256  -4.570
  206    HA   THR  30           HA       THR  30  35.156  -3.472  -2.538
  207    HB   THR  30           HB       THR  30  33.516  -4.671  -4.020
  208    HG1  THR  30           HG1      THR  30  34.300  -5.816  -5.570
  209   HG21  THR  30          HG21      THR  30  33.397  -2.969  -5.737
  210   HG22  THR  30          HG22      THR  30  35.042  -2.451  -5.361
  211   HG23  THR  30          HG23      THR  30  33.759  -2.249  -4.168
  212    H    ARG  31           H        ARG  31  36.777  -6.292  -3.920
  213    HA   ARG  31           HA       ARG  31  35.481  -8.308  -2.457
  214    HE   ARG  31           HE       ARG  31  36.225 -10.836  -4.168
  215    HB2  ARG  31           HB2      ARG  31  38.400  -8.434  -3.175
  216    HB3  ARG  31           HB3      ARG  31  37.235  -9.746  -3.110
  217    HG2  ARG  31           HG2      ARG  31  37.204  -7.531  -5.148
  218    HG3  ARG  31           HG3      ARG  31  37.921  -9.122  -5.398
  219    HD2  ARG  31           HD2      ARG  31  35.021  -8.457  -4.931
  220    HD3  ARG  31           HD3      ARG  31  35.762  -9.127  -6.387
  221   HH11  ARG  31          HH11      ARG  31  33.713  -9.853  -6.396
  222   HH12  ARG  31          HH12      ARG  31  32.832 -11.345  -6.248
  223   HH21  ARG  31          HH21      ARG  31  35.056 -12.761  -3.939
  224   HH22  ARG  31          HH22      ARG  31  33.575 -12.990  -4.824
  225    H    LEU  32           H        LEU  32  38.726  -7.025  -1.876
  226    HA   LEU  32           HA       LEU  32  39.253  -8.173   0.569
  227    HG   LEU  32           HG       LEU  32  42.411  -6.166   0.514
  228    HB2  LEU  32           HB2      LEU  32  40.759  -6.855  -1.037
  229    HB3  LEU  32           HB3      LEU  32  40.168  -5.411  -0.238
  230   HD11  LEU  32          HD11      LEU  32  41.626  -4.817   2.129
  231   HD12  LEU  32          HD12      LEU  32  41.605  -6.319   3.053
  232   HD13  LEU  32          HD13      LEU  32  40.122  -5.718   2.312
  233   HD21  LEU  32          HD21      LEU  32  42.672  -8.357   0.731
  234   HD22  LEU  32          HD22      LEU  32  40.946  -8.641   0.952
  235   HD23  LEU  32          HD23      LEU  32  41.942  -8.149   2.321
  236    H    LEU  33           H        LEU  33  38.205  -4.805   0.061
  237    HA   LEU  33           HA       LEU  33  37.965  -4.100   2.696
  238    HG   LEU  33           HG       LEU  33  38.416  -1.765   2.312
  239    HB2  LEU  33           HB2      LEU  33  36.693  -3.085   0.207
  240    HB3  LEU  33           HB3      LEU  33  36.093  -2.497   1.751
  241   HD11  LEU  33          HD11      LEU  33  39.880  -1.470   0.207
  242   HD12  LEU  33          HD12      LEU  33  38.924  -2.798  -0.449
  243   HD13  LEU  33          HD13      LEU  33  39.867  -3.034   1.022
  244   HD21  LEU  33          HD21      LEU  33  37.003  -0.664  -0.096
  245   HD22  LEU  33          HD22      LEU  33  38.427   0.112   0.598
  246   HD23  LEU  33          HD23      LEU  33  36.965  -0.076   1.568
  247    H    GLN  34           H        GLN  34  35.077  -4.772   0.694
  248    HA   GLN  34           HA       GLN  34  33.225  -4.759   2.687
  249    HB2  GLN  34           HB2      GLN  34  33.369  -6.188   0.092
  250    HB3  GLN  34           HB3      GLN  34  32.075  -6.634   1.196
  251    HG2  GLN  34           HG2      GLN  34  31.005  -5.013   0.041
  252    HG3  GLN  34           HG3      GLN  34  31.750  -4.005   1.279
  253   HE21  GLN  34          HE21      GLN  34  33.261  -2.522   0.689
  254   HE22  GLN  34          HE22      GLN  34  33.718  -2.208  -0.951
  255    H    THR  35           H        THR  35  35.089  -7.628   1.698
  256    HA   THR  35           HA       THR  35  33.806  -9.382   3.501
  257    HB   THR  35           HB       THR  35  36.583  -9.638   2.333
  258    HG1  THR  35           HG1      THR  35  35.413  -9.484   0.561
  259   HG21  THR  35          HG21      THR  35  36.277 -11.998   2.458
  260   HG22  THR  35          HG22      THR  35  34.630 -11.806   3.053
  261   HG23  THR  35          HG23      THR  35  35.990 -11.321   4.062
  262    H    LYS  36           H        LYS  36  36.575  -7.247   3.857
  263    HA   LYS  36           HA       LYS  36  37.110  -8.291   6.539
  264    HB2  LYS  36           HB2      LYS  36  38.606  -6.549   4.633
  265    HB3  LYS  36           HB3      LYS  36  38.918  -6.358   6.352
  266    HG2  LYS  36           HG2      LYS  36  40.542  -7.855   5.476
  267    HG3  LYS  36           HG3      LYS  36  39.422  -8.794   6.461
  268    HD2  LYS  36           HD2      LYS  36  38.260  -9.539   4.446
  269    HD3  LYS  36           HD3      LYS  36  39.358  -8.576   3.452
  270    HE2  LYS  36           HE2      LYS  36  39.997 -10.948   3.502
  271    HE3  LYS  36           HE3      LYS  36  41.244  -9.910   4.200
  272    HZ1  LYS  36           HZ1      LYS  36  40.382 -12.102   5.387
  273    HZ2  LYS  36           HZ2      LYS  36  39.259 -11.008   6.039
  274    HZ3  LYS  36           HZ3      LYS  36  40.918 -10.754   6.266
  275    H    ASN  37           H        ASN  37  34.659  -6.694   5.875
  276    HA   ASN  37           HA       ASN  37  33.363  -5.097   6.855
  277    HB2  ASN  37           HB2      ASN  37  34.069  -6.143   8.954
  278    HB3  ASN  37           HB3      ASN  37  35.534  -5.163   8.974
  279   HD21  ASN  37          HD21      ASN  37  35.485  -3.419  10.154
  280   HD22  ASN  37          HD22      ASN  37  34.080  -2.552  10.652
  281    H    TYR  38           H        TYR  38  34.765  -4.155   4.800
  282    HA   TYR  38           HA       TYR  38  35.698  -2.328   3.792
  283    HD1  TYR  38           HD1      TYR  38  33.836  -0.884   2.345
  284    HD2  TYR  38           HD2      TYR  38  32.132  -2.066   6.054
  285    HE1  TYR  38           HE1      TYR  38  31.752  -1.486   1.190
  286    HE2  TYR  38           HE2      TYR  38  30.042  -2.668   4.914
  287    HH   TYR  38           HH       TYR  38  29.451  -3.408   2.434
  288    HB2  TYR  38           HB2      TYR  38  34.204  -0.938   6.030
  289    HB3  TYR  38           HB3      TYR  38  34.794  -0.162   4.563
  290    H    ASP  39           H        ASP  39  37.630  -3.491   5.122
  291    HA   ASP  39           HA       ASP  39  38.750  -1.680   7.097
  292    HB2  ASP  39           HB2      ASP  39  38.743  -4.363   6.992
  293    HB3  ASP  39           HB3      ASP  39  40.293  -4.054   6.213
  294    H    ILE  40           H        ILE  40  40.312  -0.295   6.774
  295    HA   ILE  40           HA       ILE  40  41.709  -0.262   4.203
  296    HB   ILE  40           HB       ILE  40  42.814   1.842   5.273
  297   HG12  ILE  40          HG12      ILE  40  41.596   1.257   7.518
  298   HG13  ILE  40          HG13      ILE  40  41.745   2.936   7.012
  299   HG21  ILE  40          HG21      ILE  40  41.526   2.994   3.868
  300   HG22  ILE  40          HG22      ILE  40  40.040   2.534   4.695
  301   HG23  ILE  40          HG23      ILE  40  40.769   1.443   3.518
  302   HD11  ILE  40          HD11      ILE  40  39.310   1.211   6.625
  303   HD12  ILE  40          HD12      ILE  40  39.469   2.914   6.193
  304   HD13  ILE  40          HD13      ILE  40  39.524   2.424   7.888
  305    H    GLY  41           H        GLY  41  42.040  -1.463   7.314
  306    HA2  GLY  41           HA2      GLY  41  44.786  -1.110   7.759
  307    HA3  GLY  41           HA3      GLY  41  43.796  -2.360   8.486
  308    H    ALA  42           H        ALA  42  43.004  -3.539   6.027
  309    HA   ALA  42           HA       ALA  42  45.487  -4.925   5.327
  310    HB1  ALA  42           HB1      ALA  42  42.635  -5.768   4.832
  311    HB2  ALA  42           HB2      ALA  42  43.658  -6.334   6.152
  312    HB3  ALA  42           HB3      ALA  42  44.076  -6.723   4.483
  313    H    ALA  43           H        ALA  43  43.040  -2.884   4.071
  314    HA   ALA  43           HA       ALA  43  43.383  -3.372   1.308
  315    HB1  ALA  43           HB1      ALA  43  42.689  -0.634   2.203
  316    HB2  ALA  43           HB2      ALA  43  41.601  -1.943   2.672
  317    HB3  ALA  43           HB3      ALA  43  41.944  -1.646   0.968
  318    H    LEU  44           H        LEU  44  45.002  -1.219   3.579
  319    HA   LEU  44           HA       LEU  44  46.452   0.229   1.637
  320    HG   LEU  44           HG       LEU  44  46.853   2.429   2.880
  321    HB2  LEU  44           HB2      LEU  44  46.536  -0.047   4.585
  322    HB3  LEU  44           HB3      LEU  44  48.003   0.532   3.808
  323   HD11  LEU  44          HD11      LEU  44  44.430   2.800   3.503
  324   HD12  LEU  44          HD12      LEU  44  44.373   1.082   3.910
  325   HD13  LEU  44          HD13      LEU  44  44.750   1.590   2.259
  326   HD21  LEU  44          HD21      LEU  44  47.370   2.118   5.511
  327   HD22  LEU  44          HD22      LEU  44  45.655   2.535   5.561
  328   HD23  LEU  44          HD23      LEU  44  46.805   3.622   4.781
  329    H    ASP  45           H        ASP  45  47.154  -2.706   3.443
  330    HA   ASP  45           HA       ASP  45  49.866  -2.960   2.877
  331    HB2  ASP  45           HB2      ASP  45  48.492  -4.421   4.413
  332    HB3  ASP  45           HB3      ASP  45  47.896  -5.251   2.978
  333    H    THR  46           H        THR  46  47.053  -3.732   0.887
  334    HA   THR  46           HA       THR  46  48.756  -4.817  -1.188
  335    HB   THR  46           HB       THR  46  46.505  -5.051  -2.398
  336    HG1  THR  46           HG1      THR  46  44.995  -3.983  -1.402
  337   HG21  THR  46          HG21      THR  46  46.795  -7.129  -1.710
  338   HG22  THR  46          HG22      THR  46  45.883  -6.717  -0.255
  339   HG23  THR  46          HG23      THR  46  47.642  -6.591  -0.259
  340    H    ILE  47           H        ILE  47  47.073  -1.773  -0.540
  341    HA   ILE  47           HA       ILE  47  47.517  -0.856  -3.253
  342    HB   ILE  47           HB       ILE  47  46.883   1.425  -2.431
  343   HG12  ILE  47          HG12      ILE  47  46.015  -0.050   0.053
  344   HG13  ILE  47          HG13      ILE  47  47.408   1.028  -0.040
  345   HG21  ILE  47          HG21      ILE  47  44.444   0.216  -1.755
  346   HG22  ILE  47          HG22      ILE  47  45.238  -0.870  -2.894
  347   HG23  ILE  47          HG23      ILE  47  44.956   0.812  -3.331
  348   HD11  ILE  47          HD11      ILE  47  44.534   1.790  -0.507
  349   HD12  ILE  47          HD12      ILE  47  45.919   2.877  -0.630
  350   HD13  ILE  47          HD13      ILE  47  45.498   2.157   0.925
  351    H    GLN  48           H        GLN  48  49.851  -1.739  -2.252
  352    HA   GLN  48           HA       GLN  48  52.026  -1.213  -2.489
  353    HB2  GLN  48           HB2      GLN  48  51.161   1.665  -2.783
  354    HB3  GLN  48           HB3      GLN  48  52.717   0.982  -3.240
  355    HG2  GLN  48           HG2      GLN  48  51.942   0.411  -5.239
  356    HG3  GLN  48           HG3      GLN  48  50.598  -0.475  -4.519
  357   HE21  GLN  48          HE21      GLN  48  48.620   0.299  -4.774
  358   HE22  GLN  48          HE22      GLN  48  48.212   1.888  -5.341
  359    H    TYR  49           H        TYR  49  50.352  -0.644   0.151
  360    HA   TYR  49           HA       TYR  49  52.672   0.491   1.587
  361    HD1  TYR  49           HD1      TYR  49  49.302   1.495   0.399
  362    HD2  TYR  49           HD2      TYR  49  51.428   3.037   3.742
  363    HE1  TYR  49           HE1      TYR  49  48.700   3.777  -0.278
  364    HE2  TYR  49           HE2      TYR  49  50.834   5.324   3.074
  365    HH   TYR  49           HH       TYR  49  49.305   6.013   0.029
  366    HB2  TYR  49           HB2      TYR  49  49.838   0.136   2.609
  367    HB3  TYR  49           HB3      TYR  49  51.188   0.759   3.548
  368    H    SER  50           H        SER  50  53.200  -1.914   0.712
  369    HA   SER  50           HA       SER  50  52.098  -4.036   2.212
  370    HG   SER  50           HG       SER  50  51.957  -4.199  -0.132
  371    HB2  SER  50           HB2      SER  50  54.670  -4.042   0.629
  372    HB3  SER  50           HB3      SER  50  53.705  -5.451   1.084
  373    H    LYS  51           H        LYS  51  54.214  -1.749   3.106
  374    HA   LYS  51           HA       LYS  51  55.108  -3.368   5.378
  375    HB2  LYS  51           HB2      LYS  51  56.967  -2.703   3.677
  376    HB3  LYS  51           HB3      LYS  51  56.779  -1.088   4.348
  377    HG2  LYS  51           HG2      LYS  51  57.283  -2.000   6.591
  378    HG3  LYS  51           HG3      LYS  51  57.560  -3.580   5.858
  379    HD2  LYS  51           HD2      LYS  51  59.353  -2.582   4.473
  380    HD3  LYS  51           HD3      LYS  51  59.102  -1.043   5.303
  381    HE2  LYS  51           HE2      LYS  51  59.595  -2.222   7.457
  382    HE3  LYS  51           HE3      LYS  51  60.035  -3.646   6.514
  383    HZ1  LYS  51           HZ1      LYS  51  61.592  -1.354   7.107
  384    HZ2  LYS  51           HZ2      LYS  51  61.434  -1.505   5.425
  385    HZ3  LYS  51           HZ3      LYS  51  62.067  -2.790   6.332
  386    H    HIS  52           H        HIS  52  56.331  -0.490   5.948
  387    HA   HIS  52           HA       HIS  52  53.826   0.727   6.862
  388    HD1  HIS  52           HD1      HIS  52  57.706   1.899   7.816
  389    HD2  HIS  52           HD2      HIS  52  56.768  -1.727   9.618
  390    HE1  HIS  52           HE1      HIS  52  59.910   0.824   8.423
  391    HB2  HIS  52           HB2      HIS  52  55.086   1.484   8.934
  392    HB3  HIS  52           HB3      HIS  52  54.693  -0.229   8.859
  Start of MODEL   21
    1    H1   GLY   1           1H       GLY   1  19.879   5.132  -2.422
    2    H2   GLY   1           2H       GLY   1  18.974   6.385  -1.731
    3    H3   GLY   1           3H       GLY   1  18.290   4.846  -1.911
    4    HA2  GLY   1           HA2      GLY   1  18.989   5.366   0.396
    5    HA3  GLY   1           HA3      GLY   1  19.706   3.909  -0.282
    6    H    SER   2           H        SER   2  21.871   3.736  -0.323
    7    HA   SER   2           HA       SER   2  23.429   6.184   0.180
    8    HG   SER   2           HG       SER   2  23.612   5.607   2.982
    9    HB2  SER   2           HB2      SER   2  23.953   3.429   1.320
   10    HB3  SER   2           HB3      SER   2  24.971   4.851   1.557
   11    HA   PRO   3           HA       PRO   3  25.310   4.740  -3.646
   12    HB2  PRO   3           HB2      PRO   3  26.888   6.926  -3.999
   13    HB3  PRO   3           HB3      PRO   3  25.170   6.902  -4.415
   14    HG2  PRO   3           HG2      PRO   3  26.520   8.034  -1.995
   15    HG3  PRO   3           HG3      PRO   3  25.181   8.700  -2.949
   16    HD2  PRO   3           HD2      PRO   3  24.816   7.414  -0.575
   17    HD3  PRO   3           HD3      PRO   3  23.607   7.416  -1.873
   18    HA   PRO   4           HA       PRO   4  29.036   3.122  -1.793
   19    HB2  PRO   4           HB2      PRO   4  30.074   1.908  -3.968
   20    HB3  PRO   4           HB3      PRO   4  28.667   1.268  -3.110
   21    HG2  PRO   4           HG2      PRO   4  28.787   2.850  -5.645
   22    HG3  PRO   4           HG3      PRO   4  27.758   1.465  -5.237
   23    HD2  PRO   4           HD2      PRO   4  26.912   4.072  -5.165
   24    HD3  PRO   4           HD3      PRO   4  26.210   2.778  -4.173
   25    H    GLU   5           H        GLU   5  29.066   5.895  -2.674
   26    HA   GLU   5           HA       GLU   5  31.890   6.091  -3.448
   27    HB2  GLU   5           HB2      GLU   5  29.653   7.808  -4.530
   28    HB3  GLU   5           HB3      GLU   5  31.363   8.050  -4.854
   29    HG2  GLU   5           HG2      GLU   5  29.939   5.512  -5.573
   30    HG3  GLU   5           HG3      GLU   5  29.993   6.908  -6.648
   31    H    ALA   6           H        ALA   6  29.550   6.804  -1.293
   32    HA   ALA   6           HA       ALA   6  31.172   8.554   0.259
   33    HB1  ALA   6           HB1      ALA   6  29.230   9.749  -1.556
   34    HB2  ALA   6           HB2      ALA   6  30.554  10.494  -0.660
   35    HB3  ALA   6           HB3      ALA   6  28.996  10.229   0.125
   36    H    ASP   7           H        ASP   7  29.890   6.088   0.606
   37    HA   ASP   7           HA       ASP   7  27.673   6.561   2.441
   38    HB2  ASP   7           HB2      ASP   7  27.538   4.557   1.034
   39    HB3  ASP   7           HB3      ASP   7  29.123   4.030   1.577
   40    HA   PRO   8           HA       PRO   8  30.113   7.256   6.081
   41    HB2  PRO   8           HB2      PRO   8  28.638   4.902   7.190
   42    HB3  PRO   8           HB3      PRO   8  28.928   6.489   7.915
   43    HG2  PRO   8           HG2      PRO   8  26.564   5.860   6.811
   44    HG3  PRO   8           HG3      PRO   8  27.233   7.496   6.717
   45    HD2  PRO   8           HD2      PRO   8  26.944   5.460   4.596
   46    HD3  PRO   8           HD3      PRO   8  27.089   7.222   4.463
   47    H    ARG   9           H        ARG   9  29.826   4.028   4.771
   48    HA   ARG   9           HA       ARG   9  32.098   2.932   6.168
   49    HE   ARG   9           HE       ARG   9  28.041  -1.099   6.302
   50    HB2  ARG   9           HB2      ARG   9  30.576   1.935   3.754
   51    HB3  ARG   9           HB3      ARG   9  31.720   0.995   4.719
   52    HG2  ARG   9           HG2      ARG   9  30.261   0.990   6.590
   53    HG3  ARG   9           HG3      ARG   9  29.200   2.190   5.844
   54    HD2  ARG   9           HD2      ARG   9  28.633   0.593   4.082
   55    HD3  ARG   9           HD3      ARG   9  29.696  -0.605   4.820
   56   HH11  ARG   9          HH11      ARG   9  27.363   2.047   4.890
   57   HH12  ARG   9          HH12      ARG   9  25.808   2.181   5.658
   58   HH21  ARG   9          HH21      ARG   9  26.027  -0.899   7.317
   59   HH22  ARG   9          HH22      ARG   9  25.046   0.507   7.033
   60    H    LEU  10           H        LEU  10  31.418   4.060   2.861
   61    HA   LEU  10           HA       LEU  10  34.149   3.493   2.115
   62    HG   LEU  10           HG       LEU  10  31.841   1.828   1.304
   63    HB2  LEU  10           HB2      LEU  10  31.701   4.171   0.502
   64    HB3  LEU  10           HB3      LEU  10  33.299   4.006  -0.207
   65   HD11  LEU  10          HD11      LEU  10  32.023   2.518  -1.580
   66   HD12  LEU  10          HD12      LEU  10  30.673   1.859  -0.654
   67   HD13  LEU  10          HD13      LEU  10  32.022   0.817  -1.111
   68   HD21  LEU  10          HD21      LEU  10  34.146   1.449   1.579
   69   HD22  LEU  10          HD22      LEU  10  34.509   1.939  -0.077
   70   HD23  LEU  10          HD23      LEU  10  33.663   0.422   0.228
   71    H    ILE  11           H        ILE  11  32.318   6.206   3.053
   72    HA   ILE  11           HA       ILE  11  34.006   8.149   1.718
   73    HB   ILE  11           HB       ILE  11  31.710   8.738   2.561
   74   HG12  ILE  11          HG12      ILE  11  33.997  10.337   3.727
   75   HG13  ILE  11          HG13      ILE  11  33.368  10.483   2.089
   76   HG21  ILE  11          HG21      ILE  11  33.028   8.269   5.213
   77   HG22  ILE  11          HG22      ILE  11  31.489   7.649   4.614
   78   HG23  ILE  11          HG23      ILE  11  31.649   9.352   5.045
   79   HD11  ILE  11          HD11      ILE  11  32.636  12.235   3.746
   80   HD12  ILE  11          HD12      ILE  11  31.680  10.969   4.519
   81   HD13  ILE  11          HD13      ILE  11  31.351  11.425   2.847
   82    H    GLU  12           H        GLU  12  34.164   5.968   4.258
   83    HA   GLU  12           HA       GLU  12  36.412   7.293   5.575
   84    HB2  GLU  12           HB2      GLU  12  34.691   6.297   7.006
   85    HB3  GLU  12           HB3      GLU  12  34.953   4.730   6.254
   86    HG2  GLU  12           HG2      GLU  12  36.034   4.786   8.387
   87    HG3  GLU  12           HG3      GLU  12  37.257   4.735   7.117
   88    H    SER  13           H        SER  13  35.674   4.047   4.260
   89    HA   SER  13           HA       SER  13  38.493   3.464   4.205
   90    HG   SER  13           HG       SER  13  37.109   1.058   5.787
   91    HB2  SER  13           HB2      SER  13  36.197   1.677   3.401
   92    HB3  SER  13           HB3      SER  13  37.837   1.181   3.819
   93    H    LEU  14           H        LEU  14  36.133   4.359   1.799
   94    HA   LEU  14           HA       LEU  14  37.879   3.397  -0.339
   95    HG   LEU  14           HG       LEU  14  36.437   5.217  -2.474
   96    HB2  LEU  14           HB2      LEU  14  35.515   2.977  -0.673
   97    HB3  LEU  14           HB3      LEU  14  35.138   4.666  -0.397
   98   HD11  LEU  14          HD11      LEU  14  37.201   3.585  -3.927
   99   HD12  LEU  14          HD12      LEU  14  36.233   2.319  -3.173
  100   HD13  LEU  14          HD13      LEU  14  37.658   2.948  -2.346
  101   HD21  LEU  14          HD21      LEU  14  34.452   3.441  -3.580
  102   HD22  LEU  14          HD22      LEU  14  34.472   5.203  -3.513
  103   HD23  LEU  14          HD23      LEU  14  33.838   4.278  -2.155
  104    H    SER  15           H        SER  15  36.346   6.329   0.889
  105    HA   SER  15           HA       SER  15  37.594   8.027  -0.943
  106    HG   SER  15           HG       SER  15  35.346   8.158  -0.719
  107    HB2  SER  15           HB2      SER  15  36.450   8.710   1.766
  108    HB3  SER  15           HB3      SER  15  36.824   9.872   0.489
  109    H    GLN  16           H        GLN  16  38.823   6.538   1.864
  110    HA   GLN  16           HA       GLN  16  40.874   8.353   2.579
  111    HB2  GLN  16           HB2      GLN  16  40.398   6.576   4.088
  112    HB3  GLN  16           HB3      GLN  16  40.563   5.359   2.834
  113    HG2  GLN  16           HG2      GLN  16  42.944   6.997   3.549
  114    HG3  GLN  16           HG3      GLN  16  42.425   5.719   4.651
  115   HE21  GLN  16          HE21      GLN  16  44.605   6.284   2.395
  116   HE22  GLN  16          HE22      GLN  16  44.725   4.728   1.646
  117    H    MET  17           H        MET  17  40.803   5.597   0.347
  118    HA   MET  17           HA       MET  17  43.462   6.259  -0.595
  119    HB2  MET  17           HB2      MET  17  43.174   4.161  -1.970
  120    HB3  MET  17           HB3      MET  17  43.136   3.941  -0.230
  121    HG2  MET  17           HG2      MET  17  41.416   2.597  -0.917
  122    HG3  MET  17           HG3      MET  17  40.561   4.085  -0.525
  123    HE1  MET  17           HE1      MET  17  42.522   3.309  -4.215
  124    HE2  MET  17           HE2      MET  17  41.291   2.075  -4.480
  125    HE3  MET  17           HE3      MET  17  42.292   2.021  -3.030
  126    H    LEU  18           H        LEU  18  40.202   6.764  -1.530
  127    HA   LEU  18           HA       LEU  18  40.611   7.036  -4.331
  128    HG   LEU  18           HG       LEU  18  38.503   9.083  -5.028
  129    HB2  LEU  18           HB2      LEU  18  38.402   6.689  -3.183
  130    HB3  LEU  18           HB3      LEU  18  38.483   8.359  -2.653
  131   HD11  LEU  18          HD11      LEU  18  39.209   7.500  -6.456
  132   HD12  LEU  18          HD12      LEU  18  37.513   7.024  -6.470
  133   HD13  LEU  18          HD13      LEU  18  38.657   6.175  -5.432
  134   HD21  LEU  18          HD21      LEU  18  36.200   7.369  -4.118
  135   HD22  LEU  18          HD22      LEU  18  36.132   8.473  -5.491
  136   HD23  LEU  18          HD23      LEU  18  36.411   9.101  -3.866
  137    H    SER  19           H        SER  19  40.702   9.294  -1.619
  138    HA   SER  19           HA       SER  19  41.023  11.624  -3.227
  139    HG   SER  19           HG       SER  19  40.803  10.367   0.266
  140    HB2  SER  19           HB2      SER  19  41.710  12.671  -1.022
  141    HB3  SER  19           HB3      SER  19  40.114  11.916  -1.039
  142    H    MET  20           H        MET  20  43.275   9.516  -1.483
  143    HA   MET  20           HA       MET  20  45.546  11.143  -1.951
  144    HB2  MET  20           HB2      MET  20  45.349   9.473  -0.115
  145    HB3  MET  20           HB3      MET  20  45.478   8.191  -1.311
  146    HG2  MET  20           HG2      MET  20  47.593   8.553  -0.203
  147    HG3  MET  20           HG3      MET  20  47.707   8.966  -1.915
  148    HE1  MET  20           HE1      MET  20  50.125  11.180  -1.296
  149    HE2  MET  20           HE2      MET  20  49.852   9.551  -0.678
  150    HE3  MET  20           HE3      MET  20  50.066  10.895   0.444
  151    H    GLY  21           H        GLY  21  44.028   8.590  -3.797
  152    HA2  GLY  21           HA2      GLY  21  44.390   8.425  -6.159
  153    HA3  GLY  21           HA3      GLY  21  46.004   9.087  -5.915
  154    H    PHE  22           H        PHE  22  44.298   6.395  -4.335
  155    HA   PHE  22           HA       PHE  22  46.485   4.643  -5.205
  156    HD1  PHE  22           HD1      PHE  22  48.183   4.377  -3.874
  157    HD2  PHE  22           HD2      PHE  22  45.314   5.299  -0.871
  158    HE1  PHE  22           HE1      PHE  22  49.963   5.324  -2.473
  159    HE2  PHE  22           HE2      PHE  22  47.092   6.257   0.536
  160    HZ   PHE  22           HZ       PHE  22  49.420   6.261  -0.267
  161    HB2  PHE  22           HB2      PHE  22  44.600   4.383  -2.843
  162    HB3  PHE  22           HB3      PHE  22  45.704   3.112  -3.365
  163    H    SER  23           H        SER  23  45.567   2.294  -5.454
  164    HA   SER  23           HA       SER  23  42.844   2.351  -6.434
  165    HG   SER  23           HG       SER  23  45.116   3.324  -9.168
  166    HB2  SER  23           HB2      SER  23  45.083   1.405  -8.248
  167    HB3  SER  23           HB3      SER  23  43.373   1.542  -8.649
  168    H    ASP  24           H        ASP  24  42.235   0.062  -7.222
  169    HA   ASP  24           HA       ASP  24  43.152  -1.904  -5.325
  170    HB2  ASP  24           HB2      ASP  24  41.704  -3.484  -6.578
  171    HB3  ASP  24           HB3      ASP  24  40.834  -2.037  -6.076
  172    H    GLU  25           H        GLU  25  44.520  -3.580  -5.712
  173    HA   GLU  25           HA       GLU  25  45.961  -3.475  -8.285
  174    HB2  GLU  25           HB2      GLU  25  47.061  -2.933  -5.885
  175    HB3  GLU  25           HB3      GLU  25  47.269  -4.677  -5.907
  176    HG2  GLU  25           HG2      GLU  25  48.441  -4.480  -8.069
  177    HG3  GLU  25           HG3      GLU  25  48.294  -2.726  -7.959
  178    H    GLY  26           H        GLY  26  44.017  -4.926  -8.753
  179    HA2  GLY  26           HA2      GLY  26  44.427  -7.402  -9.474
  180    HA3  GLY  26           HA3      GLY  26  44.396  -7.653  -7.732
  181    H    GLY  27           H        GLY  27  42.314  -5.181  -8.177
  182    HA2  GLY  27           HA2      GLY  27  40.035  -5.010  -8.588
  183    HA3  GLY  27           HA3      GLY  27  40.038  -6.680  -9.142
  184    H    TRP  28           H        TRP  28  41.451  -5.833  -6.102
  185    HA   TRP  28           HA       TRP  28  39.476  -7.498  -4.770
  186    HD1  TRP  28           HD1      TRP  28  43.772  -7.062  -5.502
  187    HE1  TRP  28           HE1      TRP  28  45.262  -5.047  -4.979
  188    HE3  TRP  28           HE3      TRP  28  41.059  -4.970  -1.721
  189    HZ2  TRP  28           HZ2      TRP  28  45.290  -2.832  -3.233
  190    HZ3  TRP  28           HZ3      TRP  28  41.879  -2.905  -0.678
  191    HH2  TRP  28           HH2      TRP  28  43.954  -1.860  -1.417
  192    HB2  TRP  28           HB2      TRP  28  41.126  -7.386  -2.852
  193    HB3  TRP  28           HB3      TRP  28  41.730  -8.150  -4.326
  194    H    LEU  29           H        LEU  29  40.290  -4.172  -5.051
  195    HA   LEU  29           HA       LEU  29  40.081  -3.168  -2.582
  196    HG   LEU  29           HG       LEU  29  38.034  -0.816  -3.049
  197    HB2  LEU  29           HB2      LEU  29  40.579  -1.717  -4.379
  198    HB3  LEU  29           HB3      LEU  29  39.001  -1.947  -5.108
  199   HD11  LEU  29          HD11      LEU  29  40.872   0.103  -2.653
  200   HD12  LEU  29          HD12      LEU  29  40.106  -1.155  -1.682
  201   HD13  LEU  29          HD13      LEU  29  39.461   0.487  -1.666
  202   HD21  LEU  29          HD21      LEU  29  37.880   0.854  -4.495
  203   HD22  LEU  29          HD22      LEU  29  39.281   0.252  -5.381
  204   HD23  LEU  29          HD23      LEU  29  39.503   1.377  -4.041
  205    H    THR  30           H        THR  30  37.215  -3.876  -4.570
  206    HA   THR  30           HA       THR  30  35.370  -3.071  -2.548
  207    HB   THR  30           HB       THR  30  33.738  -4.412  -3.951
  208    HG1  THR  30           HG1      THR  30  34.634  -5.819  -5.207
  209   HG21  THR  30          HG21      THR  30  34.822  -1.946  -4.464
  210   HG22  THR  30          HG22      THR  30  33.418  -2.649  -5.268
  211   HG23  THR  30          HG23      THR  30  35.018  -2.793  -5.997
  212    H    ARG  31           H        ARG  31  36.598  -6.213  -3.638
  213    HA   ARG  31           HA       ARG  31  35.184  -7.869  -1.913
  214    HE   ARG  31           HE       ARG  31  39.311  -9.373  -3.676
  215    HB2  ARG  31           HB2      ARG  31  37.953  -8.717  -2.435
  216    HB3  ARG  31           HB3      ARG  31  36.442  -9.539  -2.779
  217    HG2  ARG  31           HG2      ARG  31  36.147  -8.049  -4.753
  218    HG3  ARG  31           HG3      ARG  31  37.751  -7.393  -4.428
  219    HD2  ARG  31           HD2      ARG  31  37.060 -10.251  -5.090
  220    HD3  ARG  31           HD3      ARG  31  37.924  -9.101  -6.111
  221   HH11  ARG  31          HH11      ARG  31  38.516 -11.214  -6.540
  222   HH12  ARG  31          HH12      ARG  31  39.948 -12.195  -6.467
  223   HH21  ARG  31          HH21      ARG  31  41.201 -10.654  -3.573
  224   HH22  ARG  31          HH22      ARG  31  41.491 -11.867  -4.784
  225    H    LEU  32           H        LEU  32  38.570  -6.828  -1.534
  226    HA   LEU  32           HA       LEU  32  39.144  -7.851   0.935
  227    HG   LEU  32           HG       LEU  32  42.317  -5.964   0.705
  228    HB2  LEU  32           HB2      LEU  32  40.582  -6.568  -0.765
  229    HB3  LEU  32           HB3      LEU  32  40.039  -5.114   0.053
  230   HD11  LEU  32          HD11      LEU  32  41.696  -5.858   3.253
  231   HD12  LEU  32          HD12      LEU  32  40.127  -5.362   2.615
  232   HD13  LEU  32          HD13      LEU  32  41.578  -4.439   2.215
  233   HD21  LEU  32          HD21      LEU  32  42.435  -8.162   1.037
  234   HD22  LEU  32          HD22      LEU  32  40.709  -8.307   1.373
  235   HD23  LEU  32          HD23      LEU  32  41.817  -7.796   2.647
  236    H    LEU  33           H        LEU  33  37.907  -4.560   0.327
  237    HA   LEU  33           HA       LEU  33  37.688  -3.793   2.998
  238    HG   LEU  33           HG       LEU  33  38.613  -2.327   0.602
  239    HB2  LEU  33           HB2      LEU  33  36.171  -2.876   0.558
  240    HB3  LEU  33           HB3      LEU  33  36.016  -2.108   2.131
  241   HD11  LEU  33          HD11      LEU  33  36.410  -0.368   0.486
  242   HD12  LEU  33          HD12      LEU  33  37.613  -0.810  -0.727
  243   HD13  LEU  33          HD13      LEU  33  38.045   0.289   0.583
  244   HD21  LEU  33          HD21      LEU  33  39.004  -0.313   2.268
  245   HD22  LEU  33          HD22      LEU  33  39.306  -1.985   2.745
  246   HD23  LEU  33          HD23      LEU  33  37.806  -1.188   3.222
  247    H    GLN  34           H        GLN  34  34.928  -4.544   0.883
  248    HA   GLN  34           HA       GLN  34  32.914  -4.518   2.656
  249    HB2  GLN  34           HB2      GLN  34  33.414  -5.900   0.151
  250    HB3  GLN  34           HB3      GLN  34  32.191  -6.694   1.137
  251    HG2  GLN  34           HG2      GLN  34  30.890  -5.271  -0.086
  252    HG3  GLN  34           HG3      GLN  34  31.216  -4.266   1.323
  253   HE21  GLN  34          HE21      GLN  34  32.274  -2.380   1.059
  254   HE22  GLN  34          HE22      GLN  34  32.862  -1.790  -0.457
  255    H    THR  35           H        THR  35  34.675  -7.553   1.941
  256    HA   THR  35           HA       THR  35  33.253  -9.050   3.852
  257    HB   THR  35           HB       THR  35  35.116 -10.725   3.554
  258    HG1  THR  35           HG1      THR  35  36.067  -8.792   1.689
  259   HG21  THR  35          HG21      THR  35  33.270  -9.764   1.555
  260   HG22  THR  35          HG22      THR  35  33.733 -11.414   1.976
  261   HG23  THR  35          HG23      THR  35  34.708 -10.491   0.832
  262    H    LYS  36           H        LYS  36  36.088  -7.062   4.153
  263    HA   LYS  36           HA       LYS  36  36.627  -8.116   6.832
  264    HB2  LYS  36           HB2      LYS  36  38.251  -7.038   4.771
  265    HB3  LYS  36           HB3      LYS  36  38.332  -5.928   6.134
  266    HG2  LYS  36           HG2      LYS  36  38.827  -7.971   7.566
  267    HG3  LYS  36           HG3      LYS  36  39.091  -8.827   6.044
  268    HD2  LYS  36           HD2      LYS  36  40.864  -7.346   5.436
  269    HD3  LYS  36           HD3      LYS  36  40.511  -6.276   6.799
  270    HE2  LYS  36           HE2      LYS  36  41.594  -9.087   6.900
  271    HE3  LYS  36           HE3      LYS  36  42.424  -7.604   7.367
  272    HZ1  LYS  36           HZ1      LYS  36  41.718  -8.102   9.418
  273    HZ2  LYS  36           HZ2      LYS  36  40.560  -9.213   8.862
  274    HZ3  LYS  36           HZ3      LYS  36  40.192  -7.558   8.904
  275    H    ASN  37           H        ASN  37  34.213  -6.689   6.447
  276    HA   ASN  37           HA       ASN  37  32.978  -4.890   7.057
  277    HB2  ASN  37           HB2      ASN  37  33.323  -4.121   9.422
  278    HB3  ASN  37           HB3      ASN  37  33.114  -5.857   9.225
  279   HD21  ASN  37          HD21      ASN  37  35.109  -3.355  10.370
  280   HD22  ASN  37          HD22      ASN  37  36.410  -4.336  10.942
  281    H    TYR  38           H        TYR  38  34.770  -4.070   5.267
  282    HA   TYR  38           HA       TYR  38  35.776  -2.272   4.360
  283    HD1  TYR  38           HD1      TYR  38  32.455  -2.685   5.913
  284    HD2  TYR  38           HD2      TYR  38  33.792   0.205   3.096
  285    HE1  TYR  38           HE1      TYR  38  30.480  -3.132   4.525
  286    HE2  TYR  38           HE2      TYR  38  31.813  -0.225   1.707
  287    HH   TYR  38           HH       TYR  38  29.422  -2.692   2.631
  288    HB2  TYR  38           HB2      TYR  38  34.177  -0.809   6.468
  289    HB3  TYR  38           HB3      TYR  38  34.962  -0.045   5.089
  290    H    ASP  39           H        ASP  39  37.716  -3.329   5.346
  291    HA   ASP  39           HA       ASP  39  38.915  -1.619   7.426
  292    HB2  ASP  39           HB2      ASP  39  38.836  -3.984   7.995
  293    HB3  ASP  39           HB3      ASP  39  39.690  -4.399   6.510
  294    H    ILE  40           H        ILE  40  40.415  -0.211   6.855
  295    HA   ILE  40           HA       ILE  40  41.724  -0.498   4.266
  296    HB   ILE  40           HB       ILE  40  42.783   1.740   4.875
  297   HG12  ILE  40          HG12      ILE  40  41.923   1.380   7.368
  298   HG13  ILE  40          HG13      ILE  40  42.071   2.987   6.668
  299   HG21  ILE  40          HG21      ILE  40  39.960   2.382   4.736
  300   HG22  ILE  40          HG22      ILE  40  40.405   1.068   3.647
  301   HG23  ILE  40          HG23      ILE  40  41.238   2.620   3.541
  302   HD11  ILE  40          HD11      ILE  40  39.890   2.129   7.948
  303   HD12  ILE  40          HD12      ILE  40  39.477   1.639   6.305
  304   HD13  ILE  40          HD13      ILE  40  39.843   3.328   6.654
  305    H    GLY  41           H        GLY  41  42.149  -1.423   7.422
  306    HA2  GLY  41           HA2      GLY  41  44.882  -1.042   7.851
  307    HA3  GLY  41           HA3      GLY  41  43.927  -2.331   8.551
  308    H    ALA  42           H        ALA  42  43.147  -3.613   6.246
  309    HA   ALA  42           HA       ALA  42  45.662  -4.861   5.422
  310    HB1  ALA  42           HB1      ALA  42  43.693  -6.381   4.291
  311    HB2  ALA  42           HB2      ALA  42  42.906  -5.786   5.755
  312    HB3  ALA  42           HB3      ALA  42  44.424  -6.679   5.868
  313    H    ALA  43           H        ALA  43  43.164  -2.850   4.233
  314    HA   ALA  43           HA       ALA  43  43.476  -3.381   1.456
  315    HB1  ALA  43           HB1      ALA  43  41.909  -1.787   1.132
  316    HB2  ALA  43           HB2      ALA  43  42.670  -0.658   2.251
  317    HB3  ALA  43           HB3      ALA  43  41.667  -1.973   2.869
  318    H    LEU  44           H        LEU  44  44.990  -1.128   3.705
  319    HA   LEU  44           HA       LEU  44  46.381   0.419   1.822
  320    HG   LEU  44           HG       LEU  44  46.846   2.537   3.170
  321    HB2  LEU  44           HB2      LEU  44  46.548  -0.026   4.740
  322    HB3  LEU  44           HB3      LEU  44  48.006   0.584   3.970
  323   HD11  LEU  44          HD11      LEU  44  44.441   2.884   3.927
  324   HD12  LEU  44          HD12      LEU  44  44.392   1.137   4.190
  325   HD13  LEU  44          HD13      LEU  44  44.713   1.783   2.577
  326   HD21  LEU  44          HD21      LEU  44  47.023   3.584   5.129
  327   HD22  LEU  44          HD22      LEU  44  47.360   1.995   5.820
  328   HD23  LEU  44          HD23      LEU  44  45.717   2.640   5.848
  329    H    ASP  45           H        ASP  45  47.148  -2.659   3.308
  330    HA   ASP  45           HA       ASP  45  49.859  -2.847   2.737
  331    HB2  ASP  45           HB2      ASP  45  48.784  -4.544   4.054
  332    HB3  ASP  45           HB3      ASP  45  47.707  -4.967   2.729
  333    H    THR  46           H        THR  46  47.102  -3.604   0.623
  334    HA   THR  46           HA       THR  46  48.975  -4.162  -1.523
  335    HB   THR  46           HB       THR  46  46.739  -4.799  -2.700
  336    HG1  THR  46           HG1      THR  46  45.217  -4.092  -1.334
  337   HG21  THR  46          HG21      THR  46  48.401  -6.440  -1.999
  338   HG22  THR  46          HG22      THR  46  46.757  -7.006  -1.698
  339   HG23  THR  46          HG23      THR  46  47.742  -6.405  -0.364
  340    H    ILE  47           H        ILE  47  47.397  -1.397  -0.481
  341    HA   ILE  47           HA       ILE  47  47.236  -0.374  -3.229
  342    HB   ILE  47           HB       ILE  47  46.324   1.744  -2.261
  343   HG12  ILE  47          HG12      ILE  47  46.007   0.073   0.233
  344   HG13  ILE  47          HG13      ILE  47  47.096   1.448   0.047
  345   HG21  ILE  47          HG21      ILE  47  45.012  -0.792  -2.612
  346   HG22  ILE  47          HG22      ILE  47  44.472   0.826  -3.057
  347   HG23  ILE  47          HG23      ILE  47  44.153   0.208  -1.437
  348   HD11  ILE  47          HD11      ILE  47  45.309   2.967  -0.094
  349   HD12  ILE  47          HD12      ILE  47  44.914   1.877   1.236
  350   HD13  ILE  47          HD13      ILE  47  44.131   1.677  -0.332
  351    H    GLN  48           H        GLN  48  49.704  -1.013  -2.367
  352    HA   GLN  48           HA       GLN  48  51.791  -0.229  -2.704
  353    HB2  GLN  48           HB2      GLN  48  50.575   2.535  -2.757
  354    HB3  GLN  48           HB3      GLN  48  52.230   2.137  -3.195
  355    HG2  GLN  48           HG2      GLN  48  51.564   1.811  -5.281
  356    HG3  GLN  48           HG3      GLN  48  50.565   0.462  -4.733
  357   HE21  GLN  48          HE21      GLN  48  48.430   0.639  -4.926
  358   HE22  GLN  48          HE22      GLN  48  47.568   2.103  -5.267
  359    H    TYR  49           H        TYR  49  50.668  -0.653  -0.088
  360    HA   TYR  49           HA       TYR  49  52.846   0.647   1.351
  361    HD1  TYR  49           HD1      TYR  49  53.127   2.609   2.509
  362    HD2  TYR  49           HD2      TYR  49  48.913   2.556   1.938
  363    HE1  TYR  49           HE1      TYR  49  53.140   5.053   2.239
  364    HE2  TYR  49           HE2      TYR  49  48.912   4.994   1.665
  365    HH   TYR  49           HH       TYR  49  50.534   6.942   2.522
  366    HB2  TYR  49           HB2      TYR  49  49.984   0.575   2.307
  367    HB3  TYR  49           HB3      TYR  49  51.333   0.696   3.435
  368    H    SER  50           H        SER  50  53.232  -1.716   0.360
  369    HA   SER  50           HA       SER  50  52.208  -3.792   2.102
  370    HG   SER  50           HG       SER  50  52.015  -5.741   0.934
  371    HB2  SER  50           HB2      SER  50  52.469  -3.934  -0.465
  372    HB3  SER  50           HB3      SER  50  54.178  -4.229  -0.137
  373    H    LYS  51           H        LYS  51  54.269  -1.740   2.957
  374    HA   LYS  51           HA       LYS  51  56.242  -3.683   3.961
  375    HB2  LYS  51           HB2      LYS  51  56.713  -0.721   3.575
  376    HB3  LYS  51           HB3      LYS  51  57.899  -1.927   4.059
  377    HG2  LYS  51           HG2      LYS  51  57.518  -3.040   1.838
  378    HG3  LYS  51           HG3      LYS  51  56.571  -1.624   1.379
  379    HD2  LYS  51           HD2      LYS  51  58.529  -0.201   1.793
  380    HD3  LYS  51           HD3      LYS  51  59.469  -1.635   2.215
  381    HE2  LYS  51           HE2      LYS  51  58.295  -0.895  -0.459
  382    HE3  LYS  51           HE3      LYS  51  59.994  -1.125  -0.044
  383    HZ1  LYS  51           HZ1      LYS  51  59.584  -3.130  -1.001
  384    HZ2  LYS  51           HZ2      LYS  51  57.929  -3.119  -0.613
  385    HZ3  LYS  51           HZ3      LYS  51  59.075  -3.521   0.573
  386    H    HIS  52           H        HIS  52  53.579  -2.617   4.897
  387    HA   HIS  52           HA       HIS  52  52.527  -2.144   6.848
  388    HD1  HIS  52           HD1      HIS  52  54.576  -5.127   9.714
  389    HD2  HIS  52           HD2      HIS  52  52.770  -4.569   6.008
  390    HE1  HIS  52           HE1      HIS  52  53.809  -7.412   8.948
  391    HB2  HIS  52           HB2      HIS  52  55.222  -2.800   8.061
  392    HB3  HIS  52           HB3      HIS  52  53.755  -2.535   8.991
  Start of MODEL   22
    1    H1   GLY   1           1H       GLY   1  29.005  -4.276  -2.326
    2    H2   GLY   1           2H       GLY   1  29.794  -4.290  -3.823
    3    H3   GLY   1           3H       GLY   1  28.777  -5.573  -3.392
    4    HA2  GLY   1           HA2      GLY   1  27.649  -4.173  -4.961
    5    HA3  GLY   1           HA3      GLY   1  26.867  -4.074  -3.387
    6    H    SER   2           H        SER   2  26.063  -2.052  -4.522
    7    HA   SER   2           HA       SER   2  28.017   0.130  -4.271
    8    HG   SER   2           HG       SER   2  26.730  -1.154  -6.872
    9    HB2  SER   2           HB2      SER   2  25.350   0.123  -5.705
   10    HB3  SER   2           HB3      SER   2  26.539   1.426  -5.716
   11    HA   PRO   3           HA       PRO   3  25.431   1.127  -0.673
   12    HB2  PRO   3           HB2      PRO   3  27.761   2.215   0.568
   13    HB3  PRO   3           HB3      PRO   3  26.984   0.674   0.931
   14    HG2  PRO   3           HG2      PRO   3  29.514   0.967  -0.173
   15    HG3  PRO   3           HG3      PRO   3  28.531  -0.507  -0.245
   16    HD2  PRO   3           HD2      PRO   3  28.908   1.631  -2.304
   17    HD3  PRO   3           HD3      PRO   3  28.780  -0.130  -2.515
   18    HA   PRO   4           HA       PRO   4  24.850   5.554  -1.159
   19    HB2  PRO   4           HB2      PRO   4  26.209   6.077   1.446
   20    HB3  PRO   4           HB3      PRO   4  24.651   6.670   0.856
   21    HG2  PRO   4           HG2      PRO   4  24.750   4.723   2.662
   22    HG3  PRO   4           HG3      PRO   4  23.556   4.679   1.350
   23    HD2  PRO   4           HD2      PRO   4  26.079   3.118   1.677
   24    HD3  PRO   4           HD3      PRO   4  24.530   2.627   0.961
   25    H    GLU   5           H        GLU   5  26.001   6.972  -2.326
   26    HA   GLU   5           HA       GLU   5  28.802   6.492  -2.637
   27    HB2  GLU   5           HB2      GLU   5  27.077   7.164  -4.451
   28    HB3  GLU   5           HB3      GLU   5  27.329   8.806  -3.873
   29    HG2  GLU   5           HG2      GLU   5  29.645   8.727  -4.448
   30    HG3  GLU   5           HG3      GLU   5  29.546   7.006  -4.818
   31    H    ALA   6           H        ALA   6  30.138   7.159  -1.161
   32    HA   ALA   6           HA       ALA   6  31.345   8.575   0.194
   33    HB1  ALA   6           HB1      ALA   6  30.310  10.924   0.685
   34    HB2  ALA   6           HB2      ALA   6  29.395  10.615  -0.791
   35    HB3  ALA   6           HB3      ALA   6  31.159  10.632  -0.834
   36    H    ASP   7           H        ASP   7  29.890   6.633   0.950
   37    HA   ASP   7           HA       ASP   7  27.920   7.278   2.962
   38    HB2  ASP   7           HB2      ASP   7  27.898   5.172   1.574
   39    HB3  ASP   7           HB3      ASP   7  29.400   4.692   2.342
   40    HA   PRO   8           HA       PRO   8  30.837   8.355   6.205
   41    HB2  PRO   8           HB2      PRO   8  29.089   6.499   7.768
   42    HB3  PRO   8           HB3      PRO   8  29.691   8.104   8.198
   43    HG2  PRO   8           HG2      PRO   8  27.170   7.707   7.324
   44    HG3  PRO   8           HG3      PRO   8  28.072   9.189   6.977
   45    HD2  PRO   8           HD2      PRO   8  27.283   7.017   5.154
   46    HD3  PRO   8           HD3      PRO   8  27.792   8.677   4.785
   47    H    ARG   9           H        ARG   9  29.917   5.071   5.452
   48    HA   ARG   9           HA       ARG   9  32.029   3.751   6.861
   49    HE   ARG   9           HE       ARG   9  28.423   1.893   4.434
   50    HB2  ARG   9           HB2      ARG   9  30.241   2.861   4.592
   51    HB3  ARG   9           HB3      ARG   9  31.352   1.799   5.478
   52    HG2  ARG   9           HG2      ARG   9  30.127   2.363   7.573
   53    HG3  ARG   9           HG3      ARG   9  28.954   3.250   6.597
   54    HD2  ARG   9           HD2      ARG   9  29.598   0.310   6.399
   55    HD3  ARG   9           HD3      ARG   9  28.145   1.015   7.106
   56   HH11  ARG   9          HH11      ARG   9  27.598  -0.930   6.320
   57   HH12  ARG   9          HH12      ARG   9  26.637  -1.645   5.064
   58   HH21  ARG   9          HH21      ARG   9  27.134   0.979   2.796
   59   HH22  ARG   9          HH22      ARG   9  26.364  -0.556   3.061
   60    H    LEU  10           H        LEU  10  31.493   4.454   3.369
   61    HA   LEU  10           HA       LEU  10  34.214   3.608   2.845
   62    HG   LEU  10           HG       LEU  10  32.675   1.790   2.140
   63    HB2  LEU  10           HB2      LEU  10  32.065   4.405   0.886
   64    HB3  LEU  10           HB3      LEU  10  33.616   3.693   0.488
   65   HD11  LEU  10          HD11      LEU  10  30.240   1.507   1.280
   66   HD12  LEU  10          HD12      LEU  10  30.312   3.256   1.062
   67   HD13  LEU  10          HD13      LEU  10  30.567   2.555   2.661
   68   HD21  LEU  10          HD21      LEU  10  32.898   0.573   0.293
   69   HD22  LEU  10          HD22      LEU  10  33.176   2.083  -0.578
   70   HD23  LEU  10          HD23      LEU  10  31.553   1.401  -0.494
   71    H    ILE  11           H        ILE  11  32.418   6.582   3.039
   72    HA   ILE  11           HA       ILE  11  34.141   8.160   1.428
   73    HB   ILE  11           HB       ILE  11  31.855   8.838   2.325
   74   HG12  ILE  11          HG12      ILE  11  33.667  10.377   1.281
   75   HG13  ILE  11          HG13      ILE  11  32.302  11.115   2.108
   76   HG21  ILE  11          HG21      ILE  11  31.477   9.044   4.490
   77   HG22  ILE  11          HG22      ILE  11  32.791  10.210   4.647
   78   HG23  ILE  11          HG23      ILE  11  33.120   8.486   4.807
   79   HD11  ILE  11          HD11      ILE  11  35.159  10.948   2.942
   80   HD12  ILE  11          HD12      ILE  11  33.895  11.126   4.159
   81   HD13  ILE  11          HD13      ILE  11  34.079  12.342   2.895
   82    H    GLU  12           H        GLU  12  34.327   6.837   4.587
   83    HA   GLU  12           HA       GLU  12  36.800   8.299   5.185
   84    HB2  GLU  12           HB2      GLU  12  35.300   6.303   6.892
   85    HB3  GLU  12           HB3      GLU  12  36.681   7.265   7.395
   86    HG2  GLU  12           HG2      GLU  12  35.373   9.309   7.066
   87    HG3  GLU  12           HG3      GLU  12  33.983   8.334   6.590
   88    H    SER  13           H        SER  13  35.705   5.241   4.009
   89    HA   SER  13           HA       SER  13  38.258   3.972   4.611
   90    HG   SER  13           HG       SER  13  37.717   1.290   4.780
   91    HB2  SER  13           HB2      SER  13  36.181   2.751   5.145
   92    HB3  SER  13           HB3      SER  13  35.749   2.758   3.438
   93    H    LEU  14           H        LEU  14  36.167   4.134   1.705
   94    HA   LEU  14           HA       LEU  14  38.445   3.401   0.081
   95    HG   LEU  14           HG       LEU  14  37.828   2.448  -2.118
   96    HB2  LEU  14           HB2      LEU  14  36.149   2.354  -0.113
   97    HB3  LEU  14           HB3      LEU  14  35.575   3.883  -0.742
   98   HD11  LEU  14          HD11      LEU  14  36.341   0.695  -2.168
   99   HD12  LEU  14          HD12      LEU  14  35.838   1.603  -3.596
  100   HD13  LEU  14          HD13      LEU  14  34.930   1.750  -2.089
  101   HD21  LEU  14          HD21      LEU  14  37.601   4.400  -3.244
  102   HD22  LEU  14          HD22      LEU  14  35.943   4.647  -2.695
  103   HD23  LEU  14          HD23      LEU  14  36.273   3.537  -4.026
  104    H    SER  15           H        SER  15  36.168   6.039   0.520
  105    HA   SER  15           HA       SER  15  37.000   7.509  -1.684
  106    HG   SER  15           HG       SER  15  34.328   8.016  -1.539
  107    HB2  SER  15           HB2      SER  15  35.723   8.564   0.837
  108    HB3  SER  15           HB3      SER  15  35.778   9.389  -0.722
  109    H    GLN  16           H        GLN  16  38.369   7.256   1.508
  110    HA   GLN  16           HA       GLN  16  39.819   9.695   1.413
  111    HB2  GLN  16           HB2      GLN  16  41.148   8.786   3.286
  112    HB3  GLN  16           HB3      GLN  16  39.420   8.671   3.561
  113    HG2  GLN  16           HG2      GLN  16  40.205   6.652   4.348
  114    HG3  GLN  16           HG3      GLN  16  39.676   6.244   2.720
  115   HE21  GLN  16          HE21      GLN  16  40.986   4.599   2.231
  116   HE22  GLN  16          HE22      GLN  16  42.715   4.690   2.184
  117    H    MET  17           H        MET  17  40.432   6.496   0.187
  118    HA   MET  17           HA       MET  17  43.173   7.237  -0.490
  119    HB2  MET  17           HB2      MET  17  43.347   4.855  -1.263
  120    HB3  MET  17           HB3      MET  17  43.016   5.060   0.449
  121    HG2  MET  17           HG2      MET  17  40.597   4.662  -0.064
  122    HG3  MET  17           HG3      MET  17  41.086   4.238  -1.704
  123    HE1  MET  17           HE1      MET  17  43.865   1.754  -0.820
  124    HE2  MET  17           HE2      MET  17  43.202   2.908  -1.978
  125    HE3  MET  17           HE3      MET  17  42.580   1.259  -1.922
  126    H    LEU  18           H        LEU  18  40.068   6.586  -1.972
  127    HA   LEU  18           HA       LEU  18  40.826   6.218  -4.613
  128    HG   LEU  18           HG       LEU  18  38.619   7.993  -5.997
  129    HB2  LEU  18           HB2      LEU  18  38.540   5.928  -3.791
  130    HB3  LEU  18           HB3      LEU  18  38.394   7.660  -3.557
  131   HD11  LEU  18          HD11      LEU  18  39.874   6.125  -6.708
  132   HD12  LEU  18          HD12      LEU  18  38.272   5.935  -7.421
  133   HD13  LEU  18          HD13      LEU  18  38.725   4.990  -6.002
  134   HD21  LEU  18          HD21      LEU  18  36.433   6.022  -5.790
  135   HD22  LEU  18          HD22      LEU  18  36.409   7.697  -6.341
  136   HD23  LEU  18          HD23      LEU  18  36.422   7.338  -4.614
  137    H    SER  19           H        SER  19  40.269   9.270  -2.901
  138    HA   SER  19           HA       SER  19  41.066  10.749  -5.289
  139    HG   SER  19           HG       SER  19  38.865  10.998  -2.288
  140    HB2  SER  19           HB2      SER  19  40.309  12.741  -3.904
  141    HB3  SER  19           HB3      SER  19  39.057  11.575  -4.334
  142    H    MET  20           H        MET  20  42.825   9.339  -3.028
  143    HA   MET  20           HA       MET  20  44.530  11.685  -2.523
  144    HB2  MET  20           HB2      MET  20  43.577  10.440  -0.553
  145    HB3  MET  20           HB3      MET  20  44.564   9.065  -1.024
  146    HG2  MET  20           HG2      MET  20  46.574  10.246  -0.601
  147    HG3  MET  20           HG3      MET  20  45.713  11.774  -0.429
  148    HE1  MET  20           HE1      MET  20  45.853   8.207   0.736
  149    HE2  MET  20           HE2      MET  20  44.311   8.377   1.576
  150    HE3  MET  20           HE3      MET  20  45.811   8.278   2.498
  151    H    GLY  21           H        GLY  21  44.399   8.820  -4.331
  152    HA2  GLY  21           HA2      GLY  21  46.151   8.628  -6.040
  153    HA3  GLY  21           HA3      GLY  21  47.315   8.989  -4.768
  154    H    PHE  22           H        PHE  22  44.694   6.937  -3.955
  155    HA   PHE  22           HA       PHE  22  46.361   4.571  -4.404
  156    HD1  PHE  22           HD1      PHE  22  47.932   4.267  -2.965
  157    HD2  PHE  22           HD2      PHE  22  45.135   5.782  -0.140
  158    HE1  PHE  22           HE1      PHE  22  49.782   4.889  -1.476
  159    HE2  PHE  22           HE2      PHE  22  46.985   6.416   1.353
  160    HZ   PHE  22           HZ       PHE  22  49.311   5.966   0.686
  161    HB2  PHE  22           HB2      PHE  22  44.368   5.011  -2.165
  162    HB3  PHE  22           HB3      PHE  22  45.190   3.491  -2.506
  163    H    SER  23           H        SER  23  44.967   2.621  -4.790
  164    HA   SER  23           HA       SER  23  42.275   3.202  -5.609
  165    HG   SER  23           HG       SER  23  43.377   4.787  -6.929
  166    HB2  SER  23           HB2      SER  23  44.318   2.343  -7.684
  167    HB3  SER  23           HB3      SER  23  42.580   2.490  -7.957
  168    H    ASP  24           H        ASP  24  42.722   0.743  -7.513
  169    HA   ASP  24           HA       ASP  24  42.683  -1.247  -5.354
  170    HB2  ASP  24           HB2      ASP  24  41.393  -2.687  -6.981
  171    HB3  ASP  24           HB3      ASP  24  40.538  -1.275  -6.371
  172    H    GLU  25           H        GLU  25  44.450  -2.420  -5.247
  173    HA   GLU  25           HA       GLU  25  46.218  -2.660  -7.532
  174    HB2  GLU  25           HB2      GLU  25  46.363  -3.133  -4.632
  175    HB3  GLU  25           HB3      GLU  25  47.289  -4.253  -5.614
  176    HG2  GLU  25           HG2      GLU  25  47.567  -1.380  -6.248
  177    HG3  GLU  25           HG3      GLU  25  48.265  -1.937  -4.728
  178    H    GLY  26           H        GLY  26  44.019  -3.779  -8.351
  179    HA2  GLY  26           HA2      GLY  26  44.301  -6.049  -9.509
  180    HA3  GLY  26           HA3      GLY  26  44.234  -6.676  -7.867
  181    H    GLY  27           H        GLY  27  42.278  -4.009  -7.987
  182    HA2  GLY  27           HA2      GLY  27  40.018  -3.693  -8.510
  183    HA3  GLY  27           HA3      GLY  27  39.956  -5.339  -9.124
  184    H    TRP  28           H        TRP  28  41.396  -5.099  -6.054
  185    HA   TRP  28           HA       TRP  28  39.120  -6.415  -4.863
  186    HD1  TRP  28           HD1      TRP  28  43.553  -6.671  -5.175
  187    HE1  TRP  28           HE1      TRP  28  45.260  -4.873  -4.509
  188    HE3  TRP  28           HE3      TRP  28  40.742  -4.069  -1.796
  189    HZ2  TRP  28           HZ2      TRP  28  45.395  -2.640  -2.803
  190    HZ3  TRP  28           HZ3      TRP  28  41.729  -2.111  -0.695
  191    HH2  TRP  28           HH2      TRP  28  44.010  -1.411  -1.186
  192    HB2  TRP  28           HB2      TRP  28  40.640  -6.588  -2.850
  193    HB3  TRP  28           HB3      TRP  28  41.233  -7.387  -4.309
  194    H    LEU  29           H        LEU  29  40.261  -3.223  -5.130
  195    HA   LEU  29           HA       LEU  29  39.781  -2.180  -2.613
  196    HG   LEU  29           HG       LEU  29  38.167   0.419  -3.620
  197    HB2  LEU  29           HB2      LEU  29  40.839  -0.833  -4.264
  198    HB3  LEU  29           HB3      LEU  29  39.441  -0.901  -5.318
  199   HD11  LEU  29          HD11      LEU  29  39.903   1.705  -2.073
  200   HD12  LEU  29          HD12      LEU  29  40.757   0.168  -2.196
  201   HD13  LEU  29          HD13      LEU  29  39.111   0.215  -1.563
  202   HD21  LEU  29          HD21      LEU  29  40.668   1.871  -4.426
  203   HD22  LEU  29          HD22      LEU  29  39.022   2.491  -4.301
  204   HD23  LEU  29          HD23      LEU  29  39.449   1.380  -5.604
  205    H    THR  30           H        THR  30  37.464  -3.258  -4.942
  206    HA   THR  30           HA       THR  30  35.261  -2.026  -3.472
  207    HB   THR  30           HB       THR  30  33.859  -3.029  -5.281
  208    HG1  THR  30           HG1      THR  30  35.033  -4.737  -5.979
  209   HG21  THR  30          HG21      THR  30  35.416  -1.760  -7.163
  210   HG22  THR  30          HG22      THR  30  35.865  -0.970  -5.650
  211   HG23  THR  30          HG23      THR  30  34.176  -1.014  -6.155
  212    H    ARG  31           H        ARG  31  36.947  -5.032  -3.757
  213    HA   ARG  31           HA       ARG  31  34.752  -6.571  -2.596
  214    HE   ARG  31           HE       ARG  31  38.341  -8.880  -3.574
  215    HB2  ARG  31           HB2      ARG  31  37.325  -7.938  -2.921
  216    HB3  ARG  31           HB3      ARG  31  35.728  -8.414  -3.464
  217    HG2  ARG  31           HG2      ARG  31  35.924  -7.108  -5.447
  218    HG3  ARG  31           HG3      ARG  31  37.413  -6.356  -4.867
  219    HD2  ARG  31           HD2      ARG  31  36.959  -9.139  -5.872
  220    HD3  ARG  31           HD3      ARG  31  38.215  -7.982  -6.321
  221   HH11  ARG  31          HH11      ARG  31  39.430  -9.441  -6.861
  222   HH12  ARG  31          HH12      ARG  31  40.758 -10.446  -6.371
  223   HH21  ARG  31          HH21      ARG  31  40.076 -10.193  -2.948
  224   HH22  ARG  31          HH22      ARG  31  41.136 -10.862  -4.149
  225    H    LEU  32           H        LEU  32  38.194  -6.055  -1.932
  226    HA   LEU  32           HA       LEU  32  38.585  -7.404   0.358
  227    HG   LEU  32           HG       LEU  32  41.870  -5.708   0.593
  228    HB2  LEU  32           HB2      LEU  32  40.191  -5.985  -1.030
  229    HB3  LEU  32           HB3      LEU  32  39.684  -4.628  -0.045
  230   HD11  LEU  32          HD11      LEU  32  39.680  -5.559   2.649
  231   HD12  LEU  32          HD12      LEU  32  40.775  -4.267   2.156
  232   HD13  LEU  32          HD13      LEU  32  41.400  -5.672   3.020
  233   HD21  LEU  32          HD21      LEU  32  40.971  -8.044   0.238
  234   HD22  LEU  32          HD22      LEU  32  40.166  -7.861   1.799
  235   HD23  LEU  32          HD23      LEU  32  41.925  -7.774   1.696
  236    H    LEU  33           H        LEU  33  37.992  -3.889   0.543
  237    HA   LEU  33           HA       LEU  33  37.467  -4.028   3.301
  238    HG   LEU  33           HG       LEU  33  37.862  -2.159   0.234
  239    HB2  LEU  33           HB2      LEU  33  36.514  -1.642   2.881
  240    HB3  LEU  33           HB3      LEU  33  38.235  -1.957   2.750
  241   HD11  LEU  33          HD11      LEU  33  35.894  -1.676  -0.736
  242   HD12  LEU  33          HD12      LEU  33  35.468  -0.472   0.485
  243   HD13  LEU  33          HD13      LEU  33  35.233  -2.189   0.819
  244   HD21  LEU  33          HD21      LEU  33  37.708   0.342  -0.013
  245   HD22  LEU  33          HD22      LEU  33  38.963  -0.253   1.076
  246   HD23  LEU  33          HD23      LEU  33  37.467   0.412   1.733
  247    H    GLN  34           H        GLN  34  35.382  -4.398   0.576
  248    HA   GLN  34           HA       GLN  34  32.931  -3.780   1.821
  249    HB2  GLN  34           HB2      GLN  34  33.446  -4.129  -0.636
  250    HB3  GLN  34           HB3      GLN  34  33.350  -5.853  -0.322
  251    HG2  GLN  34           HG2      GLN  34  31.247  -5.385  -1.113
  252    HG3  GLN  34           HG3      GLN  34  31.011  -5.321   0.630
  253   HE21  GLN  34          HE21      GLN  34  32.680  -2.622   0.098
  254   HE22  GLN  34          HE22      GLN  34  31.404  -1.510  -0.225
  255    H    THR  35           H        THR  35  34.924  -6.686   1.896
  256    HA   THR  35           HA       THR  35  32.810  -8.104   3.344
  257    HB   THR  35           HB       THR  35  33.763  -9.379   1.549
  258    HG1  THR  35           HG1      THR  35  34.484 -10.187   4.142
  259   HG21  THR  35          HG21      THR  35  35.841  -8.850   0.913
  260   HG22  THR  35          HG22      THR  35  36.318 -10.077   2.087
  261   HG23  THR  35          HG23      THR  35  36.330  -8.372   2.537
  262    H    LYS  36           H        LYS  36  35.533  -6.240   4.017
  263    HA   LYS  36           HA       LYS  36  35.974  -7.633   6.572
  264    HB2  LYS  36           HB2      LYS  36  37.849  -5.841   5.022
  265    HB3  LYS  36           HB3      LYS  36  38.207  -6.564   6.584
  266    HG2  LYS  36           HG2      LYS  36  37.947  -8.804   5.567
  267    HG3  LYS  36           HG3      LYS  36  37.709  -8.029   3.999
  268    HD2  LYS  36           HD2      LYS  36  40.004  -8.755   4.204
  269    HD3  LYS  36           HD3      LYS  36  39.940  -6.992   4.205
  270    HE2  LYS  36           HE2      LYS  36  41.507  -7.798   5.882
  271    HE3  LYS  36           HE3      LYS  36  40.141  -6.989   6.647
  272    HZ1  LYS  36           HZ1      LYS  36  40.291  -8.856   7.924
  273    HZ2  LYS  36           HZ2      LYS  36  40.871  -9.833   6.660
  274    HZ3  LYS  36           HZ3      LYS  36  39.222  -9.436   6.736
  275    H    ASN  37           H        ASN  37  33.827  -5.834   6.391
  276    HA   ASN  37           HA       ASN  37  32.867  -3.986   7.260
  277    HB2  ASN  37           HB2      ASN  37  33.335  -3.465   9.565
  278    HB3  ASN  37           HB3      ASN  37  33.398  -5.208   9.339
  279   HD21  ASN  37          HD21      ASN  37  35.083  -6.238  10.168
  280   HD22  ASN  37          HD22      ASN  37  36.563  -5.501  10.685
  281    H    TYR  38           H        TYR  38  34.801  -3.469   5.331
  282    HA   TYR  38           HA       TYR  38  35.817  -1.769   4.290
  283    HD1  TYR  38           HD2      TYR  38  34.016   0.030   2.820
  284    HD2  TYR  38           HD1      TYR  38  32.465  -1.214   6.580
  285    HE1  TYR  38           HE2      TYR  38  31.848  -0.451   1.766
  286    HE2  TYR  38           HE1      TYR  38  30.301  -1.710   5.533
  287    HH   TYR  38           HH       TYR  38  29.311  -2.121   3.458
  288    HB2  TYR  38           HB2      TYR  38  34.585  -0.049   6.453
  289    HB3  TYR  38           HB3      TYR  38  35.216   0.519   4.904
  290    H    ASP  39           H        ASP  39  37.630  -2.992   5.077
  291    HA   ASP  39           HA       ASP  39  39.107  -1.891   7.315
  292    HB2  ASP  39           HB2      ASP  39  38.754  -4.405   6.619
  293    HB3  ASP  39           HB3      ASP  39  40.144  -4.099   5.583
  294    H    ILE  40           H        ILE  40  40.268  -0.145   6.905
  295    HA   ILE  40           HA       ILE  40  41.812   0.015   4.430
  296    HB   ILE  40           HB       ILE  40  42.482   2.300   5.351
  297   HG12  ILE  40          HG12      ILE  40  40.353   1.495   7.302
  298   HG13  ILE  40          HG13      ILE  40  41.856   2.361   7.587
  299   HG21  ILE  40          HG21      ILE  40  41.059   2.955   3.790
  300   HG22  ILE  40          HG22      ILE  40  39.701   2.708   4.888
  301   HG23  ILE  40          HG23      ILE  40  40.265   1.382   3.871
  302   HD11  ILE  40          HD11      ILE  40  39.431   3.512   7.584
  303   HD12  ILE  40          HD12      ILE  40  39.893   3.754   5.901
  304   HD13  ILE  40          HD13      ILE  40  40.923   4.368   7.195
  305    H    GLY  41           H        GLY  41  42.064  -1.267   7.420
  306    HA2  GLY  41           HA2      GLY  41  44.801  -0.620   7.962
  307    HA3  GLY  41           HA3      GLY  41  43.867  -1.882   8.744
  308    H    ALA  42           H        ALA  42  43.025  -3.064   6.302
  309    HA   ALA  42           HA       ALA  42  45.485  -4.487   5.588
  310    HB1  ALA  42           HB1      ALA  42  44.255  -6.362   5.258
  311    HB2  ALA  42           HB2      ALA  42  42.879  -5.470   4.609
  312    HB3  ALA  42           HB3      ALA  42  43.145  -5.534   6.352
  313    H    ALA  43           H        ALA  43  43.074  -2.387   4.332
  314    HA   ALA  43           HA       ALA  43  43.395  -2.900   1.571
  315    HB1  ALA  43           HB1      ALA  43  42.773  -0.126   2.359
  316    HB2  ALA  43           HB2      ALA  43  41.676  -1.371   2.962
  317    HB3  ALA  43           HB3      ALA  43  41.951  -1.199   1.228
  318    H    LEU  44           H        LEU  44  45.012  -0.625   3.761
  319    HA   LEU  44           HA       LEU  44  46.566   0.623   1.744
  320    HG   LEU  44           HG       LEU  44  46.703   2.859   2.794
  321    HB2  LEU  44           HB2      LEU  44  46.673   0.530   4.725
  322    HB3  LEU  44           HB3      LEU  44  48.078   1.120   3.851
  323   HD11  LEU  44          HD11      LEU  44  44.536   2.221   2.601
  324   HD12  LEU  44          HD12      LEU  44  44.409   3.149   4.095
  325   HD13  LEU  44          HD13      LEU  44  44.524   1.388   4.156
  326   HD21  LEU  44          HD21      LEU  44  47.270   2.641   5.617
  327   HD22  LEU  44          HD22      LEU  44  45.901   3.707   5.306
  328   HD23  LEU  44          HD23      LEU  44  47.453   4.018   4.530
  329    H    ASP  45           H        ASP  45  46.912  -2.303   3.549
  330    HA   ASP  45           HA       ASP  45  49.673  -2.791   3.010
  331    HB2  ASP  45           HB2      ASP  45  48.666  -4.040   4.784
  332    HB3  ASP  45           HB3      ASP  45  47.353  -4.584   3.752
  333    H    THR  46           H        THR  46  46.711  -4.120   1.590
  334    HA   THR  46           HA       THR  46  47.973  -5.563  -0.397
  335    HB   THR  46           HB       THR  46  45.664  -5.558  -1.482
  336    HG1  THR  46           HG1      THR  46  44.620  -3.818  -0.813
  337   HG21  THR  46          HG21      THR  46  45.119  -6.252   1.299
  338   HG22  THR  46          HG22      THR  46  46.595  -6.966   0.648
  339   HG23  THR  46          HG23      THR  46  45.052  -7.242  -0.160
  340    H    ILE  47           H        ILE  47  47.390  -2.104  -0.431
  341    HA   ILE  47           HA       ILE  47  47.574  -2.046  -3.347
  342    HB   ILE  47           HB       ILE  47  47.797   0.524  -2.845
  343   HG12  ILE  47          HG12      ILE  47  46.444  -0.490  -0.343
  344   HG13  ILE  47          HG13      ILE  47  48.033   0.264  -0.421
  345   HG21  ILE  47          HG21      ILE  47  45.143  -0.837  -2.472
  346   HG22  ILE  47          HG22      ILE  47  45.938  -0.603  -4.026
  347   HG23  ILE  47          HG23      ILE  47  45.438   0.791  -3.073
  348   HD11  ILE  47          HD11      ILE  47  47.182   2.343  -0.620
  349   HD12  ILE  47          HD12      ILE  47  45.819   1.589   0.210
  350   HD13  ILE  47          HD13      ILE  47  45.779   1.798  -1.540
  351    H    GLN  48           H        GLN  48  49.658  -1.460  -0.577
  352    HA   GLN  48           HA       GLN  48  51.987  -1.448  -2.267
  353    HB2  GLN  48           HB2      GLN  48  51.074   1.101  -0.937
  354    HB3  GLN  48           HB3      GLN  48  52.772   0.809  -1.279
  355    HG2  GLN  48           HG2      GLN  48  52.495   1.538  -3.347
  356    HG3  GLN  48           HG3      GLN  48  51.287   0.287  -3.646
  357   HE21  GLN  48          HE21      GLN  48  49.346   0.964  -4.190
  358   HE22  GLN  48          HE22      GLN  48  48.662   2.524  -3.838
  359    H    TYR  49           H        TYR  49  50.687  -0.705   0.935
  360    HA   TYR  49           HA       TYR  49  53.180  -1.060   2.254
  361    HD1  TYR  49           HD1      TYR  49  53.781   0.749   3.586
  362    HD2  TYR  49           HD2      TYR  49  49.642   1.431   2.887
  363    HE1  TYR  49           HE1      TYR  49  54.213   3.159   3.409
  364    HE2  TYR  49           HE2      TYR  49  50.064   3.845   2.709
  365    HH   TYR  49           HH       TYR  49  52.695   5.203   2.051
  366    HB2  TYR  49           HB2      TYR  49  50.355  -0.717   3.250
  367    HB3  TYR  49           HB3      TYR  49  51.726  -0.886   4.343
  368    H    SER  50           H        SER  50  52.430  -3.426   0.793
  369    HA   SER  50           HA       SER  50  51.972  -5.361   2.951
  370    HG   SER  50           HG       SER  50  50.380  -7.002   1.997
  371    HB2  SER  50           HB2      SER  50  50.826  -5.386   0.554
  372    HB3  SER  50           HB3      SER  50  52.327  -6.196   0.097
  373    H    LYS  51           H        LYS  51  54.357  -3.838   2.860
  374    HA   LYS  51           HA       LYS  51  56.345  -5.936   2.675
  375    HB2  LYS  51           HB2      LYS  51  57.821  -4.509   1.238
  376    HB3  LYS  51           HB3      LYS  51  56.399  -5.132   0.411
  377    HG2  LYS  51           HG2      LYS  51  55.290  -2.926   0.846
  378    HG3  LYS  51           HG3      LYS  51  56.842  -2.337   1.441
  379    HD2  LYS  51           HD2      LYS  51  56.304  -3.411  -1.329
  380    HD3  LYS  51           HD3      LYS  51  56.464  -1.709  -0.898
  381    HE2  LYS  51           HE2      LYS  51  58.770  -2.180  -0.112
  382    HE3  LYS  51           HE3      LYS  51  58.588  -3.835  -0.687
  383    HZ1  LYS  51           HZ1      LYS  51  59.466  -3.015  -2.558
  384    HZ2  LYS  51           HZ2      LYS  51  59.070  -1.406  -2.181
  385    HZ3  LYS  51           HZ3      LYS  51  57.897  -2.430  -2.866
  386    H    HIS  52           H        HIS  52  58.079  -5.566   4.012
  387    HA   HIS  52           HA       HIS  52  58.018  -3.023   5.489
  388    HD1  HIS  52           HD1      HIS  52  56.469  -2.691   7.416
  389    HD2  HIS  52           HD2      HIS  52  56.156  -6.835   7.243
  390    HE1  HIS  52           HE1      HIS  52  54.120  -3.260   8.170
  391    HB2  HIS  52           HB2      HIS  52  58.519  -5.809   6.551
  392    HB3  HIS  52           HB3      HIS  52  58.846  -4.343   7.470
  Start of MODEL   23
    1    H1   GLY   1           1H       GLY   1  20.268   4.771  -4.648
    2    H2   GLY   1           2H       GLY   1  19.802   5.626  -3.262
    3    H3   GLY   1           3H       GLY   1  18.844   4.346  -3.832
    4    HA2  GLY   1           HA2      GLY   1  19.958   3.412  -2.050
    5    HA3  GLY   1           HA3      GLY   1  20.858   2.876  -3.463
    6    H    SER   2           H        SER   2  22.362   2.617  -1.458
    7    HA   SER   2           HA       SER   2  23.666   5.025  -0.576
    8    HG   SER   2           HG       SER   2  23.265   2.047   1.507
    9    HB2  SER   2           HB2      SER   2  24.566   2.156  -0.222
   10    HB3  SER   2           HB3      SER   2  25.071   3.554   0.731
   11    HA   PRO   3           HA       PRO   3  26.368   5.060  -4.148
   12    HB2  PRO   3           HB2      PRO   3  27.715   7.319  -3.500
   13    HB3  PRO   3           HB3      PRO   3  26.081   7.339  -4.174
   14    HG2  PRO   3           HG2      PRO   3  26.965   7.650  -1.333
   15    HG3  PRO   3           HG3      PRO   3  25.701   8.524  -2.219
   16    HD2  PRO   3           HD2      PRO   3  25.184   6.476  -0.493
   17    HD3  PRO   3           HD3      PRO   3  24.146   6.872  -1.879
   18    HA   PRO   4           HA       PRO   4  29.811   2.994  -2.179
   19    HB2  PRO   4           HB2      PRO   4  30.931   2.721  -4.864
   20    HB3  PRO   4           HB3      PRO   4  30.343   1.470  -3.768
   21    HG2  PRO   4           HG2      PRO   4  29.038   2.150  -6.043
   22    HG3  PRO   4           HG3      PRO   4  28.200   1.563  -4.595
   23    HD2  PRO   4           HD2      PRO   4  28.503   4.364  -5.608
   24    HD3  PRO   4           HD3      PRO   4  27.090   3.574  -4.876
   25    H    GLU   5           H        GLU   5  29.817   5.984  -2.810
   26    HA   GLU   5           HA       GLU   5  32.698   6.292  -2.482
   27    HB2  GLU   5           HB2      GLU   5  31.104   7.866  -4.520
   28    HB3  GLU   5           HB3      GLU   5  32.747   8.244  -4.031
   29    HG2  GLU   5           HG2      GLU   5  33.474   6.052  -4.901
   30    HG3  GLU   5           HG3      GLU   5  31.827   5.757  -5.455
   31    H    ALA   6           H        ALA   6  30.033   6.550  -1.015
   32    HA   ALA   6           HA       ALA   6  30.704   8.800   0.602
   33    HB1  ALA   6           HB1      ALA   6  29.265   9.481  -1.668
   34    HB2  ALA   6           HB2      ALA   6  29.432  10.448  -0.203
   35    HB3  ALA   6           HB3      ALA   6  28.044   9.376  -0.399
   36    H    ASP   7           H        ASP   7  29.751   5.916   0.364
   37    HA   ASP   7           HA       ASP   7  27.365   5.727   1.953
   38    HB2  ASP   7           HB2      ASP   7  28.415   3.955   0.359
   39    HB3  ASP   7           HB3      ASP   7  29.537   3.632   1.671
   40    HA   PRO   8           HA       PRO   8  29.004   7.004   5.904
   41    HB2  PRO   8           HB2      PRO   8  27.853   4.377   6.774
   42    HB3  PRO   8           HB3      PRO   8  27.729   5.963   7.542
   43    HG2  PRO   8           HG2      PRO   8  25.741   4.930   6.038
   44    HG3  PRO   8           HG3      PRO   8  26.063   6.669   6.131
   45    HD2  PRO   8           HD2      PRO   8  26.454   4.830   3.879
   46    HD3  PRO   8           HD3      PRO   8  26.432   6.603   3.891
   47    H    ARG   9           H        ARG   9  29.552   3.774   4.686
   48    HA   ARG   9           HA       ARG   9  31.911   3.349   6.343
   49    HE   ARG   9           HE       ARG   9  31.644  -0.505   7.249
   50    HB2  ARG   9           HB2      ARG   9  30.625   1.642   4.203
   51    HB3  ARG   9           HB3      ARG   9  31.967   1.143   5.248
   52    HG2  ARG   9           HG2      ARG   9  29.204   1.894   6.202
   53    HG3  ARG   9           HG3      ARG   9  29.808   0.246   6.013
   54    HD2  ARG   9           HD2      ARG   9  31.184   2.276   7.761
   55    HD3  ARG   9           HD3      ARG   9  29.877   1.256   8.361
   56   HH11  ARG   9          HH11      ARG   9  31.879   2.002   9.669
   57   HH12  ARG   9          HH12      ARG   9  33.122   1.197  10.577
   58   HH21  ARG   9          HH21      ARG   9  33.255  -1.597   8.462
   59   HH22  ARG   9          HH22      ARG   9  33.901  -0.859   9.892
   60    H    LEU  10           H        LEU  10  31.107   3.516   2.866
   61    HA   LEU  10           HA       LEU  10  33.808   3.311   2.066
   62    HG   LEU  10           HG       LEU  10  31.390   1.629   1.460
   63    HB2  LEU  10           HB2      LEU  10  31.295   3.935   0.523
   64    HB3  LEU  10           HB3      LEU  10  32.865   3.668  -0.215
   65   HD11  LEU  10          HD11      LEU  10  31.296   0.483  -0.852
   66   HD12  LEU  10          HD12      LEU  10  31.512   2.113  -1.488
   67   HD13  LEU  10          HD13      LEU  10  30.119   1.741  -0.471
   68   HD21  LEU  10          HD21      LEU  10  33.610   1.037   1.644
   69   HD22  LEU  10          HD22      LEU  10  34.023   1.672   0.051
   70   HD23  LEU  10          HD23      LEU  10  33.130   0.159   0.190
   71    H    ILE  11           H        ILE  11  31.901   5.991   2.995
   72    HA   ILE  11           HA       ILE  11  33.271   7.959   1.410
   73    HB   ILE  11           HB       ILE  11  31.073   8.440   2.458
   74   HG12  ILE  11          HG12      ILE  11  33.319  10.234   3.406
   75   HG13  ILE  11          HG13      ILE  11  32.542  10.296   1.826
   76   HG21  ILE  11          HG21      ILE  11  32.633   8.186   5.011
   77   HG22  ILE  11          HG22      ILE  11  31.155   7.347   4.537
   78   HG23  ILE  11          HG23      ILE  11  31.111   9.070   4.912
   79   HD11  ILE  11          HD11      ILE  11  30.393  10.787   3.025
   80   HD12  ILE  11          HD12      ILE  11  31.628  12.042   3.123
   81   HD13  ILE  11          HD13      ILE  11  31.347  10.970   4.494
   82    H    GLU  12           H        GLU  12  33.856   6.159   4.262
   83    HA   GLU  12           HA       GLU  12  36.255   7.723   4.915
   84    HB2  GLU  12           HB2      GLU  12  34.941   5.429   6.379
   85    HB3  GLU  12           HB3      GLU  12  36.425   6.219   6.891
   86    HG2  GLU  12           HG2      GLU  12  35.167   8.348   7.074
   87    HG3  GLU  12           HG3      GLU  12  33.690   7.458   6.702
   88    H    SER  13           H        SER  13  35.252   4.416   4.097
   89    HA   SER  13           HA       SER  13  37.980   3.535   4.137
   90    HG   SER  13           HG       SER  13  36.338   1.303   5.779
   91    HB2  SER  13           HB2      SER  13  35.488   1.988   3.417
   92    HB3  SER  13           HB3      SER  13  37.068   1.307   3.804
   93    H    LEU  14           H        LEU  14  35.634   4.156   1.535
   94    HA   LEU  14           HA       LEU  14  37.536   3.044  -0.390
   95    HG   LEU  14           HG       LEU  14  36.678   2.618  -2.614
   96    HB2  LEU  14           HB2      LEU  14  35.066   2.502  -0.509
   97    HB3  LEU  14           HB3      LEU  14  34.782   4.181  -0.919
   98   HD11  LEU  14          HD11      LEU  14  34.876   1.070  -2.455
   99   HD12  LEU  14          HD12      LEU  14  34.734   1.902  -4.002
  100   HD13  LEU  14          HD13      LEU  14  33.681   2.351  -2.661
  101   HD21  LEU  14          HD21      LEU  14  34.570   4.651  -3.324
  102   HD22  LEU  14          HD22      LEU  14  35.887   4.066  -4.340
  103   HD23  LEU  14          HD23      LEU  14  36.240   5.059  -2.927
  104    H    SER  15           H        SER  15  35.863   5.974   0.511
  105    HA   SER  15           HA       SER  15  36.962   7.534  -1.556
  106    HG   SER  15           HG       SER  15  36.888   9.943  -0.773
  107    HB2  SER  15           HB2      SER  15  34.849   8.058  -0.291
  108    HB3  SER  15           HB3      SER  15  35.868   8.579   1.052
  109    H    GLN  16           H        GLN  16  38.291   6.406   1.359
  110    HA   GLN  16           HA       GLN  16  40.073   8.460   2.044
  111    HB2  GLN  16           HB2      GLN  16  39.687   6.470   3.456
  112    HB3  GLN  16           HB3      GLN  16  40.482   5.463   2.257
  113    HG2  GLN  16           HG2      GLN  16  41.991   7.758   3.388
  114    HG3  GLN  16           HG3      GLN  16  41.739   6.341   4.400
  115   HE21  GLN  16          HE21      GLN  16  43.766   7.741   2.178
  116   HE22  GLN  16          HE22      GLN  16  44.629   6.334   1.663
  117    H    MET  17           H        MET  17  40.696   5.564   0.047
  118    HA   MET  17           HA       MET  17  43.134   6.751  -0.930
  119    HB2  MET  17           HB2      MET  17  43.426   4.679  -2.199
  120    HB3  MET  17           HB3      MET  17  43.089   4.352  -0.508
  121    HG2  MET  17           HG2      MET  17  40.985   4.258  -2.646
  122    HG3  MET  17           HG3      MET  17  41.959   2.864  -2.188
  123    HE1  MET  17           HE1      MET  17  42.023   3.677   1.233
  124    HE2  MET  17           HE2      MET  17  42.267   2.206   0.292
  125    HE3  MET  17           HE3      MET  17  40.980   2.279   1.494
  126    H    LEU  18           H        LEU  18  39.825   6.584  -1.940
  127    HA   LEU  18           HA       LEU  18  40.245   6.859  -4.733
  128    HG   LEU  18           HG       LEU  18  37.934   8.544  -5.553
  129    HB2  LEU  18           HB2      LEU  18  38.086   6.219  -3.629
  130    HB3  LEU  18           HB3      LEU  18  37.903   7.893  -3.137
  131   HD11  LEU  18          HD11      LEU  18  39.053   6.760  -6.601
  132   HD12  LEU  18          HD12      LEU  18  37.378   6.650  -7.141
  133   HD13  LEU  18          HD13      LEU  18  37.974   5.560  -5.890
  134   HD21  LEU  18          HD21      LEU  18  35.861   7.189  -4.073
  135   HD22  LEU  18          HD22      LEU  18  35.661   6.958  -5.811
  136   HD23  LEU  18          HD23      LEU  18  35.753   8.588  -5.142
  137    H    SER  19           H        SER  19  40.098   9.169  -2.096
  138    HA   SER  19           HA       SER  19  40.266  11.389  -3.986
  139    HG   SER  19           HG       SER  19  37.727  12.081  -2.251
  140    HB2  SER  19           HB2      SER  19  40.001  11.516  -0.974
  141    HB3  SER  19           HB3      SER  19  39.692  12.811  -2.134
  142    H    MET  20           H        MET  20  42.136   9.843  -1.418
  143    HA   MET  20           HA       MET  20  44.095  11.861  -1.197
  144    HB2  MET  20           HB2      MET  20  43.646  10.085   0.502
  145    HB3  MET  20           HB3      MET  20  44.432   8.929  -0.565
  146    HG2  MET  20           HG2      MET  20  46.515  10.188  -0.407
  147    HG3  MET  20           HG3      MET  20  45.730  11.357   0.655
  148    HE1  MET  20           HE1      MET  20  48.270  10.328   1.354
  149    HE2  MET  20           HE2      MET  20  48.333   9.255   2.752
  150    HE3  MET  20           HE3      MET  20  47.586  10.847   2.892
  151    H    GLY  21           H        GLY  21  43.822   9.105  -3.360
  152    HA2  GLY  21           HA2      GLY  21  44.938   9.401  -5.523
  153    HA3  GLY  21           HA3      GLY  21  46.312  10.052  -4.638
  154    H    PHE  22           H        PHE  22  44.367   7.150  -4.110
  155    HA   PHE  22           HA       PHE  22  46.784   5.554  -4.618
  156    HD1  PHE  22           HD2      PHE  22  47.736   6.328  -3.212
  157    HD2  PHE  22           HD1      PHE  22  45.588   3.750  -0.594
  158    HE1  PHE  22           HE2      PHE  22  49.459   6.646  -1.487
  159    HE2  PHE  22           HE1      PHE  22  47.308   4.058   1.130
  160    HZ   PHE  22           HZ       PHE  22  49.248   5.512   0.691
  161    HB2  PHE  22           HB2      PHE  22  44.547   5.113  -2.653
  162    HB3  PHE  22           HB3      PHE  22  45.452   3.743  -3.292
  163    H    SER  23           H        SER  23  45.701   3.123  -5.115
  164    HA   SER  23           HA       SER  23  43.524   3.582  -6.988
  165    HG   SER  23           HG       SER  23  45.134   4.921  -7.921
  166    HB2  SER  23           HB2      SER  23  46.182   2.400  -7.841
  167    HB3  SER  23           HB3      SER  23  44.737   2.491  -8.849
  168    H    ASP  24           H        ASP  24  43.748   1.097  -8.328
  169    HA   ASP  24           HA       ASP  24  43.097  -0.744  -6.123
  170    HB2  ASP  24           HB2      ASP  24  41.235   0.075  -7.682
  171    HB3  ASP  24           HB3      ASP  24  42.010  -0.891  -8.937
  172    H    GLU  25           H        GLU  25  44.451  -2.447  -5.907
  173    HA   GLU  25           HA       GLU  25  46.562  -2.915  -7.682
  174    HB2  GLU  25           HB2      GLU  25  46.998  -4.973  -6.414
  175    HB3  GLU  25           HB3      GLU  25  46.709  -3.601  -5.357
  176    HG2  GLU  25           HG2      GLU  25  44.696  -4.424  -4.612
  177    HG3  GLU  25           HG3      GLU  25  44.443  -5.404  -6.056
  178    H    GLY  26           H        GLY  26  43.331  -4.133  -7.762
  179    HA2  GLY  26           HA2      GLY  26  43.103  -4.890 -10.282
  180    HA3  GLY  26           HA3      GLY  26  44.069  -6.228  -9.675
  181    H    GLY  27           H        GLY  27  41.578  -4.655  -7.766
  182    HA2  GLY  27           HA2      GLY  27  39.240  -5.522  -7.972
  183    HA3  GLY  27           HA3      GLY  27  39.973  -7.122  -7.998
  184    H    TRP  28           H        TRP  28  41.048  -4.463  -5.973
  185    HA   TRP  28           HA       TRP  28  40.506  -6.143  -3.641
  186    HD1  TRP  28           HD1      TRP  28  42.493  -2.606  -5.518
  187    HE1  TRP  28           HE1      TRP  28  42.366  -0.188  -4.632
  188    HE3  TRP  28           HE3      TRP  28  41.530  -3.585  -0.608
  189    HZ2  TRP  28           HZ2      TRP  28  41.907   1.120  -2.188
  190    HZ3  TRP  28           HZ3      TRP  28  41.242  -1.701   0.937
  191    HH2  TRP  28           HH2      TRP  28  41.426   0.605   0.162
  192    HB2  TRP  28           HB2      TRP  28  42.197  -5.004  -2.501
  193    HB3  TRP  28           HB3      TRP  28  42.807  -4.989  -4.159
  194    H    LEU  29           H        LEU  29  39.862  -2.914  -4.910
  195    HA   LEU  29           HA       LEU  29  38.894  -1.903  -2.512
  196    HG   LEU  29           HG       LEU  29  36.912   0.194  -3.694
  197    HB2  LEU  29           HB2      LEU  29  39.785  -0.511  -4.269
  198    HB3  LEU  29           HB3      LEU  29  38.473  -0.943  -5.341
  199   HD11  LEU  29          HD11      LEU  29  37.695   0.880  -1.739
  200   HD12  LEU  29          HD12      LEU  29  38.824   1.956  -2.564
  201   HD13  LEU  29          HD13      LEU  29  39.307   0.304  -2.171
  202   HD21  LEU  29          HD21      LEU  29  38.693   1.296  -5.646
  203   HD22  LEU  29          HD22      LEU  29  38.398   2.479  -4.372
  204   HD23  LEU  29          HD23      LEU  29  37.042   1.769  -5.248
  205    H    THR  30           H        THR  30  37.359  -3.886  -4.789
  206    HA   THR  30           HA       THR  30  34.721  -3.387  -3.613
  207    HB   THR  30           HB       THR  30  34.534  -3.555  -5.965
  208    HG1  THR  30           HG1      THR  30  33.722  -5.753  -4.501
  209   HG21  THR  30          HG21      THR  30  36.837  -5.000  -5.981
  210   HG22  THR  30          HG22      THR  30  35.766  -4.777  -7.363
  211   HG23  THR  30          HG23      THR  30  35.635  -6.229  -6.370
  212    H    ARG  31           H        ARG  31  37.336  -5.685  -3.771
  213    HA   ARG  31           HA       ARG  31  35.804  -7.736  -2.403
  214    HE   ARG  31           HE       ARG  31  39.667 -11.491  -2.131
  215    HB2  ARG  31           HB2      ARG  31  36.966  -8.660  -4.161
  216    HB3  ARG  31           HB3      ARG  31  38.363  -7.626  -3.930
  217    HG2  ARG  31           HG2      ARG  31  39.024  -8.935  -1.993
  218    HG3  ARG  31           HG3      ARG  31  37.608  -9.979  -2.208
  219    HD2  ARG  31           HD2      ARG  31  38.420 -10.670  -4.381
  220    HD3  ARG  31           HD3      ARG  31  39.780  -9.555  -4.261
  221   HH11  ARG  31          HH11      ARG  31  40.775 -10.847  -5.385
  222   HH12  ARG  31          HH12      ARG  31  42.044 -12.029  -5.317
  223   HH21  ARG  31          HH21      ARG  31  41.320 -13.050  -2.047
  224   HH22  ARG  31          HH22      ARG  31  42.351 -13.284  -3.428
  225    H    LEU  32           H        LEU  32  39.069  -6.391  -1.941
  226    HA   LEU  32           HA       LEU  32  39.687  -7.493   0.480
  227    HG   LEU  32           HG       LEU  32  42.741  -5.372   0.457
  228    HB2  LEU  32           HB2      LEU  32  41.135  -6.129  -1.085
  229    HB3  LEU  32           HB3      LEU  32  40.455  -4.695  -0.343
  230   HD11  LEU  32          HD11      LEU  32  42.257  -4.147   2.226
  231   HD12  LEU  32          HD12      LEU  32  41.420  -5.506   2.976
  232   HD13  LEU  32          HD13      LEU  32  40.538  -4.403   1.919
  233   HD21  LEU  32          HD21      LEU  32  42.707  -7.171   2.230
  234   HD22  LEU  32          HD22      LEU  32  42.633  -7.707   0.552
  235   HD23  LEU  32          HD23      LEU  32  41.170  -7.687   1.538
  236    H    LEU  33           H        LEU  33  38.515  -4.133   0.130
  237    HA   LEU  33           HA       LEU  33  38.234  -3.449   2.744
  238    HG   LEU  33           HG       LEU  33  38.677  -1.710   0.274
  239    HB2  LEU  33           HB2      LEU  33  36.483  -2.731   0.407
  240    HB3  LEU  33           HB3      LEU  33  36.225  -2.047   2.004
  241   HD11  LEU  33          HD11      LEU  33  37.851   0.750   0.715
  242   HD12  LEU  33          HD12      LEU  33  36.296  -0.058   0.923
  243   HD13  LEU  33          HD13      LEU  33  37.181  -0.226  -0.594
  244   HD21  LEU  33          HD21      LEU  33  38.219  -1.267   3.151
  245   HD22  LEU  33          HD22      LEU  33  38.965   0.072   2.278
  246   HD23  LEU  33          HD23      LEU  33  39.722  -1.520   2.263
  247    H    GLN  34           H        GLN  34  35.583  -4.775   0.808
  248    HA   GLN  34           HA       GLN  34  33.610  -5.011   2.662
  249    HB2  GLN  34           HB2      GLN  34  34.390  -6.824   0.412
  250    HB3  GLN  34           HB3      GLN  34  32.885  -7.035   1.300
  251    HG2  GLN  34           HG2      GLN  34  33.645  -4.497  -0.131
  252    HG3  GLN  34           HG3      GLN  34  32.703  -5.788  -0.868
  253   HE21  GLN  34          HE21      GLN  34  31.770  -5.956   2.201
  254   HE22  GLN  34          HE22      GLN  34  30.436  -4.860   2.191
  255    H    THR  35           H        THR  35  35.864  -7.674   1.876
  256    HA   THR  35           HA       THR  35  34.939  -9.392   3.876
  257    HB   THR  35           HB       THR  35  37.063 -10.638   3.483
  258    HG1  THR  35           HG1      THR  35  37.740  -8.220   2.297
  259   HG21  THR  35          HG21      THR  35  36.087 -11.536   1.723
  260   HG22  THR  35          HG22      THR  35  36.549 -10.155   0.727
  261   HG23  THR  35          HG23      THR  35  35.023 -10.133   1.610
  262    H    LYS  36           H        LYS  36  37.253  -6.807   4.006
  263    HA   LYS  36           HA       LYS  36  38.051  -7.535   6.725
  264    HB2  LYS  36           HB2      LYS  36  39.108  -5.622   4.677
  265    HB3  LYS  36           HB3      LYS  36  39.430  -5.312   6.376
  266    HG2  LYS  36           HG2      LYS  36  41.281  -6.494   5.377
  267    HG3  LYS  36           HG3      LYS  36  40.486  -7.514   6.575
  268    HD2  LYS  36           HD2      LYS  36  39.277  -8.661   4.747
  269    HD3  LYS  36           HD3      LYS  36  40.151  -7.674   3.576
  270    HE2  LYS  36           HE2      LYS  36  41.140  -9.916   3.849
  271    HE3  LYS  36           HE3      LYS  36  42.259  -8.626   4.289
  272    HZ1  LYS  36           HZ1      LYS  36  41.144 -10.728   5.913
  273    HZ2  LYS  36           HZ2      LYS  36  41.038  -9.195   6.639
  274    HZ3  LYS  36           HZ3      LYS  36  42.550  -9.796   6.148
  275    H    ASN  37           H        ASN  37  35.378  -6.874   6.338
  276    HA   ASN  37           HA       ASN  37  33.713  -5.368   6.624
  277    HB2  ASN  37           HB2      ASN  37  33.326  -4.807   8.941
  278    HB3  ASN  37           HB3      ASN  37  33.927  -6.447   8.787
  279   HD21  ASN  37          HD21      ASN  37  36.500  -4.279   8.476
  280   HD22  ASN  37          HD22      ASN  37  37.045  -4.326  10.117
  281    H    TYR  38           H        TYR  38  35.176  -4.016   5.034
  282    HA   TYR  38           HA       TYR  38  35.640  -1.952   4.232
  283    HD1  TYR  38           HD1      TYR  38  34.010  -0.791   2.796
  284    HD2  TYR  38           HD2      TYR  38  31.742  -2.105   6.148
  285    HE1  TYR  38           HE1      TYR  38  32.132  -1.336   1.306
  286    HE2  TYR  38           HE2      TYR  38  29.861  -2.654   4.667
  287    HH   TYR  38           HH       TYR  38  30.161  -2.797   1.281
  288    HB2  TYR  38           HB2      TYR  38  33.823  -1.170   6.510
  289    HB3  TYR  38           HB3      TYR  38  34.425  -0.023   5.319
  290    H    ASP  39           H        ASP  39  37.793  -2.827   5.423
  291    HA   ASP  39           HA       ASP  39  38.600  -0.742   7.350
  292    HB2  ASP  39           HB2      ASP  39  39.417  -3.568   6.980
  293    HB3  ASP  39           HB3      ASP  39  40.655  -2.438   7.524
  294    H    ILE  40           H        ILE  40  40.018   0.729   6.860
  295    HA   ILE  40           HA       ILE  40  41.532   0.582   4.384
  296    HB   ILE  40           HB       ILE  40  42.452   2.829   5.165
  297   HG12  ILE  40          HG12      ILE  40  41.484   2.364   7.570
  298   HG13  ILE  40          HG13      ILE  40  41.507   4.000   6.923
  299   HG21  ILE  40          HG21      ILE  40  39.919   2.144   3.976
  300   HG22  ILE  40          HG22      ILE  40  41.053   3.429   3.559
  301   HG23  ILE  40          HG23      ILE  40  39.835   3.699   4.805
  302   HD11  ILE  40          HD11      ILE  40  39.088   2.282   6.583
  303   HD12  ILE  40          HD12      ILE  40  39.222   4.040   6.593
  304   HD13  ILE  40          HD13      ILE  40  39.385   3.135   8.099
  305    H    GLY  41           H        GLY  41  41.749  -0.585   7.428
  306    HA2  GLY  41           HA2      GLY  41  44.451  -0.034   8.071
  307    HA3  GLY  41           HA3      GLY  41  43.475  -1.308   8.774
  308    H    ALA  42           H        ALA  42  42.857  -2.553   6.299
  309    HA   ALA  42           HA       ALA  42  45.443  -3.802   5.681
  310    HB1  ALA  42           HB1      ALA  42  43.048  -5.051   4.547
  311    HB2  ALA  42           HB2      ALA  42  43.064  -4.998   6.310
  312    HB3  ALA  42           HB3      ALA  42  44.387  -5.771   5.438
  313    H    ALA  43           H        ALA  43  43.187  -1.622   4.529
  314    HA   ALA  43           HA       ALA  43  43.116  -2.031   1.779
  315    HB1  ALA  43           HB1      ALA  43  43.179   0.661   3.123
  316    HB2  ALA  43           HB2      ALA  43  41.761  -0.387   3.085
  317    HB3  ALA  43           HB3      ALA  43  42.436   0.239   1.580
  318    H    LEU  44           H        LEU  44  45.344   0.059   3.615
  319    HA   LEU  44           HA       LEU  44  46.875   0.867   1.412
  320    HG   LEU  44           HG       LEU  44  47.197   3.085   2.468
  321    HB2  LEU  44           HB2      LEU  44  47.443   0.738   4.362
  322    HB3  LEU  44           HB3      LEU  44  48.688   1.234   3.227
  323   HD11  LEU  44          HD11      LEU  44  45.507   2.386   4.855
  324   HD12  LEU  44          HD12      LEU  44  45.067   2.009   3.189
  325   HD13  LEU  44          HD13      LEU  44  45.250   3.689   3.695
  326   HD21  LEU  44          HD21      LEU  44  48.852   2.973   4.617
  327   HD22  LEU  44          HD22      LEU  44  47.361   3.562   5.353
  328   HD23  LEU  44          HD23      LEU  44  48.088   4.444   4.011
  329    H    ASP  45           H        ASP  45  47.157  -1.876   3.579
  330    HA   ASP  45           HA       ASP  45  49.654  -2.866   2.961
  331    HB2  ASP  45           HB2      ASP  45  48.303  -3.788   4.742
  332    HB3  ASP  45           HB3      ASP  45  47.090  -4.342   3.594
  333    H    THR  46           H        THR  46  46.611  -3.514   1.252
  334    HA   THR  46           HA       THR  46  47.820  -5.410  -0.466
  335    HB   THR  46           HB       THR  46  45.597  -5.332  -1.642
  336    HG1  THR  46           HG1      THR  46  44.836  -3.318  -1.279
  337   HG21  THR  46          HG21      THR  46  46.110  -6.103   1.102
  338   HG22  THR  46          HG22      THR  46  45.228  -6.948  -0.170
  339   HG23  THR  46          HG23      THR  46  44.413  -5.730   0.812
  340    H    ILE  47           H        ILE  47  47.034  -1.990  -0.901
  341    HA   ILE  47           HA       ILE  47  47.483  -2.272  -3.742
  342    HB   ILE  47           HB       ILE  47  46.833   0.191  -3.772
  343   HG12  ILE  47          HG12      ILE  47  46.067  -0.520  -0.929
  344   HG13  ILE  47          HG13      ILE  47  47.258   0.685  -1.413
  345   HG21  ILE  47          HG21      ILE  47  45.414  -2.106  -3.935
  346   HG22  ILE  47          HG22      ILE  47  44.742  -0.498  -4.208
  347   HG23  ILE  47          HG23      ILE  47  44.560  -1.275  -2.635
  348   HD11  ILE  47          HD11      ILE  47  45.695   2.233  -1.695
  349   HD12  ILE  47          HD12      ILE  47  44.606   1.126  -0.858
  350   HD13  ILE  47          HD13      ILE  47  44.666   1.138  -2.622
  351    H    GLN  48           H        GLN  48  49.313  -0.915  -1.085
  352    HA   GLN  48           HA       GLN  48  51.455  -0.337  -2.963
  353    HB2  GLN  48           HB2      GLN  48  49.951   1.815  -1.546
  354    HB3  GLN  48           HB3      GLN  48  51.686   2.004  -1.737
  355    HG2  GLN  48           HG2      GLN  48  51.254   2.889  -3.723
  356    HG3  GLN  48           HG3      GLN  48  50.840   1.262  -4.258
  357   HE21  GLN  48          HE21      GLN  48  48.618   2.113  -1.981
  358   HE22  GLN  48          HE22      GLN  48  47.376   2.732  -3.024
  359    H    TYR  49           H        TYR  49  50.354  -0.711   0.325
  360    HA   TYR  49           HA       TYR  49  53.118  -0.584   1.302
  361    HD1  TYR  49           HD1      TYR  49  50.239   1.338   0.966
  362    HD2  TYR  49           HD2      TYR  49  52.712   1.349   4.425
  363    HE1  TYR  49           HE1      TYR  49  50.193   3.796   0.982
  364    HE2  TYR  49           HE2      TYR  49  52.672   3.805   4.454
  365    HH   TYR  49           HH       TYR  49  51.271   5.640   3.643
  366    HB2  TYR  49           HB2      TYR  49  50.479  -0.692   2.787
  367    HB3  TYR  49           HB3      TYR  49  52.055  -0.672   3.567
  368    H    SER  50           H        SER  50  52.949  -2.718  -0.216
  369    HA   SER  50           HA       SER  50  51.959  -4.986   1.288
  370    HG   SER  50           HG       SER  50  50.616  -4.545  -0.599
  371    HB2  SER  50           HB2      SER  50  53.288  -4.923  -1.429
  372    HB3  SER  50           HB3      SER  50  52.378  -6.266  -0.736
  373    H    LYS  51           H        LYS  51  54.604  -3.324   1.649
  374    HA   LYS  51           HA       LYS  51  56.191  -5.676   2.387
  375    HB2  LYS  51           HB2      LYS  51  57.280  -3.133   1.150
  376    HB3  LYS  51           HB3      LYS  51  58.267  -4.404   1.851
  377    HG2  LYS  51           HG2      LYS  51  56.380  -5.026  -0.386
  378    HG3  LYS  51           HG3      LYS  51  57.947  -4.292  -0.719
  379    HD2  LYS  51           HD2      LYS  51  58.305  -6.603  -0.946
  380    HD3  LYS  51           HD3      LYS  51  58.947  -6.205   0.647
  381    HE2  LYS  51           HE2      LYS  51  56.902  -7.024   1.690
  382    HE3  LYS  51           HE3      LYS  51  56.217  -7.377   0.105
  383    HZ1  LYS  51           HZ1      LYS  51  58.784  -8.597   0.858
  384    HZ2  LYS  51           HZ2      LYS  51  57.578  -9.176  -0.188
  385    HZ3  LYS  51           HZ3      LYS  51  57.348  -9.240   1.497
  386    H    HIS  52           H        HIS  52  56.908  -5.601   4.450
  387    HA   HIS  52           HA       HIS  52  56.429  -3.079   5.883
  388    HD1  HIS  52           HD1      HIS  52  55.269  -2.313   7.893
  389    HD2  HIS  52           HD2      HIS  52  56.221  -5.970   9.627
  390    HE1  HIS  52           HE1      HIS  52  55.221  -1.944  10.393
  391    HB2  HIS  52           HB2      HIS  52  54.871  -4.922   6.472
  392    HB3  HIS  52           HB3      HIS  52  56.246  -5.905   6.964
  Start of MODEL   24
    1    H1   GLY   1           1H       GLY   1  19.665   8.154   3.084
    2    H2   GLY   1           2H       GLY   1  19.401   6.991   4.285
    3    H3   GLY   1           3H       GLY   1  18.229   7.256   3.097
    4    HA2  GLY   1           HA2      GLY   1  19.810   5.230   2.913
    5    HA3  GLY   1           HA3      GLY   1  19.360   6.146   1.480
    6    H    SER   2           H        SER   2  21.659   4.622   1.521
    7    HA   SER   2           HA       SER   2  23.808   6.613   1.773
    8    HG   SER   2           HG       SER   2  23.804   3.826   3.817
    9    HB2  SER   2           HB2      SER   2  23.935   3.587   1.737
   10    HB3  SER   2           HB3      SER   2  25.347   4.644   1.775
   11    HA   PRO   3           HA       PRO   3  23.798   6.591  -2.689
   12    HB2  PRO   3           HB2      PRO   3  26.131   8.320  -2.509
   13    HB3  PRO   3           HB3      PRO   3  24.506   8.708  -3.076
   14    HG2  PRO   3           HG2      PRO   3  25.540   9.701  -0.766
   15    HG3  PRO   3           HG3      PRO   3  23.807   9.403  -1.000
   16    HD2  PRO   3           HD2      PRO   3  25.842   7.734   0.439
   17    HD3  PRO   3           HD3      PRO   3  24.166   8.113   0.898
   18    HA   PRO   4           HA       PRO   4  26.718   3.326  -3.446
   19    HB2  PRO   4           HB2      PRO   4  26.532   4.357  -6.234
   20    HB3  PRO   4           HB3      PRO   4  26.323   2.711  -5.623
   21    HG2  PRO   4           HG2      PRO   4  24.212   4.178  -6.337
   22    HG3  PRO   4           HG3      PRO   4  24.144   3.099  -4.931
   23    HD2  PRO   4           HD2      PRO   4  24.378   6.070  -5.034
   24    HD3  PRO   4           HD3      PRO   4  23.541   5.040  -3.854
   25    H    GLU   5           H        GLU   5  28.830   3.359  -3.138
   26    HA   GLU   5           HA       GLU   5  31.044   3.874  -3.274
   27    HB2  GLU   5           HB2      GLU   5  30.212   5.626  -5.591
   28    HB3  GLU   5           HB3      GLU   5  31.876   5.337  -5.108
   29    HG2  GLU   5           HG2      GLU   5  29.950   3.197  -5.990
   30    HG3  GLU   5           HG3      GLU   5  31.148   3.968  -7.029
   31    H    ALA   6           H        ALA   6  28.993   5.396  -1.782
   32    HA   ALA   6           HA       ALA   6  30.766   7.426  -0.757
   33    HB1  ALA   6           HB1      ALA   6  28.457   8.908  -0.849
   34    HB2  ALA   6           HB2      ALA   6  28.481   8.138  -2.436
   35    HB3  ALA   6           HB3      ALA   6  29.850   9.119  -1.910
   36    H    ASP   7           H        ASP   7  29.769   4.967   0.100
   37    HA   ASP   7           HA       ASP   7  27.563   5.233   1.871
   38    HB2  ASP   7           HB2      ASP   7  29.814   3.206   1.742
   39    HB3  ASP   7           HB3      ASP   7  28.460   3.093   2.858
   40    HA   PRO   8           HA       PRO   8  29.478   7.037   5.510
   41    HB2  PRO   8           HB2      PRO   8  28.451   4.735   7.045
   42    HB3  PRO   8           HB3      PRO   8  28.139   6.459   7.263
   43    HG2  PRO   8           HG2      PRO   8  26.283   4.763   6.272
   44    HG3  PRO   8           HG3      PRO   8  26.380   6.465   5.788
   45    HD2  PRO   8           HD2      PRO   8  27.212   4.020   4.294
   46    HD3  PRO   8           HD3      PRO   8  26.576   5.561   3.688
   47    H    ARG   9           H        ARG   9  29.903   3.820   4.432
   48    HA   ARG   9           HA       ARG   9  32.184   3.227   6.137
   49    HE   ARG   9           HE       ARG   9  30.689  -0.828   6.740
   50    HB2  ARG   9           HB2      ARG   9  30.999   1.582   3.895
   51    HB3  ARG   9           HB3      ARG   9  32.012   1.013   5.228
   52    HG2  ARG   9           HG2      ARG   9  29.298   2.230   5.671
   53    HG3  ARG   9           HG3      ARG   9  29.524   0.509   5.360
   54    HD2  ARG   9           HD2      ARG   9  31.100   1.844   7.521
   55    HD3  ARG   9           HD3      ARG   9  29.414   1.413   7.810
   56   HH11  ARG   9          HH11      ARG   9  30.894   1.167   9.598
   57   HH12  ARG   9          HH12      ARG   9  31.333  -0.142  10.649
   58   HH21  ARG   9          HH21      ARG   9  31.250  -2.577   8.111
   59   HH22  ARG   9          HH22      ARG   9  31.498  -2.286   9.808
   60    H    LEU  10           H        LEU  10  31.403   3.942   2.769
   61    HA   LEU  10           HA       LEU  10  34.117   3.412   1.938
   62    HG   LEU  10           HG       LEU  10  31.340   1.912   1.376
   63    HB2  LEU  10           HB2      LEU  10  31.668   4.067   0.300
   64    HB3  LEU  10           HB3      LEU  10  33.220   3.546  -0.332
   65   HD11  LEU  10          HD11      LEU  10  30.582   1.997  -0.882
   66   HD12  LEU  10          HD12      LEU  10  31.342   0.427  -0.616
   67   HD13  LEU  10          HD13      LEU  10  32.208   1.689  -1.493
   68   HD21  LEU  10          HD21      LEU  10  34.018   1.126   0.249
   69   HD22  LEU  10          HD22      LEU  10  32.927   0.114   1.195
   70   HD23  LEU  10          HD23      LEU  10  33.706   1.508   1.943
   71    H    ILE  11           H        ILE  11  32.018   6.117   2.489
   72    HA   ILE  11           HA       ILE  11  33.672   8.028   1.092
   73    HB   ILE  11           HB       ILE  11  31.251   8.465   1.714
   74   HG12  ILE  11          HG12      ILE  11  33.306  10.457   2.700
   75   HG13  ILE  11          HG13      ILE  11  32.742  10.290   1.039
   76   HG21  ILE  11          HG21      ILE  11  30.695   9.163   3.943
   77   HG22  ILE  11          HG22      ILE  11  32.369   8.963   4.466
   78   HG23  ILE  11          HG23      ILE  11  31.411   7.551   4.014
   79   HD11  ILE  11          HD11      ILE  11  30.489  10.931   1.762
   80   HD12  ILE  11          HD12      ILE  11  31.688  12.177   2.113
   81   HD13  ILE  11          HD13      ILE  11  31.092  11.136   3.407
   82    H    GLU  12           H        GLU  12  33.860   6.155   3.844
   83    HA   GLU  12           HA       GLU  12  35.847   7.874   5.146
   84    HB2  GLU  12           HB2      GLU  12  34.088   6.861   6.557
   85    HB3  GLU  12           HB3      GLU  12  34.636   5.262   6.081
   86    HG2  GLU  12           HG2      GLU  12  35.467   5.776   8.265
   87    HG3  GLU  12           HG3      GLU  12  36.812   5.724   7.130
   88    H    SER  13           H        SER  13  35.485   4.511   4.016
   89    HA   SER  13           HA       SER  13  38.320   4.108   4.362
   90    HG   SER  13           HG       SER  13  38.110   1.170   5.155
   91    HB2  SER  13           HB2      SER  13  36.506   2.505   5.117
   92    HB3  SER  13           HB3      SER  13  36.303   2.072   3.421
   93    H    LEU  14           H        LEU  14  36.116   4.325   1.576
   94    HA   LEU  14           HA       LEU  14  38.301   3.518  -0.187
   95    HG   LEU  14           HG       LEU  14  35.482   1.978   0.056
   96    HB2  LEU  14           HB2      LEU  14  35.422   4.220  -0.782
   97    HB3  LEU  14           HB3      LEU  14  36.612   3.856  -2.016
   98   HD11  LEU  14          HD11      LEU  14  34.038   2.198  -1.811
   99   HD12  LEU  14          HD12      LEU  14  34.925   0.689  -2.032
  100   HD13  LEU  14          HD13      LEU  14  35.384   2.125  -2.949
  101   HD21  LEU  14          HD21      LEU  14  37.822   1.486  -0.063
  102   HD22  LEU  14          HD22      LEU  14  37.808   1.589  -1.824
  103   HD23  LEU  14          HD23      LEU  14  36.961   0.275  -1.011
  104    H    SER  15           H        SER  15  36.290   6.251   0.660
  105    HA   SER  15           HA       SER  15  37.169   7.947  -1.346
  106    HG   SER  15           HG       SER  15  36.880  10.553  -0.001
  107    HB2  SER  15           HB2      SER  15  35.174   8.289   0.165
  108    HB3  SER  15           HB3      SER  15  36.306   8.880   1.381
  109    H    GLN  16           H        GLN  16  38.788   6.959   1.550
  110    HA   GLN  16           HA       GLN  16  40.575   9.199   1.625
  111    HB2  GLN  16           HB2      GLN  16  41.794   8.027   3.312
  112    HB3  GLN  16           HB3      GLN  16  40.088   7.765   3.621
  113    HG2  GLN  16           HG2      GLN  16  40.837   5.660   3.957
  114    HG3  GLN  16           HG3      GLN  16  40.561   5.561   2.218
  115   HE21  GLN  16          HE21      GLN  16  42.121   4.359   1.382
  116   HE22  GLN  16          HE22      GLN  16  43.808   4.509   1.718
  117    H    MET  17           H        MET  17  40.427   6.163  -0.070
  118    HA   MET  17           HA       MET  17  43.121   6.296  -1.087
  119    HB2  MET  17           HB2      MET  17  40.694   4.707  -1.899
  120    HB3  MET  17           HB3      MET  17  42.167   4.701  -2.858
  121    HG2  MET  17           HG2      MET  17  43.305   4.063  -0.612
  122    HG3  MET  17           HG3      MET  17  41.672   3.590  -0.141
  123    HE1  MET  17           HE1      MET  17  44.433   1.050  -0.965
  124    HE2  MET  17           HE2      MET  17  42.922   0.279  -0.481
  125    HE3  MET  17           HE3      MET  17  43.449   1.765   0.309
  126    H    LEU  18           H        LEU  18  39.895   7.286  -2.122
  127    HA   LEU  18           HA       LEU  18  40.700   8.218  -4.695
  128    HG   LEU  18           HG       LEU  18  38.588   7.719  -5.866
  129    HB2  LEU  18           HB2      LEU  18  38.284   8.575  -2.981
  130    HB3  LEU  18           HB3      LEU  18  38.516   9.663  -4.334
  131   HD11  LEU  18          HD11      LEU  18  39.270   5.845  -4.759
  132   HD12  LEU  18          HD12      LEU  18  37.525   5.591  -4.739
  133   HD13  LEU  18          HD13      LEU  18  38.340   6.224  -3.309
  134   HD21  LEU  18          HD21      LEU  18  36.072   7.016  -4.933
  135   HD22  LEU  18          HD22      LEU  18  36.457   8.301  -6.075
  136   HD23  LEU  18          HD23      LEU  18  36.315   8.664  -4.356
  137    H    SER  19           H        SER  19  41.213   9.454  -1.586
  138    HA   SER  19           HA       SER  19  41.449  12.209  -2.533
  139    HG   SER  19           HG       SER  19  42.243  13.527  -0.086
  140    HB2  SER  19           HB2      SER  19  40.289  11.470  -0.314
  141    HB3  SER  19           HB3      SER  19  41.937  11.349   0.305
  142    H    MET  20           H        MET  20  43.397   9.616  -1.081
  143    HA   MET  20           HA       MET  20  45.765  11.261  -1.081
  144    HB2  MET  20           HB2      MET  20  45.430   8.318  -0.484
  145    HB3  MET  20           HB3      MET  20  46.902   9.242  -0.230
  146    HG2  MET  20           HG2      MET  20  45.712  10.666   1.382
  147    HG3  MET  20           HG3      MET  20  44.267   9.680   1.157
  148    HE1  MET  20           HE1      MET  20  48.174   7.769   2.151
  149    HE2  MET  20           HE2      MET  20  48.087   9.207   3.172
  150    HE3  MET  20           HE3      MET  20  47.934   9.358   1.422
  151    H    GLY  21           H        GLY  21  44.417   8.743  -3.121
  152    HA2  GLY  21           HA2      GLY  21  45.077   8.826  -5.480
  153    HA3  GLY  21           HA3      GLY  21  46.720   9.139  -4.929
  154    H    PHE  22           H        PHE  22  44.317   6.724  -3.899
  155    HA   PHE  22           HA       PHE  22  46.190   4.634  -4.785
  156    HD1  PHE  22           HD1      PHE  22  47.887   4.224  -3.217
  157    HD2  PHE  22           HD2      PHE  22  44.828   5.384  -0.501
  158    HE1  PHE  22           HE1      PHE  22  49.595   5.026  -1.642
  159    HE2  PHE  22           HE2      PHE  22  46.529   6.196   1.078
  160    HZ   PHE  22           HZ       PHE  22  48.920   6.012   0.506
  161    HB2  PHE  22           HB2      PHE  22  44.227   4.449  -2.485
  162    HB3  PHE  22           HB3      PHE  22  45.323   3.178  -3.021
  163    H    SER  23           H        SER  23  45.037   2.627  -5.473
  164    HA   SER  23           HA       SER  23  42.273   3.150  -6.242
  165    HG   SER  23           HG       SER  23  44.655   4.146  -8.829
  166    HB2  SER  23           HB2      SER  23  44.338   2.156  -8.229
  167    HB3  SER  23           HB3      SER  23  42.648   2.540  -8.560
  168    H    ASP  24           H        ASP  24  42.846   0.701  -8.110
  169    HA   ASP  24           HA       ASP  24  42.978  -1.345  -6.013
  170    HB2  ASP  24           HB2      ASP  24  41.474  -2.770  -7.423
  171    HB3  ASP  24           HB3      ASP  24  40.686  -1.350  -6.741
  172    H    GLU  25           H        GLU  25  44.675  -2.638  -6.263
  173    HA   GLU  25           HA       GLU  25  46.377  -2.443  -8.514
  174    HB2  GLU  25           HB2      GLU  25  47.099  -3.067  -6.176
  175    HB3  GLU  25           HB3      GLU  25  46.389  -4.649  -6.459
  176    HG2  GLU  25           HG2      GLU  25  47.929  -4.760  -8.503
  177    HG3  GLU  25           HG3      GLU  25  48.786  -3.416  -7.750
  178    H    GLY  26           H        GLY  26  44.203  -4.961  -7.397
  179    HA2  GLY  26           HA2      GLY  26  44.207  -6.068 -10.134
  180    HA3  GLY  26           HA3      GLY  26  44.283  -7.115  -8.719
  181    H    GLY  27           H        GLY  27  42.298  -4.301  -8.482
  182    HA2  GLY  27           HA2      GLY  27  40.002  -4.021  -8.851
  183    HA3  GLY  27           HA3      GLY  27  39.915  -5.678  -9.428
  184    H    TRP  28           H        TRP  28  41.580  -5.656  -6.573
  185    HA   TRP  28           HA       TRP  28  39.480  -6.952  -5.168
  186    HD1  TRP  28           HD1      TRP  28  43.883  -6.894  -5.841
  187    HE1  TRP  28           HE1      TRP  28  45.486  -4.938  -5.372
  188    HE3  TRP  28           HE3      TRP  28  41.167  -4.380  -2.312
  189    HZ2  TRP  28           HZ2      TRP  28  45.593  -2.654  -3.765
  190    HZ3  TRP  28           HZ3      TRP  28  42.088  -2.310  -1.363
  191    HH2  TRP  28           HH2      TRP  28  44.261  -1.467  -2.078
  192    HB2  TRP  28           HB2      TRP  28  41.177  -6.964  -3.281
  193    HB3  TRP  28           HB3      TRP  28  41.698  -7.745  -4.776
  194    H    LEU  29           H        LEU  29  40.221  -3.682  -5.550
  195    HA   LEU  29           HA       LEU  29  40.144  -2.642  -3.031
  196    HG   LEU  29           HG       LEU  29  38.163  -0.182  -3.643
  197    HB2  LEU  29           HB2      LEU  29  40.691  -1.262  -4.887
  198    HB3  LEU  29           HB3      LEU  29  39.099  -1.443  -5.586
  199   HD11  LEU  29          HD11      LEU  29  39.829   1.161  -2.336
  200   HD12  LEU  29          HD12      LEU  29  41.081   0.096  -2.976
  201   HD13  LEU  29          HD13      LEU  29  39.793  -0.564  -1.965
  202   HD21  LEU  29          HD21      LEU  29  38.511   1.028  -5.658
  203   HD22  LEU  29          HD22      LEU  29  40.248   1.125  -5.374
  204   HD23  LEU  29          HD23      LEU  29  39.137   2.027  -4.344
  205    H    THR  30           H        THR  30  37.494  -4.002  -4.744
  206    HA   THR  30           HA       THR  30  35.539  -3.007  -2.828
  207    HB   THR  30           HB       THR  30  33.973  -4.510  -4.082
  208    HG1  THR  30           HG1      THR  30  34.704  -5.801  -5.573
  209   HG21  THR  30          HG21      THR  30  35.165  -2.112  -5.018
  210   HG22  THR  30          HG22      THR  30  33.546  -2.742  -5.326
  211   HG23  THR  30          HG23      THR  30  34.881  -3.176  -6.395
  212    H    ARG  31           H        ARG  31  36.566  -6.249  -3.934
  213    HA   ARG  31           HA       ARG  31  35.434  -7.681  -1.873
  214    HE   ARG  31           HE       ARG  31  38.903 -10.367  -2.861
  215    HB2  ARG  31           HB2      ARG  31  37.173  -9.458  -2.487
  216    HB3  ARG  31           HB3      ARG  31  36.023  -8.938  -3.706
  217    HG2  ARG  31           HG2      ARG  31  37.678  -7.586  -4.769
  218    HG3  ARG  31           HG3      ARG  31  38.830  -7.899  -3.468
  219    HD2  ARG  31           HD2      ARG  31  37.679  -9.921  -5.386
  220    HD3  ARG  31           HD3      ARG  31  39.324  -9.293  -5.375
  221   HH11  ARG  31          HH11      ARG  31  38.992 -11.525  -6.170
  222   HH12  ARG  31          HH12      ARG  31  39.445 -13.137  -5.717
  223   HH21  ARG  31          HH21      ARG  31  39.520 -12.459  -2.283
  224   HH22  ARG  31          HH22      ARG  31  39.753 -13.671  -3.504
  225    H    LEU  32           H        LEU  32  38.801  -6.497  -2.001
  226    HA   LEU  32           HA       LEU  32  39.804  -7.752   0.250
  227    HG   LEU  32           HG       LEU  32  42.818  -5.574  -0.113
  228    HB2  LEU  32           HB2      LEU  32  41.039  -6.337  -1.433
  229    HB3  LEU  32           HB3      LEU  32  40.428  -4.920  -0.605
  230   HD11  LEU  32          HD11      LEU  32  41.311  -5.610   2.452
  231   HD12  LEU  32          HD12      LEU  32  41.167  -4.209   1.392
  232   HD13  LEU  32          HD13      LEU  32  42.751  -4.697   1.996
  233   HD21  LEU  32          HD21      LEU  32  43.296  -7.630   0.521
  234   HD22  LEU  32          HD22      LEU  32  41.584  -8.053   0.490
  235   HD23  LEU  32          HD23      LEU  32  42.307  -7.413   1.966
  236    H    LEU  33           H        LEU  33  38.631  -4.387   0.201
  237    HA   LEU  33           HA       LEU  33  38.651  -4.148   2.992
  238    HG   LEU  33           HG       LEU  33  39.800  -2.091   2.432
  239    HB2  LEU  33           HB2      LEU  33  37.251  -2.513   0.883
  240    HB3  LEU  33           HB3      LEU  33  37.233  -2.095   2.590
  241   HD11  LEU  33          HD11      LEU  33  40.414  -1.330   0.006
  242   HD12  LEU  33          HD12      LEU  33  39.031  -2.332  -0.436
  243   HD13  LEU  33          HD13      LEU  33  40.393  -3.041   0.436
  244   HD21  LEU  33          HD21      LEU  33  39.725   0.213   1.333
  245   HD22  LEU  33          HD22      LEU  33  38.741  -0.041   2.771
  246   HD23  LEU  33          HD23      LEU  33  37.991  -0.058   1.174
  247    H    GLN  34           H        GLN  34  35.972  -4.832   0.768
  248    HA   GLN  34           HA       GLN  34  33.852  -4.660   2.546
  249    HB2  GLN  34           HB2      GLN  34  34.339  -5.667  -0.058
  250    HB3  GLN  34           HB3      GLN  34  33.391  -6.868   0.808
  251    HG2  GLN  34           HG2      GLN  34  31.815  -5.526  -0.262
  252    HG3  GLN  34           HG3      GLN  34  31.817  -4.958   1.402
  253   HE21  GLN  34          HE21      GLN  34  34.484  -3.622   0.774
  254   HE22  GLN  34          HE22      GLN  34  34.039  -2.173  -0.051
  255    H    THR  35           H        THR  35  36.042  -7.398   2.016
  256    HA   THR  35           HA       THR  35  34.551  -9.080   3.840
  257    HB   THR  35           HB       THR  35  37.243  -9.589   2.550
  258    HG1  THR  35           HG1      THR  35  35.984  -9.377   0.830
  259   HG21  THR  35          HG21      THR  35  35.778 -11.947   2.671
  260   HG22  THR  35          HG22      THR  35  35.566 -11.197   4.253
  261   HG23  THR  35          HG23      THR  35  37.188 -11.517   3.639
  262    H    LYS  36           H        LYS  36  36.916  -6.708   4.117
  263    HA   LYS  36           HA       LYS  36  37.823  -7.770   6.709
  264    HB2  LYS  36           HB2      LYS  36  39.153  -5.785   4.858
  265    HB3  LYS  36           HB3      LYS  36  39.745  -6.203   6.461
  266    HG2  LYS  36           HG2      LYS  36  39.988  -8.546   5.738
  267    HG3  LYS  36           HG3      LYS  36  39.462  -8.077   4.119
  268    HD2  LYS  36           HD2      LYS  36  41.376  -6.759   3.763
  269    HD3  LYS  36           HD3      LYS  36  41.805  -6.782   5.476
  270    HE2  LYS  36           HE2      LYS  36  42.197  -9.223   5.302
  271    HE3  LYS  36           HE3      LYS  36  41.832  -9.136   3.581
  272    HZ1  LYS  36           HZ1      LYS  36  43.768  -7.284   3.843
  273    HZ2  LYS  36           HZ2      LYS  36  44.028  -8.888   3.373
  274    HZ3  LYS  36           HZ3      LYS  36  44.247  -8.432   4.995
  275    H    ASN  37           H        ASN  37  35.329  -6.497   6.428
  276    HA   ASN  37           HA       ASN  37  34.022  -4.770   7.085
  277    HB2  ASN  37           HB2      ASN  37  34.422  -3.984   9.422
  278    HB3  ASN  37           HB3      ASN  37  34.370  -5.733   9.239
  279   HD21  ASN  37          HD21      ASN  37  36.185  -3.043  10.273
  280   HD22  ASN  37          HD22      ASN  37  37.597  -3.897  10.782
  281    H    TYR  38           H        TYR  38  35.820  -3.877   5.218
  282    HA   TYR  38           HA       TYR  38  36.540  -1.981   4.240
  283    HD1  TYR  38           HD1      TYR  38  34.710  -1.016   2.792
  284    HD2  TYR  38           HD2      TYR  38  32.911  -1.443   6.619
  285    HE1  TYR  38           HE1      TYR  38  32.619  -1.735   1.726
  286    HE2  TYR  38           HE2      TYR  38  30.812  -2.165   5.558
  287    HH   TYR  38           HH       TYR  38  29.991  -3.054   3.525
  288    HB2  TYR  38           HB2      TYR  38  35.057  -0.583   6.483
  289    HB3  TYR  38           HB3      TYR  38  35.585   0.153   4.969
  290    H    ASP  39           H        ASP  39  38.577  -2.925   5.051
  291    HA   ASP  39           HA       ASP  39  39.870  -1.275   7.116
  292    HB2  ASP  39           HB2      ASP  39  39.841  -3.812   7.264
  293    HB3  ASP  39           HB3      ASP  39  40.941  -3.815   5.891
  294    H    ILE  40           H        ILE  40  41.188   0.282   6.485
  295    HA   ILE  40           HA       ILE  40  42.461   0.109   3.862
  296    HB   ILE  40           HB       ILE  40  43.361   2.415   4.447
  297   HG12  ILE  40          HG12      ILE  40  42.564   2.037   6.950
  298   HG13  ILE  40          HG13      ILE  40  42.550   3.640   6.225
  299   HG21  ILE  40          HG21      ILE  40  41.162   3.492   3.873
  300   HG22  ILE  40          HG22      ILE  40  40.434   1.894   4.010
  301   HG23  ILE  40          HG23      ILE  40  41.682   2.193   2.800
  302   HD11  ILE  40          HD11      ILE  40  40.112   3.129   5.625
  303   HD12  ILE  40          HD12      ILE  40  40.503   3.486   7.306
  304   HD13  ILE  40          HD13      ILE  40  40.247   1.818   6.795
  305    H    GLY  41           H        GLY  41  42.966  -0.724   7.037
  306    HA2  GLY  41           HA2      GLY  41  45.745  -0.197   7.264
  307    HA3  GLY  41           HA3      GLY  41  44.839  -1.349   8.226
  308    H    ALA  42           H        ALA  42  43.831  -2.766   5.977
  309    HA   ALA  42           HA       ALA  42  46.241  -4.246   5.212
  310    HB1  ALA  42           HB1      ALA  42  44.968  -6.157   5.019
  311    HB2  ALA  42           HB2      ALA  42  43.481  -5.261   4.706
  312    HB3  ALA  42           HB3      ALA  42  44.150  -5.318   6.338
  313    H    ALA  43           H        ALA  43  43.942  -2.080   4.011
  314    HA   ALA  43           HA       ALA  43  43.939  -2.962   1.284
  315    HB1  ALA  43           HB1      ALA  43  43.290  -0.143   1.902
  316    HB2  ALA  43           HB2      ALA  43  42.274  -1.385   2.642
  317    HB3  ALA  43           HB3      ALA  43  42.444  -1.310   0.887
  318    H    LEU  44           H        LEU  44  45.831  -0.693   3.176
  319    HA   LEU  44           HA       LEU  44  47.168   0.451   0.912
  320    HG   LEU  44           HG       LEU  44  47.461   2.767   1.800
  321    HB2  LEU  44           HB2      LEU  44  47.535   0.562   3.873
  322    HB3  LEU  44           HB3      LEU  44  48.873   1.049   2.843
  323   HD11  LEU  44          HD11      LEU  44  45.270   2.025   1.859
  324   HD12  LEU  44          HD12      LEU  44  45.283   3.284   3.092
  325   HD13  LEU  44          HD13      LEU  44  45.351   1.585   3.566
  326   HD21  LEU  44          HD21      LEU  44  48.047   4.209   3.386
  327   HD22  LEU  44          HD22      LEU  44  48.569   2.811   4.322
  328   HD23  LEU  44          HD23      LEU  44  46.956   3.480   4.565
  329    H    ASP  45           H        ASP  45  47.480  -2.378   2.797
  330    HA   ASP  45           HA       ASP  45  50.181  -3.058   2.172
  331    HB2  ASP  45           HB2      ASP  45  49.141  -4.108   4.059
  332    HB3  ASP  45           HB3      ASP  45  47.785  -4.657   3.084
  333    H    THR  46           H        THR  46  47.107  -3.384   0.552
  334    HA   THR  46           HA       THR  46  48.238  -5.296  -1.299
  335    HB   THR  46           HB       THR  46  45.821  -5.324  -2.171
  336    HG1  THR  46           HG1      THR  46  44.745  -3.708  -1.335
  337   HG21  THR  46          HG21      THR  46  45.635  -6.126   0.633
  338   HG22  THR  46          HG22      THR  46  47.026  -6.784  -0.230
  339   HG23  THR  46          HG23      THR  46  45.395  -7.062  -0.844
  340    H    ILE  47           H        ILE  47  47.763  -1.852  -1.367
  341    HA   ILE  47           HA       ILE  47  47.608  -1.951  -4.300
  342    HB   ILE  47           HB       ILE  47  47.688   0.692  -3.901
  343   HG12  ILE  47          HG12      ILE  47  46.052   1.072  -1.926
  344   HG13  ILE  47          HG13      ILE  47  46.677  -0.458  -1.325
  345   HG21  ILE  47          HG21      ILE  47  45.150  -0.882  -3.562
  346   HG22  ILE  47          HG22      ILE  47  45.970  -0.613  -5.101
  347   HG23  ILE  47          HG23      ILE  47  45.325   0.755  -4.193
  348   HD11  ILE  47          HD11      ILE  47  48.841   1.249  -2.099
  349   HD12  ILE  47          HD12      ILE  47  48.476   0.544  -0.524
  350   HD13  ILE  47          HD13      ILE  47  47.762   2.091  -0.986
  351    H    GLN  48           H        GLN  48  49.887  -1.106  -1.781
  352    HA   GLN  48           HA       GLN  48  52.034  -1.056  -3.701
  353    HB2  GLN  48           HB2      GLN  48  51.215   1.481  -2.279
  354    HB3  GLN  48           HB3      GLN  48  52.862   1.221  -2.826
  355    HG2  GLN  48           HG2      GLN  48  52.289   2.068  -4.781
  356    HG3  GLN  48           HG3      GLN  48  51.230   0.683  -5.038
  357   HE21  GLN  48          HE21      GLN  48  49.260   1.236  -5.596
  358   HE22  GLN  48          HE22      GLN  48  48.397   2.645  -5.064
  359    H    TYR  49           H        TYR  49  51.279   0.168  -0.460
  360    HA   TYR  49           HA       TYR  49  53.798  -0.475   0.625
  361    HD1  TYR  49           HD1      TYR  49  54.298   1.822   0.997
  362    HD2  TYR  49           HD2      TYR  49  50.096   1.966   1.637
  363    HE1  TYR  49           HE1      TYR  49  54.260   4.138   0.181
  364    HE2  TYR  49           HE2      TYR  49  50.046   4.282   0.822
  365    HH   TYR  49           HH       TYR  49  51.855   5.648  -0.944
  366    HB2  TYR  49           HB2      TYR  49  51.214   0.019   2.121
  367    HB3  TYR  49           HB3      TYR  49  52.855   0.249   2.732
  368    H    SER  50           H        SER  50  53.671  -1.755   2.895
  369    HA   SER  50           HA       SER  50  52.151  -4.222   2.641
  370    HG   SER  50           HG       SER  50  53.313  -4.231   0.605
  371    HB2  SER  50           HB2      SER  50  55.182  -4.269   2.604
  372    HB3  SER  50           HB3      SER  50  54.118  -5.676   2.633
  373    H    LYS  51           H        LYS  51  52.482  -1.988   4.583
  374    HA   LYS  51           HA       LYS  51  53.011  -3.670   6.921
  375    HB2  LYS  51           HB2      LYS  51  54.036  -0.874   6.439
  376    HB3  LYS  51           HB3      LYS  51  53.843  -1.517   8.061
  377    HG2  LYS  51           HG2      LYS  51  56.085  -1.880   7.590
  378    HG3  LYS  51           HG3      LYS  51  55.345  -3.445   7.263
  379    HD2  LYS  51           HD2      LYS  51  55.299  -2.911   4.870
  380    HD3  LYS  51           HD3      LYS  51  56.060  -1.355   5.206
  381    HE2  LYS  51           HE2      LYS  51  58.009  -2.535   6.142
  382    HE3  LYS  51           HE3      LYS  51  57.246  -4.078   5.758
  383    HZ1  LYS  51           HZ1      LYS  51  57.702  -3.860   3.561
  384    HZ2  LYS  51           HZ2      LYS  51  58.971  -2.899   4.149
  385    HZ3  LYS  51           HZ3      LYS  51  57.555  -2.168   3.563
  386    H    HIS  52           H        HIS  52  51.394  -3.638   8.334
  387    HA   HIS  52           HA       HIS  52  49.065  -2.100   7.691
  388    HD1  HIS  52           HD1      HIS  52  47.940  -6.228   9.610
  389    HD2  HIS  52           HD2      HIS  52  49.045  -4.038   6.253
  390    HE1  HIS  52           HE1      HIS  52  47.514  -7.725   7.616
  391    HB2  HIS  52           HB2      HIS  52  49.626  -4.032   9.956
  392    HB3  HIS  52           HB3      HIS  52  48.060  -3.284   9.664
  Start of MODEL   25
    1    H1   GLY   1           1H       GLY   1  28.607  -5.546  -1.564
    2    H2   GLY   1           2H       GLY   1  29.515  -4.896  -2.842
    3    H3   GLY   1           3H       GLY   1  28.761  -6.406  -3.017
    4    HA2  GLY   1           HA2      GLY   1  27.273  -5.129  -4.135
    5    HA3  GLY   1           HA3      GLY   1  26.607  -5.061  -2.508
    6    H    SER   2           H        SER   2  26.012  -3.104  -4.361
    7    HA   SER   2           HA       SER   2  27.722  -0.868  -4.289
    8    HG   SER   2           HG       SER   2  25.609  -0.653  -6.952
    9    HB2  SER   2           HB2      SER   2  24.719  -0.951  -4.666
   10    HB3  SER   2           HB3      SER   2  25.770   0.407  -5.072
   11    HA   PRO   3           HA       PRO   3  26.731   0.334  -0.103
   12    HB2  PRO   3           HB2      PRO   3  28.955   1.713   0.349
   13    HB3  PRO   3           HB3      PRO   3  29.029  -0.035   0.099
   14    HG2  PRO   3           HG2      PRO   3  29.729   2.183  -1.767
   15    HG3  PRO   3           HG3      PRO   3  30.496   0.598  -1.571
   16    HD2  PRO   3           HD2      PRO   3  28.591   1.324  -3.519
   17    HD3  PRO   3           HD3      PRO   3  29.158  -0.311  -3.146
   18    HA   PRO   4           HA       PRO   4  25.100   4.468  -0.059
   19    HB2  PRO   4           HB2      PRO   4  26.955   5.260   2.107
   20    HB3  PRO   4           HB3      PRO   4  25.189   5.294   2.070
   21    HG2  PRO   4           HG2      PRO   4  26.479   3.458   3.497
   22    HG3  PRO   4           HG3      PRO   4  25.001   3.046   2.605
   23    HD2  PRO   4           HD2      PRO   4  27.859   2.489   1.902
   24    HD3  PRO   4           HD3      PRO   4  26.432   1.446   1.725
   25    H    GLU   5           H        GLU   5  25.630   6.787  -0.314
   26    HA   GLU   5           HA       GLU   5  27.834   7.022  -2.157
   27    HB2  GLU   5           HB2      GLU   5  25.763   9.046  -1.295
   28    HB3  GLU   5           HB3      GLU   5  26.915   9.267  -2.606
   29    HG2  GLU   5           HG2      GLU   5  24.826   7.098  -2.520
   30    HG3  GLU   5           HG3      GLU   5  24.645   8.635  -3.361
   31    H    ALA   6           H        ALA   6  29.686   6.914  -0.892
   32    HA   ALA   6           HA       ALA   6  31.398   7.690   0.392
   33    HB1  ALA   6           HB1      ALA   6  31.212  10.323   0.822
   34    HB2  ALA   6           HB2      ALA   6  30.099  10.180  -0.539
   35    HB3  ALA   6           HB3      ALA   6  31.769   9.640  -0.706
   36    H    ASP   7           H        ASP   7  29.980   6.387   1.893
   37    HA   ASP   7           HA       ASP   7  28.807   7.908   4.086
   38    HB2  ASP   7           HB2      ASP   7  27.667   5.883   3.180
   39    HB3  ASP   7           HB3      ASP   7  29.071   4.917   3.608
   40    HA   PRO   8           HA       PRO   8  32.429   8.043   6.665
   41    HB2  PRO   8           HB2      PRO   8  30.700   6.556   8.609
   42    HB3  PRO   8           HB3      PRO   8  31.759   7.943   8.887
   43    HG2  PRO   8           HG2      PRO   8  29.126   8.281   8.650
   44    HG3  PRO   8           HG3      PRO   8  30.260   9.449   7.942
   45    HD2  PRO   8           HD2      PRO   8  28.553   7.419   6.603
   46    HD3  PRO   8           HD3      PRO   8  29.168   8.965   5.986
   47    H    ARG   9           H        ARG   9  30.731   5.060   6.114
   48    HA   ARG   9           HA       ARG   9  32.692   3.243   7.067
   49    HE   ARG   9           HE       ARG   9  29.588   0.008   6.279
   50    HB2  ARG   9           HB2      ARG   9  30.566   2.941   4.931
   51    HB3  ARG   9           HB3      ARG   9  31.499   1.609   5.624
   52    HG2  ARG   9           HG2      ARG   9  30.448   1.774   7.686
   53    HG3  ARG   9           HG3      ARG   9  29.909   3.428   7.389
   54    HD2  ARG   9           HD2      ARG   9  27.989   2.065   7.217
   55    HD3  ARG   9           HD3      ARG   9  28.431   2.503   5.570
   56   HH11  ARG   9          HH11      ARG   9  26.542   1.513   5.447
   57   HH12  ARG   9          HH12      ARG   9  25.828   0.047   4.841
   58   HH21  ARG   9          HH21      ARG   9  28.645  -1.945   5.497
   59   HH22  ARG   9          HH22      ARG   9  27.025  -1.917   4.861
   60    H    LEU  10           H        LEU  10  31.974   4.363   3.716
   61    HA   LEU  10           HA       LEU  10  34.542   3.269   2.892
   62    HG   LEU  10           HG       LEU  10  32.995   1.566   2.181
   63    HB2  LEU  10           HB2      LEU  10  32.236   4.267   1.232
   64    HB3  LEU  10           HB3      LEU  10  33.725   3.598   0.591
   65   HD11  LEU  10          HD11      LEU  10  30.398   2.785   1.264
   66   HD12  LEU  10          HD12      LEU  10  30.960   2.689   2.934
   67   HD13  LEU  10          HD13      LEU  10  30.601   1.213   2.039
   68   HD21  LEU  10          HD21      LEU  10  32.627   2.239  -0.651
   69   HD22  LEU  10          HD22      LEU  10  31.627   0.912  -0.059
   70   HD23  LEU  10          HD23      LEU  10  33.383   0.834   0.100
   71    H    ILE  11           H        ILE  11  32.961   6.366   3.311
   72    HA   ILE  11           HA       ILE  11  34.697   7.846   1.626
   73    HB   ILE  11           HB       ILE  11  32.520   8.711   2.617
   74   HG12  ILE  11          HG12      ILE  11  34.982  10.441   2.921
   75   HG13  ILE  11          HG13      ILE  11  34.104  10.156   1.420
   76   HG21  ILE  11          HG21      ILE  11  34.221   9.401   4.999
   77   HG22  ILE  11          HG22      ILE  11  33.096   8.041   4.964
   78   HG23  ILE  11          HG23      ILE  11  32.496   9.690   4.777
   79   HD11  ILE  11          HD11      ILE  11  32.719  11.811   1.875
   80   HD12  ILE  11          HD12      ILE  11  33.683  12.178   3.306
   81   HD13  ILE  11          HD13      ILE  11  32.300  11.090   3.430
   82    H    GLU  12           H        GLU  12  35.063   6.343   4.657
   83    HA   GLU  12           HA       GLU  12  37.532   7.822   5.252
   84    HB2  GLU  12           HB2      GLU  12  35.990   5.746   6.800
   85    HB3  GLU  12           HB3      GLU  12  37.576   6.323   7.298
   86    HG2  GLU  12           HG2      GLU  12  35.225   8.138   6.854
   87    HG3  GLU  12           HG3      GLU  12  35.617   7.413   8.414
   88    H    SER  13           H        SER  13  36.448   4.639   4.204
   89    HA   SER  13           HA       SER  13  39.154   3.609   4.436
   90    HG   SER  13           HG       SER  13  35.557   2.340   4.312
   91    HB2  SER  13           HB2      SER  13  38.097   1.422   3.845
   92    HB3  SER  13           HB3      SER  13  37.417   2.183   5.286
   93    H    LEU  14           H        LEU  14  36.720   3.936   1.850
   94    HA   LEU  14           HA       LEU  14  38.685   3.079  -0.103
   95    HG   LEU  14           HG       LEU  14  37.736   2.306  -2.222
   96    HB2  LEU  14           HB2      LEU  14  36.291   2.239  -0.045
   97    HB3  LEU  14           HB3      LEU  14  35.790   3.844  -0.537
   98   HD11  LEU  14          HD11      LEU  14  34.948   1.630  -1.699
   99   HD12  LEU  14          HD12      LEU  14  36.217   0.691  -2.484
  100   HD13  LEU  14          HD13      LEU  14  35.305   1.885  -3.407
  101   HD21  LEU  14          HD21      LEU  14  35.729   4.496  -2.682
  102   HD22  LEU  14          HD22      LEU  14  36.455   3.581  -4.003
  103   HD23  LEU  14          HD23      LEU  14  37.475   4.538  -2.930
  104    H    SER  15           H        SER  15  36.681   5.847   0.747
  105    HA   SER  15           HA       SER  15  37.559   7.399  -1.427
  106    HG   SER  15           HG       SER  15  36.739  10.240  -0.106
  107    HB2  SER  15           HB2      SER  15  35.450   7.783  -0.066
  108    HB3  SER  15           HB3      SER  15  36.490   8.537   1.145
  109    H    GLN  16           H        GLN  16  38.951   6.654   1.623
  110    HA   GLN  16           HA       GLN  16  40.728   8.806   1.986
  111    HB2  GLN  16           HB2      GLN  16  40.485   7.149   3.723
  112    HB3  GLN  16           HB3      GLN  16  40.977   5.859   2.638
  113    HG2  GLN  16           HG2      GLN  16  42.890   8.068   3.214
  114    HG3  GLN  16           HG3      GLN  16  42.623   6.823   4.431
  115   HE21  GLN  16          HE21      GLN  16  44.597   7.679   1.979
  116   HE22  GLN  16          HE22      GLN  16  45.157   6.121   1.471
  117    H    MET  17           H        MET  17  41.312   5.658   0.448
  118    HA   MET  17           HA       MET  17  43.777   6.557  -0.656
  119    HB2  MET  17           HB2      MET  17  43.763   4.305  -1.788
  120    HB3  MET  17           HB3      MET  17  43.674   4.278  -0.034
  121    HG2  MET  17           HG2      MET  17  41.146   4.081  -0.350
  122    HG3  MET  17           HG3      MET  17  41.520   3.694  -2.030
  123    HE1  MET  17           HE1      MET  17  44.287   2.261  -1.682
  124    HE2  MET  17           HE2      MET  17  43.086   1.481  -2.710
  125    HE3  MET  17           HE3      MET  17  43.906   0.554  -1.452
  126    H    LEU  18           H        LEU  18  40.506   6.568  -1.757
  127    HA   LEU  18           HA       LEU  18  41.072   6.701  -4.557
  128    HG   LEU  18           HG       LEU  18  38.769   8.389  -5.547
  129    HB2  LEU  18           HB2      LEU  18  38.833   6.189  -3.477
  130    HB3  LEU  18           HB3      LEU  18  38.699   7.905  -3.141
  131   HD11  LEU  18          HD11      LEU  18  40.117   6.467  -6.249
  132   HD12  LEU  18          HD12      LEU  18  38.621   6.586  -7.171
  133   HD13  LEU  18          HD13      LEU  18  38.768   5.391  -5.882
  134   HD21  LEU  18          HD21      LEU  18  36.591   8.261  -4.785
  135   HD22  LEU  18          HD22      LEU  18  36.703   6.534  -4.441
  136   HD23  LEU  18          HD23      LEU  18  36.596   7.093  -6.110
  137    H    SER  19           H        SER  19  40.745   9.083  -1.975
  138    HA   SER  19           HA       SER  19  41.103  11.313  -3.776
  139    HG   SER  19           HG       SER  19  40.113  13.486  -1.393
  140    HB2  SER  19           HB2      SER  19  39.657  11.408  -1.721
  141    HB3  SER  19           HB3      SER  19  41.124  11.315  -0.746
  142    H    MET  20           H        MET  20  43.072   9.405  -1.588
  143    HA   MET  20           HA       MET  20  45.239  11.216  -1.389
  144    HB2  MET  20           HB2      MET  20  44.801   9.319   0.177
  145    HB3  MET  20           HB3      MET  20  45.312   8.207  -1.083
  146    HG2  MET  20           HG2      MET  20  47.069   8.639   0.574
  147    HG3  MET  20           HG3      MET  20  47.538   9.116  -1.058
  148    HE1  MET  20           HE1      MET  20  45.107  10.751   1.340
  149    HE2  MET  20           HE2      MET  20  45.871  12.261   1.832
  150    HE3  MET  20           HE3      MET  20  46.378  10.736   2.562
  151    H    GLY  21           H        GLY  21  44.373   8.812  -3.764
  152    HA2  GLY  21           HA2      GLY  21  45.295   9.154  -6.010
  153    HA3  GLY  21           HA3      GLY  21  46.836   9.513  -5.237
  154    H    PHE  22           H        PHE  22  44.603   6.915  -4.430
  155    HA   PHE  22           HA       PHE  22  46.593   4.958  -5.370
  156    HD1  PHE  22           HD2      PHE  22  47.785   6.060  -4.065
  157    HD2  PHE  22           HD1      PHE  22  45.976   3.864  -0.896
  158    HE1  PHE  22           HE2      PHE  22  49.615   6.723  -2.561
  159    HE2  PHE  22           HE1      PHE  22  47.808   4.518   0.604
  160    HZ   PHE  22           HZ       PHE  22  49.630   5.950  -0.222
  161    HB2  PHE  22           HB2      PHE  22  44.693   4.756  -3.010
  162    HB3  PHE  22           HB3      PHE  22  45.672   3.423  -3.615
  163    H    SER  23           H        SER  23  45.087   2.699  -5.357
  164    HA   SER  23           HA       SER  23  42.457   3.208  -6.348
  165    HG   SER  23           HG       SER  23  43.548   4.655  -7.828
  166    HB2  SER  23           HB2      SER  23  44.539   2.189  -8.317
  167    HB3  SER  23           HB3      SER  23  42.801   2.226  -8.613
  168    H    ASP  24           H        ASP  24  43.028   0.584  -8.013
  169    HA   ASP  24           HA       ASP  24  43.265  -1.224  -5.720
  170    HB2  ASP  24           HB2      ASP  24  41.797  -2.838  -7.054
  171    HB3  ASP  24           HB3      ASP  24  40.990  -1.476  -6.285
  172    H    GLU  25           H        GLU  25  44.759  -2.801  -5.946
  173    HA   GLU  25           HA       GLU  25  46.329  -2.776  -8.401
  174    HB2  GLU  25           HB2      GLU  25  47.312  -2.815  -6.026
  175    HB3  GLU  25           HB3      GLU  25  46.833  -4.505  -5.978
  176    HG2  GLU  25           HG2      GLU  25  48.200  -4.836  -8.061
  177    HG3  GLU  25           HG3      GLU  25  48.822  -3.207  -7.813
  178    H    GLY  26           H        GLY  26  43.857  -3.711  -8.989
  179    HA2  GLY  26           HA2      GLY  26  44.069  -5.901 -10.458
  180    HA3  GLY  26           HA3      GLY  26  43.942  -6.634  -8.865
  181    H    GLY  27           H        GLY  27  42.091  -4.019  -8.473
  182    HA2  GLY  27           HA2      GLY  27  39.851  -3.522  -9.148
  183    HA3  GLY  27           HA3      GLY  27  39.721  -5.154  -9.790
  184    H    TRP  28           H        TRP  28  41.251  -4.942  -6.779
  185    HA   TRP  28           HA       TRP  28  39.021  -6.316  -5.546
  186    HD1  TRP  28           HD1      TRP  28  43.430  -6.602  -6.215
  187    HE1  TRP  28           HE1      TRP  28  45.224  -4.901  -5.503
  188    HE3  TRP  28           HE3      TRP  28  40.917  -4.262  -2.427
  189    HZ2  TRP  28           HZ2      TRP  28  45.528  -2.846  -3.625
  190    HZ3  TRP  28           HZ3      TRP  28  42.030  -2.429  -1.232
  191    HH2  TRP  28           HH2      TRP  28  44.290  -1.736  -1.818
  192    HB2  TRP  28           HB2      TRP  28  40.682  -6.689  -3.683
  193    HB3  TRP  28           HB3      TRP  28  41.152  -7.358  -5.247
  194    H    LEU  29           H        LEU  29  39.968  -3.108  -5.711
  195    HA   LEU  29           HA       LEU  29  40.002  -2.278  -3.091
  196    HG   LEU  29           HG       LEU  29  38.055   0.326  -3.695
  197    HB2  LEU  29           HB2      LEU  29  40.693  -0.733  -4.702
  198    HB3  LEU  29           HB3      LEU  29  39.192  -0.840  -5.599
  199   HD11  LEU  29          HD11      LEU  29  39.419   1.465  -2.040
  200   HD12  LEU  29          HD12      LEU  29  40.876   0.738  -2.717
  201   HD13  LEU  29          HD13      LEU  29  39.659  -0.279  -1.945
  202   HD21  LEU  29          HD21      LEU  29  39.742   2.455  -4.163
  203   HD22  LEU  29          HD22      LEU  29  38.364   1.981  -5.156
  204   HD23  LEU  29          HD23      LEU  29  39.986   1.422  -5.571
  205    H    THR  30           H        THR  30  37.181  -2.951  -5.069
  206    HA   THR  30           HA       THR  30  35.411  -2.060  -2.935
  207    HB   THR  30           HB       THR  30  33.594  -2.626  -4.469
  208    HG1  THR  30           HG1      THR  30  34.004  -4.161  -5.820
  209   HG21  THR  30          HG21      THR  30  34.706  -0.443  -4.764
  210   HG22  THR  30          HG22      THR  30  34.007  -1.085  -6.251
  211   HG23  THR  30          HG23      THR  30  35.747  -1.178  -5.984
  212    H    ARG  31           H        ARG  31  37.113  -4.840  -3.755
  213    HA   ARG  31           HA       ARG  31  35.142  -6.708  -2.680
  214    HE   ARG  31           HE       ARG  31  33.901  -8.211  -4.562
  215    HB2  ARG  31           HB2      ARG  31  37.913  -7.501  -3.503
  216    HB3  ARG  31           HB3      ARG  31  36.424  -8.426  -3.587
  217    HG2  ARG  31           HG2      ARG  31  37.160  -6.107  -5.367
  218    HG3  ARG  31           HG3      ARG  31  37.242  -7.814  -5.802
  219    HD2  ARG  31           HD2      ARG  31  34.777  -6.193  -5.171
  220    HD3  ARG  31           HD3      ARG  31  35.243  -6.887  -6.725
  221   HH11  ARG  31          HH11      ARG  31  35.983  -8.707  -7.335
  222   HH12  ARG  31          HH12      ARG  31  35.616 -10.401  -7.458
  223   HH21  ARG  31          HH21      ARG  31  33.446 -10.423  -4.707
  224   HH22  ARG  31          HH22      ARG  31  34.191 -11.381  -5.952
  225    H    LEU  32           H        LEU  32  38.525  -5.838  -2.112
  226    HA   LEU  32           HA       LEU  32  39.074  -7.359   0.126
  227    HG   LEU  32           HG       LEU  32  42.349  -5.566   0.207
  228    HB2  LEU  32           HB2      LEU  32  40.634  -5.999  -1.330
  229    HB3  LEU  32           HB3      LEU  32  40.119  -4.579  -0.444
  230   HD11  LEU  32          HD11      LEU  32  40.202  -4.665   1.930
  231   HD12  LEU  32          HD12      LEU  32  41.909  -4.224   1.913
  232   HD13  LEU  32          HD13      LEU  32  41.379  -5.668   2.776
  233   HD21  LEU  32          HD21      LEU  32  41.175  -7.946   0.178
  234   HD22  LEU  32          HD22      LEU  32  40.951  -7.554   1.884
  235   HD23  LEU  32          HD23      LEU  32  42.573  -7.584   1.193
  236    H    LEU  33           H        LEU  33  38.442  -3.868   0.219
  237    HA   LEU  33           HA       LEU  33  38.130  -3.620   2.944
  238    HG   LEU  33           HG       LEU  33  39.324  -1.484   2.459
  239    HB2  LEU  33           HB2      LEU  33  36.918  -2.003   0.706
  240    HB3  LEU  33           HB3      LEU  33  36.800  -1.544   2.394
  241   HD11  LEU  33          HD11      LEU  33  40.044  -2.743   0.638
  242   HD12  LEU  33          HD12      LEU  33  40.333  -1.073   0.144
  243   HD13  LEU  33          HD13      LEU  33  38.930  -1.945  -0.476
  244   HD21  LEU  33          HD21      LEU  33  39.400   0.713   1.731
  245   HD22  LEU  33          HD22      LEU  33  37.688   0.464   2.073
  246   HD23  LEU  33          HD23      LEU  33  38.271   0.420   0.407
  247    H    GLN  34           H        GLN  34  35.558  -3.947   0.534
  248    HA   GLN  34           HA       GLN  34  33.289  -3.754   1.957
  249    HB2  GLN  34           HB2      GLN  34  33.547  -4.259  -0.448
  250    HB3  GLN  34           HB3      GLN  34  33.846  -5.935  -0.042
  251    HG2  GLN  34           HG2      GLN  34  31.624  -5.971  -0.625
  252    HG3  GLN  34           HG3      GLN  34  31.548  -5.844   1.129
  253   HE21  GLN  34          HE21      GLN  34  32.545  -2.907  -0.010
  254   HE22  GLN  34          HE22      GLN  34  31.019  -2.113  -0.109
  255    H    THR  35           H        THR  35  34.887  -6.906   1.495
  256    HA   THR  35           HA       THR  35  33.200  -8.286   3.268
  257    HB   THR  35           HB       THR  35  36.004  -9.148   2.580
  258    HG1  THR  35           HG1      THR  35  35.380  -8.728   0.590
  259   HG21  THR  35          HG21      THR  35  35.369 -11.166   3.221
  260   HG22  THR  35          HG22      THR  35  33.956 -11.106   2.164
  261   HG23  THR  35          HG23      THR  35  33.861 -10.465   3.806
  262    H    LYS  36           H        LYS  36  36.199  -6.573   3.740
  263    HA   LYS  36           HA       LYS  36  36.491  -7.591   6.450
  264    HB2  LYS  36           HB2      LYS  36  38.282  -5.866   4.746
  265    HB3  LYS  36           HB3      LYS  36  38.671  -6.411   6.374
  266    HG2  LYS  36           HG2      LYS  36  38.801  -8.663   5.711
  267    HG3  LYS  36           HG3      LYS  36  38.000  -8.340   4.174
  268    HD2  LYS  36           HD2      LYS  36  40.392  -8.693   3.857
  269    HD3  LYS  36           HD3      LYS  36  39.933  -7.045   3.430
  270    HE2  LYS  36           HE2      LYS  36  42.034  -7.150   4.718
  271    HE3  LYS  36           HE3      LYS  36  40.777  -6.217   5.531
  272    HZ1  LYS  36           HZ1      LYS  36  42.141  -7.883   6.886
  273    HZ2  LYS  36           HZ2      LYS  36  41.177  -9.079   6.155
  274    HZ3  LYS  36           HZ3      LYS  36  40.459  -7.863   7.105
  275    H    ASN  37           H        ASN  37  34.273  -5.959   6.056
  276    HA   ASN  37           HA       ASN  37  33.170  -4.100   6.722
  277    HB2  ASN  37           HB2      ASN  37  33.603  -3.407   9.087
  278    HB3  ASN  37           HB3      ASN  37  33.314  -5.130   8.859
  279   HD21  ASN  37          HD21      ASN  37  35.799  -2.703   9.406
  280   HD22  ASN  37          HD22      ASN  37  36.938  -3.773  10.140
  281    H    TYR  38           H        TYR  38  35.132  -3.409   4.957
  282    HA   TYR  38           HA       TYR  38  36.132  -1.603   4.047
  283    HD1  TYR  38           HD1      TYR  38  34.488  -0.884   2.497
  284    HD2  TYR  38           HD2      TYR  38  32.326  -0.428   6.125
  285    HE1  TYR  38           HE1      TYR  38  32.405  -1.446   1.321
  286    HE2  TYR  38           HE2      TYR  38  30.241  -0.995   4.961
  287    HH   TYR  38           HH       TYR  38  29.698  -2.416   2.735
  288    HB2  TYR  38           HB2      TYR  38  34.592  -0.069   6.145
  289    HB3  TYR  38           HB3      TYR  38  35.264   0.587   4.654
  290    H    ASP  39           H        ASP  39  38.150  -2.499   4.955
  291    HA   ASP  39           HA       ASP  39  39.215  -0.643   6.991
  292    HB2  ASP  39           HB2      ASP  39  40.881  -2.306   7.619
  293    HB3  ASP  39           HB3      ASP  39  39.246  -2.923   7.823
  294    H    ILE  40           H        ILE  40  41.034   0.455   6.702
  295    HA   ILE  40           HA       ILE  40  42.155   0.510   4.011
  296    HB   ILE  40           HB       ILE  40  43.540   2.443   5.086
  297   HG12  ILE  40          HG12      ILE  40  42.473   1.745   7.405
  298   HG13  ILE  40          HG13      ILE  40  42.804   3.433   7.033
  299   HG21  ILE  40          HG21      ILE  40  42.257   3.606   3.726
  300   HG22  ILE  40          HG22      ILE  40  40.958   3.603   4.918
  301   HG23  ILE  40          HG23      ILE  40  41.069   2.302   3.732
  302   HD11  ILE  40          HD11      ILE  40  40.681   3.580   7.873
  303   HD12  ILE  40          HD12      ILE  40  40.193   2.014   7.223
  304   HD13  ILE  40          HD13      ILE  40  40.336   3.407   6.151
  305    H    GLY  41           H        GLY  41  42.699  -0.850   7.031
  306    HA2  GLY  41           HA2      GLY  41  45.457  -0.718   7.293
  307    HA3  GLY  41           HA3      GLY  41  44.451  -1.973   7.982
  308    H    ALA  42           H        ALA  42  43.500  -3.248   5.872
  309    HA   ALA  42           HA       ALA  42  45.866  -4.542   4.795
  310    HB1  ALA  42           HB1      ALA  42  43.097  -5.460   4.179
  311    HB2  ALA  42           HB2      ALA  42  43.762  -5.712   5.795
  312    HB3  ALA  42           HB3      ALA  42  44.574  -6.403   4.389
  313    H    ALA  43           H        ALA  43  43.546  -2.261   3.851
  314    HA   ALA  43           HA       ALA  43  43.446  -2.781   1.063
  315    HB1  ALA  43           HB1      ALA  43  43.124  -0.046   2.240
  316    HB2  ALA  43           HB2      ALA  43  41.901  -1.293   2.477
  317    HB3  ALA  43           HB3      ALA  43  42.311  -0.756   0.847
  318    H    LEU  44           H        LEU  44  45.438  -0.568   3.006
  319    HA   LEU  44           HA       LEU  44  46.855   0.465   0.756
  320    HG   LEU  44           HG       LEU  44  45.583   1.624   3.595
  321    HB2  LEU  44           HB2      LEU  44  47.685   0.475   3.657
  322    HB3  LEU  44           HB3      LEU  44  48.341   1.492   2.383
  323   HD11  LEU  44          HD11      LEU  44  48.046   3.310   3.646
  324   HD12  LEU  44          HD12      LEU  44  47.005   2.798   4.979
  325   HD13  LEU  44          HD13      LEU  44  46.457   4.050   3.864
  326   HD21  LEU  44          HD21      LEU  44  46.661   3.227   1.280
  327   HD22  LEU  44          HD22      LEU  44  45.075   3.392   2.035
  328   HD23  LEU  44          HD23      LEU  44  45.480   1.924   1.143
  329    H    ASP  45           H        ASP  45  47.192  -2.286   2.783
  330    HA   ASP  45           HA       ASP  45  49.905  -2.905   2.403
  331    HB2  ASP  45           HB2      ASP  45  48.453  -3.963   4.105
  332    HB3  ASP  45           HB3      ASP  45  47.553  -4.770   2.829
  333    H    THR  46           H        THR  46  47.035  -3.551   0.479
  334    HA   THR  46           HA       THR  46  48.556  -5.235  -1.310
  335    HB   THR  46           HB       THR  46  46.231  -5.507  -2.382
  336    HG1  THR  46           HG1      THR  46  45.042  -3.909  -1.541
  337   HG21  THR  46          HG21      THR  46  47.271  -6.589   0.114
  338   HG22  THR  46          HG22      THR  46  46.546  -7.406  -1.271
  339   HG23  THR  46          HG23      THR  46  45.515  -6.686  -0.033
  340    H    ILE  47           H        ILE  47  48.027  -1.883  -1.326
  341    HA   ILE  47           HA       ILE  47  47.722  -1.927  -4.250
  342    HB   ILE  47           HB       ILE  47  47.690   0.683  -3.887
  343   HG12  ILE  47          HG12      ILE  47  46.277   1.064  -1.739
  344   HG13  ILE  47          HG13      ILE  47  47.035  -0.421  -1.171
  345   HG21  ILE  47          HG21      ILE  47  45.905  -0.651  -4.868
  346   HG22  ILE  47          HG22      ILE  47  45.268   0.606  -3.812
  347   HG23  ILE  47          HG23      ILE  47  45.324  -1.066  -3.256
  348   HD11  ILE  47          HD11      ILE  47  48.800   0.742  -0.536
  349   HD12  ILE  47          HD12      ILE  47  48.049   2.222  -1.133
  350   HD13  ILE  47          HD13      ILE  47  49.073   1.260  -2.200
  351    H    GLN  48           H        GLN  48  50.069  -1.165  -1.817
  352    HA   GLN  48           HA       GLN  48  52.122  -1.025  -3.824
  353    HB2  GLN  48           HB2      GLN  48  51.414   1.432  -2.215
  354    HB3  GLN  48           HB3      GLN  48  53.031   1.182  -2.857
  355    HG2  GLN  48           HG2      GLN  48  52.350   2.191  -4.706
  356    HG3  GLN  48           HG3      GLN  48  51.343   0.775  -5.028
  357   HE21  GLN  48          HE21      GLN  48  49.334   1.246  -5.469
  358   HE22  GLN  48          HE22      GLN  48  48.419   2.571  -4.827
  359    H    TYR  49           H        TYR  49  51.546  -0.077  -0.430
  360    HA   TYR  49           HA       TYR  49  54.031  -1.458   0.242
  361    HD1  TYR  49           HD1      TYR  49  52.385   1.902  -0.356
  362    HD2  TYR  49           HD2      TYR  49  52.035   0.737   3.721
  363    HE1  TYR  49           HE1      TYR  49  50.642   3.600  -0.029
  364    HE2  TYR  49           HE2      TYR  49  50.286   2.430   4.057
  365    HH   TYR  49           HH       TYR  49  49.666   4.673   2.919
  366    HB2  TYR  49           HB2      TYR  49  53.742  -0.146   2.450
  367    HB3  TYR  49           HB3      TYR  49  54.265   0.700   1.007
  368    H    SER  50           H        SER  50  53.806  -3.442   0.891
  369    HA   SER  50           HA       SER  50  51.461  -4.340   2.333
  370    HG   SER  50           HG       SER  50  54.172  -5.333   0.173
  371    HB2  SER  50           HB2      SER  50  52.895  -6.518   2.391
  372    HB3  SER  50           HB3      SER  50  52.213  -5.980   0.856
  373    H    LYS  51           H        LYS  51  52.531  -2.389   3.779
  374    HA   LYS  51           HA       LYS  51  53.558  -3.789   6.127
  375    HB2  LYS  51           HB2      LYS  51  54.845  -1.447   4.759
  376    HB3  LYS  51           HB3      LYS  51  54.987  -1.629   6.503
  377    HG2  LYS  51           HG2      LYS  51  55.836  -3.686   4.467
  378    HG3  LYS  51           HG3      LYS  51  56.913  -2.556   5.300
  379    HD2  LYS  51           HD2      LYS  51  56.198  -3.513   7.456
  380    HD3  LYS  51           HD3      LYS  51  55.201  -4.681   6.588
  381    HE2  LYS  51           HE2      LYS  51  57.171  -5.624   5.536
  382    HE3  LYS  51           HE3      LYS  51  58.194  -4.409   6.306
  383    HZ1  LYS  51           HZ1      LYS  51  56.517  -6.056   8.050
  384    HZ2  LYS  51           HZ2      LYS  51  58.075  -5.438   8.310
  385    HZ3  LYS  51           HZ3      LYS  51  57.863  -6.810   7.331
  386    H    HIS  52           H        HIS  52  52.480  -3.243   7.907
  387    HA   HIS  52           HA       HIS  52  50.463  -1.169   7.687
  388    HD1  HIS  52           HD1      HIS  52  48.613  -4.707  10.085
  389    HD2  HIS  52           HD2      HIS  52  49.751  -3.185   6.386
  390    HE1  HIS  52           HE1      HIS  52  47.382  -6.070   8.344
  391    HB2  HIS  52           HB2      HIS  52  51.017  -3.192   9.870
  392    HB3  HIS  52           HB3      HIS  52  49.686  -2.043   9.898
  Start of MODEL   26
    1    H1   GLY   1           1H       GLY   1  21.603  -2.560   4.482
    2    H2   GLY   1           2H       GLY   1  23.129  -3.264   4.714
    3    H3   GLY   1           3H       GLY   1  22.745  -2.542   3.231
    4    HA2  GLY   1           HA2      GLY   1  22.591  -0.903   5.652
    5    HA3  GLY   1           HA3      GLY   1  24.181  -1.296   5.011
    6    H    SER   2           H        SER   2  24.683   0.773   4.383
    7    HA   SER   2           HA       SER   2  22.928   2.267   2.630
    8    HG   SER   2           HG       SER   2  25.694   4.421   2.247
    9    HB2  SER   2           HB2      SER   2  24.305   3.429   4.317
   10    HB3  SER   2           HB3      SER   2  25.767   2.798   3.561
   11    HA   PRO   3           HA       PRO   3  24.288   0.737  -1.308
   12    HB2  PRO   3           HB2      PRO   3  24.617   3.618  -2.018
   13    HB3  PRO   3           HB3      PRO   3  23.747   2.343  -2.879
   14    HG2  PRO   3           HG2      PRO   3  22.422   4.172  -1.473
   15    HG3  PRO   3           HG3      PRO   3  21.899   2.478  -1.478
   16    HD2  PRO   3           HD2      PRO   3  23.319   4.018   0.644
   17    HD3  PRO   3           HD3      PRO   3  22.117   2.722   0.800
   18    HA   PRO   4           HA       PRO   4  28.670   0.812  -0.779
   19    HB2  PRO   4           HB2      PRO   4  28.856  -0.490  -3.407
   20    HB3  PRO   4           HB3      PRO   4  29.290  -1.109  -1.810
   21    HG2  PRO   4           HG2      PRO   4  27.145  -2.023  -3.153
   22    HG3  PRO   4           HG3      PRO   4  27.159  -1.885  -1.385
   23    HD2  PRO   4           HD2      PRO   4  25.911  -0.069  -3.418
   24    HD3  PRO   4           HD3      PRO   4  25.271  -0.617  -1.853
   25    H    GLU   5           H        GLU   5  27.579   3.213  -1.979
   26    HA   GLU   5           HA       GLU   5  29.935   3.955  -3.560
   27    HB2  GLU   5           HB2      GLU   5  27.155   4.985  -4.163
   28    HB3  GLU   5           HB3      GLU   5  28.628   5.371  -5.036
   29    HG2  GLU   5           HG2      GLU   5  27.429   2.619  -4.882
   30    HG3  GLU   5           HG3      GLU   5  27.130   3.760  -6.189
   31    H    ALA   6           H        ALA   6  28.477   4.224  -0.809
   32    HA   ALA   6           HA       ALA   6  29.713   6.478   0.191
   33    HB1  ALA   6           HB1      ALA   6  27.881   7.505  -1.435
   34    HB2  ALA   6           HB2      ALA   6  28.274   8.251   0.115
   35    HB3  ALA   6           HB3      ALA   6  26.843   7.231  -0.034
   36    H    ASP   7           H        ASP   7  29.762   4.372   1.358
   37    HA   ASP   7           HA       ASP   7  27.487   4.022   3.189
   38    HB2  ASP   7           HB2      ASP   7  28.200   2.055   1.826
   39    HB3  ASP   7           HB3      ASP   7  29.812   2.178   2.512
   40    HA   PRO   8           HA       PRO   8  29.751   5.814   6.585
   41    HB2  PRO   8           HB2      PRO   8  29.281   3.224   7.994
   42    HB3  PRO   8           HB3      PRO   8  29.006   4.876   8.557
   43    HG2  PRO   8           HG2      PRO   8  26.973   3.331   7.759
   44    HG3  PRO   8           HG3      PRO   8  26.999   5.074   7.430
   45    HD2  PRO   8           HD2      PRO   8  27.418   2.793   5.571
   46    HD3  PRO   8           HD3      PRO   8  26.796   4.423   5.249
   47    H    ARG   9           H        ARG   9  30.509   2.657   5.360
   48    HA   ARG   9           HA       ARG   9  33.129   2.490   6.604
   49    HE   ARG   9           HE       ARG   9  30.790  -2.667   7.617
   50    HB2  ARG   9           HB2      ARG   9  31.807   0.771   4.502
   51    HB3  ARG   9           HB3      ARG   9  33.297   0.386   5.366
   52    HG2  ARG   9           HG2      ARG   9  32.110   0.170   7.441
   53    HG3  ARG   9           HG3      ARG   9  30.616   0.744   6.693
   54    HD2  ARG   9           HD2      ARG   9  30.645  -1.214   5.191
   55    HD3  ARG   9           HD3      ARG   9  32.105  -1.790   5.994
   56   HH11  ARG   9          HH11      ARG   9  28.971  -0.143   6.007
   57   HH12  ARG   9          HH12      ARG   9  27.511  -0.455   6.906
   58   HH21  ARG   9          HH21      ARG   9  28.884  -3.070   8.795
   59   HH22  ARG   9          HH22      ARG   9  27.476  -2.095   8.504
   60    H    LEU  10           H        LEU  10  31.749   3.428   3.521
   61    HA   LEU  10           HA       LEU  10  34.347   3.423   2.232
   62    HG   LEU  10           HG       LEU  10  32.044   1.515   1.720
   63    HB2  LEU  10           HB2      LEU  10  31.567   3.891   1.155
   64    HB3  LEU  10           HB3      LEU  10  33.025   3.919   0.180
   65   HD11  LEU  10          HD11      LEU  10  30.540   2.116  -0.118
   66   HD12  LEU  10          HD12      LEU  10  31.397   0.605  -0.422
   67   HD13  LEU  10          HD13      LEU  10  31.906   2.087  -1.232
   68   HD21  LEU  10          HD21      LEU  10  34.283   1.108   1.499
   69   HD22  LEU  10          HD22      LEU  10  34.431   2.087   0.039
   70   HD23  LEU  10          HD23      LEU  10  33.701   0.484  -0.046
   71    H    ILE  11           H        ILE  11  31.954   5.576   3.502
   72    HA   ILE  11           HA       ILE  11  32.836   7.975   2.281
   73    HB   ILE  11           HB       ILE  11  31.544   7.561   4.992
   74   HG12  ILE  11          HG12      ILE  11  30.345   8.273   2.309
   75   HG13  ILE  11          HG13      ILE  11  30.169   6.732   3.144
   76   HG21  ILE  11          HG21      ILE  11  31.461   9.771   5.315
   77   HG22  ILE  11          HG22      ILE  11  31.098  10.099   3.621
   78   HG23  ILE  11          HG23      ILE  11  32.767   9.845   4.132
   79   HD11  ILE  11          HD11      ILE  11  28.936   7.804   4.922
   80   HD12  ILE  11          HD12      ILE  11  28.191   8.156   3.362
   81   HD13  ILE  11          HD13      ILE  11  29.176   9.379   4.166
   82    H    GLU  12           H        GLU  12  34.053   5.946   4.771
   83    HA   GLU  12           HA       GLU  12  36.125   7.929   5.399
   84    HB2  GLU  12           HB2      GLU  12  36.884   6.184   7.101
   85    HB3  GLU  12           HB3      GLU  12  35.401   7.060   7.437
   86    HG2  GLU  12           HG2      GLU  12  34.065   5.183   6.861
   87    HG3  GLU  12           HG3      GLU  12  35.456   4.326   6.194
   88    H    SER  13           H        SER  13  35.935   4.448   4.647
   89    HA   SER  13           HA       SER  13  38.720   4.347   4.158
   90    HG   SER  13           HG       SER  13  37.112   1.559   5.716
   91    HB2  SER  13           HB2      SER  13  36.615   2.243   3.650
   92    HB3  SER  13           HB3      SER  13  38.356   1.971   3.737
   93    H    LEU  14           H        LEU  14  36.007   4.691   1.920
   94    HA   LEU  14           HA       LEU  14  37.776   3.997  -0.308
   95    HG   LEU  14           HG       LEU  14  36.097   5.000  -2.575
   96    HB2  LEU  14           HB2      LEU  14  35.377   3.219  -0.245
   97    HB3  LEU  14           HB3      LEU  14  34.893   4.898  -0.391
   98   HD11  LEU  14          HD11      LEU  14  37.558   2.982  -1.964
   99   HD12  LEU  14          HD12      LEU  14  36.963   3.106  -3.619
  100   HD13  LEU  14          HD13      LEU  14  36.185   2.005  -2.482
  101   HD21  LEU  14          HD21      LEU  14  33.633   4.506  -2.290
  102   HD22  LEU  14          HD22      LEU  14  34.040   2.808  -2.543
  103   HD23  LEU  14          HD23      LEU  14  34.359   3.992  -3.812
  104    H    SER  15           H        SER  15  35.987   6.623   1.118
  105    HA   SER  15           HA       SER  15  36.557   8.526  -0.840
  106    HG   SER  15           HG       SER  15  34.901  10.784   0.390
  107    HB2  SER  15           HB2      SER  15  34.755   8.754   0.831
  108    HB3  SER  15           HB3      SER  15  35.971   9.005   2.083
  109    H    GLN  16           H        GLN  16  38.509   7.351   1.811
  110    HA   GLN  16           HA       GLN  16  40.250   9.618   1.863
  111    HB2  GLN  16           HB2      GLN  16  41.687   8.319   3.330
  112    HB3  GLN  16           HB3      GLN  16  40.012   8.198   3.840
  113    HG2  GLN  16           HG2      GLN  16  40.674   6.040   4.087
  114    HG3  GLN  16           HG3      GLN  16  40.077   5.986   2.431
  115   HE21  GLN  16          HE21      GLN  16  41.318   4.621   1.368
  116   HE22  GLN  16          HE22      GLN  16  43.047   4.609   1.366
  117    H    MET  17           H        MET  17  40.112   6.714  -0.037
  118    HA   MET  17           HA       MET  17  42.798   7.218  -1.071
  119    HB2  MET  17           HB2      MET  17  42.439   5.135  -2.396
  120    HB3  MET  17           HB3      MET  17  42.359   4.896  -0.659
  121    HG2  MET  17           HG2      MET  17  39.962   4.769  -0.737
  122    HG3  MET  17           HG3      MET  17  39.958   5.187  -2.449
  123    HE1  MET  17           HE1      MET  17  41.626   2.041  -4.059
  124    HE2  MET  17           HE2      MET  17  42.411   3.537  -3.550
  125    HE3  MET  17           HE3      MET  17  40.851   3.596  -4.368
  126    H    LEU  18           H        LEU  18  39.438   7.577  -1.897
  127    HA   LEU  18           HA       LEU  18  39.778   7.953  -4.689
  128    HG   LEU  18           HG       LEU  18  37.399   7.677  -5.652
  129    HB2  LEU  18           HB2      LEU  18  37.644   8.319  -2.715
  130    HB3  LEU  18           HB3      LEU  18  37.575   9.456  -4.047
  131   HD11  LEU  18          HD11      LEU  18  37.204   5.491  -3.709
  132   HD12  LEU  18          HD12      LEU  18  38.824   6.148  -3.935
  133   HD13  LEU  18          HD13      LEU  18  37.925   5.523  -5.317
  134   HD21  LEU  18          HD21      LEU  18  35.575   7.054  -3.342
  135   HD22  LEU  18          HD22      LEU  18  35.272   6.747  -5.051
  136   HD23  LEU  18          HD23      LEU  18  35.357   8.406  -4.455
  137    H    SER  19           H        SER  19  39.975  10.132  -1.933
  138    HA   SER  19           HA       SER  19  40.242  12.443  -3.662
  139    HG   SER  19           HG       SER  19  39.556  11.410  -0.154
  140    HB2  SER  19           HB2      SER  19  40.559  13.653  -1.462
  141    HB3  SER  19           HB3      SER  19  39.014  12.822  -1.655
  142    H    MET  20           H        MET  20  42.313  10.265  -1.897
  143    HA   MET  20           HA       MET  20  44.573  12.032  -1.917
  144    HB2  MET  20           HB2      MET  20  44.208  10.323  -0.155
  145    HB3  MET  20           HB3      MET  20  44.486   9.065  -1.350
  146    HG2  MET  20           HG2      MET  20  46.451   9.471   0.039
  147    HG3  MET  20           HG3      MET  20  46.761   9.810  -1.662
  148    HE1  MET  20           HE1      MET  20  44.800  12.185   0.902
  149    HE2  MET  20           HE2      MET  20  46.186  13.021   1.605
  150    HE3  MET  20           HE3      MET  20  45.993  11.284   1.839
  151    H    GLY  21           H        GLY  21  43.428   9.408  -3.969
  152    HA2  GLY  21           HA2      GLY  21  44.097   9.413  -6.294
  153    HA3  GLY  21           HA3      GLY  21  45.665  10.036  -5.788
  154    H    PHE  22           H        PHE  22  43.711   7.301  -4.628
  155    HA   PHE  22           HA       PHE  22  45.999   5.537  -5.180
  156    HD1  PHE  22           HD2      PHE  22  47.036   6.505  -3.864
  157    HD2  PHE  22           HD1      PHE  22  44.593   4.849  -0.800
  158    HE1  PHE  22           HE2      PHE  22  48.591   7.363  -2.162
  159    HE2  PHE  22           HE1      PHE  22  46.142   5.703   0.906
  160    HZ   PHE  22           HZ       PHE  22  48.144   6.956   0.224
  161    HB2  PHE  22           HB2      PHE  22  43.753   5.302  -3.160
  162    HB3  PHE  22           HB3      PHE  22  44.885   4.000  -3.517
  163    H    SER  23           H        SER  23  45.196   3.237  -5.724
  164    HA   SER  23           HA       SER  23  42.616   3.301  -7.039
  165    HG   SER  23           HG       SER  23  44.604   4.409  -9.810
  166    HB2  SER  23           HB2      SER  23  45.139   2.547  -8.549
  167    HB3  SER  23           HB3      SER  23  43.495   2.514  -9.184
  168    H    ASP  24           H        ASP  24  42.430   1.025  -8.253
  169    HA   ASP  24           HA       ASP  24  42.856  -1.057  -6.270
  170    HB2  ASP  24           HB2      ASP  24  40.831  -0.788  -7.895
  171    HB3  ASP  24           HB3      ASP  24  41.912  -1.476  -9.106
  172    H    GLU  25           H        GLU  25  44.570  -2.501  -6.326
  173    HA   GLU  25           HA       GLU  25  46.669  -1.968  -8.225
  174    HB2  GLU  25           HB2      GLU  25  47.056  -2.632  -5.808
  175    HB3  GLU  25           HB3      GLU  25  46.563  -4.260  -6.256
  176    HG2  GLU  25           HG2      GLU  25  48.406  -4.184  -7.987
  177    HG3  GLU  25           HG3      GLU  25  48.973  -2.732  -7.166
  178    H    GLY  26           H        GLY  26  43.952  -3.958  -8.139
  179    HA2  GLY  26           HA2      GLY  26  44.597  -5.025 -10.735
  180    HA3  GLY  26           HA3      GLY  26  44.507  -6.262  -9.484
  181    H    GLY  27           H        GLY  27  42.514  -6.439  -8.264
  182    HA2  GLY  27           HA2      GLY  27  40.183  -5.009  -9.128
  183    HA3  GLY  27           HA3      GLY  27  40.183  -6.676  -9.698
  184    H    TRP  28           H        TRP  28  41.640  -5.619  -6.727
  185    HA   TRP  28           HA       TRP  28  39.928  -7.472  -5.268
  186    HD1  TRP  28           HD1      TRP  28  44.032  -6.496  -6.317
  187    HE1  TRP  28           HE1      TRP  28  45.297  -4.302  -5.920
  188    HE3  TRP  28           HE3      TRP  28  41.430  -4.737  -2.287
  189    HZ2  TRP  28           HZ2      TRP  28  45.209  -2.102  -4.163
  190    HZ3  TRP  28           HZ3      TRP  28  42.078  -2.578  -1.313
  191    HH2  TRP  28           HH2      TRP  28  43.930  -1.295  -2.232
  192    HB2  TRP  28           HB2      TRP  28  41.652  -7.103  -3.440
  193    HB3  TRP  28           HB3      TRP  28  42.264  -7.843  -4.924
  194    H    LEU  29           H        LEU  29  40.288  -4.085  -5.668
  195    HA   LEU  29           HA       LEU  29  40.207  -3.124  -3.177
  196    HG   LEU  29           HG       LEU  29  38.111  -0.797  -3.390
  197    HB2  LEU  29           HB2      LEU  29  40.449  -1.680  -5.082
  198    HB3  LEU  29           HB3      LEU  29  38.772  -1.906  -5.523
  199   HD11  LEU  29          HD11      LEU  29  41.021  -0.862  -3.024
  200   HD12  LEU  29          HD12      LEU  29  39.725  -0.796  -1.831
  201   HD13  LEU  29          HD13      LEU  29  40.253   0.679  -2.643
  202   HD21  LEU  29          HD21      LEU  29  37.920   0.954  -4.731
  203   HD22  LEU  29          HD22      LEU  29  39.229   0.357  -5.751
  204   HD23  LEU  29          HD23      LEU  29  39.590   1.386  -4.366
  205    H    THR  30           H        THR  30  37.169  -3.918  -4.929
  206    HA   THR  30           HA       THR  30  35.603  -3.265  -2.603
  207    HB   THR  30           HB       THR  30  33.718  -4.316  -3.890
  208    HG1  THR  30           HG1      THR  30  35.437  -5.615  -5.151
  209   HG21  THR  30          HG21      THR  30  34.414  -2.654  -6.009
  210   HG22  THR  30          HG22      THR  30  35.193  -1.951  -4.592
  211   HG23  THR  30          HG23      THR  30  33.453  -2.236  -4.591
  212    H    ARG  31           H        ARG  31  37.510  -5.895  -3.413
  213    HA   ARG  31           HA       ARG  31  35.927  -7.831  -1.909
  214    HE   ARG  31           HE       ARG  31  39.980 -11.522  -2.167
  215    HB2  ARG  31           HB2      ARG  31  36.730  -8.910  -3.770
  216    HB3  ARG  31           HB3      ARG  31  38.215  -7.973  -3.809
  217    HG2  ARG  31           HG2      ARG  31  39.194  -9.297  -2.104
  218    HG3  ARG  31           HG3      ARG  31  37.656 -10.100  -1.759
  219    HD2  ARG  31           HD2      ARG  31  37.697 -11.245  -3.843
  220    HD3  ARG  31           HD3      ARG  31  39.038 -10.261  -4.431
  221   HH11  ARG  31          HH11      ARG  31  38.627 -12.544  -5.233
  222   HH12  ARG  31          HH12      ARG  31  39.590 -13.991  -5.308
  223   HH21  ARG  31          HH21      ARG  31  41.230 -13.412  -2.271
  224   HH22  ARG  31          HH22      ARG  31  41.072 -14.478  -3.636
  225    H    LEU  32           H        LEU  32  39.276  -6.593  -1.879
  226    HA   LEU  32           HA       LEU  32  40.201  -7.741   0.463
  227    HG   LEU  32           HG       LEU  32  43.201  -5.520   0.052
  228    HB2  LEU  32           HB2      LEU  32  41.454  -6.389  -1.280
  229    HB3  LEU  32           HB3      LEU  32  40.835  -4.948  -0.500
  230   HD11  LEU  32          HD11      LEU  32  41.294  -5.467   2.378
  231   HD12  LEU  32          HD12      LEU  32  41.930  -4.069   1.510
  232   HD13  LEU  32          HD13      LEU  32  43.017  -5.096   2.444
  233   HD21  LEU  32          HD21      LEU  32  41.903  -7.882   1.366
  234   HD22  LEU  32          HD22      LEU  32  43.521  -7.308   1.770
  235   HD23  LEU  32          HD23      LEU  32  43.166  -7.872   0.136
  236    H    LEU  33           H        LEU  33  38.611  -4.600   0.038
  237    HA   LEU  33           HA       LEU  33  38.589  -3.860   2.750
  238    HG   LEU  33           HG       LEU  33  39.048  -2.399   0.107
  239    HB2  LEU  33           HB2      LEU  33  36.662  -3.104   0.545
  240    HB3  LEU  33           HB3      LEU  33  36.787  -2.302   2.101
  241   HD11  LEU  33          HD11      LEU  33  36.709  -0.583   0.354
  242   HD12  LEU  33          HD12      LEU  33  37.597  -1.101  -1.081
  243   HD13  LEU  33          HD13      LEU  33  38.279   0.130  -0.016
  244   HD21  LEU  33          HD21      LEU  33  38.583  -0.521   2.408
  245   HD22  LEU  33          HD22      LEU  33  40.045  -0.715   1.441
  246   HD23  LEU  33          HD23      LEU  33  39.540  -1.996   2.545
  247    H    GLN  34           H        GLN  34  36.065  -5.240   0.716
  248    HA   GLN  34           HA       GLN  34  33.896  -5.374   2.227
  249    HB2  GLN  34           HB2      GLN  34  34.070  -6.243  -0.027
  250    HB3  GLN  34           HB3      GLN  34  34.969  -7.634   0.549
  251    HG2  GLN  34           HG2      GLN  34  32.769  -8.365   0.145
  252    HG3  GLN  34           HG3      GLN  34  32.951  -8.267   1.895
  253   HE21  GLN  34          HE21      GLN  34  32.758  -5.175   0.768
  254   HE22  GLN  34          HE22      GLN  34  31.063  -4.910   0.938
  255    H    THR  35           H        THR  35  36.272  -8.052   2.355
  256    HA   THR  35           HA       THR  35  34.883  -9.452   4.343
  257    HB   THR  35           HB       THR  35  37.059 -10.707   4.604
  258    HG1  THR  35           HG1      THR  35  38.754 -10.126   3.289
  259   HG21  THR  35          HG21      THR  35  36.782 -10.572   1.696
  260   HG22  THR  35          HG22      THR  35  35.270 -10.838   2.563
  261   HG23  THR  35          HG23      THR  35  36.625 -11.943   2.794
  262    H    LYS  36           H        LYS  36  36.881  -6.702   4.613
  263    HA   LYS  36           HA       LYS  36  37.290  -7.186   7.489
  264    HB2  LYS  36           HB2      LYS  36  38.775  -5.259   5.702
  265    HB3  LYS  36           HB3      LYS  36  39.177  -5.695   7.357
  266    HG2  LYS  36           HG2      LYS  36  39.833  -7.876   6.719
  267    HG3  LYS  36           HG3      LYS  36  39.150  -7.680   5.100
  268    HD2  LYS  36           HD2      LYS  36  40.792  -5.952   4.605
  269    HD3  LYS  36           HD3      LYS  36  41.462  -6.105   6.229
  270    HE2  LYS  36           HE2      LYS  36  41.409  -8.252   4.113
  271    HE3  LYS  36           HE3      LYS  36  42.817  -7.304   4.591
  272    HZ1  LYS  36           HZ1      LYS  36  42.984  -9.345   5.711
  273    HZ2  LYS  36           HZ2      LYS  36  41.355  -9.332   6.184
  274    HZ3  LYS  36           HZ3      LYS  36  42.454  -8.240   6.889
  275    H    ASN  37           H        ASN  37  34.803  -6.039   6.295
  276    HA   ASN  37           HA       ASN  37  33.302  -4.381   6.808
  277    HB2  ASN  37           HB2      ASN  37  33.992  -4.720   9.115
  278    HB3  ASN  37           HB3      ASN  37  35.420  -3.720   8.877
  279   HD21  ASN  37          HD21      ASN  37  35.301  -1.719   9.528
  280   HD22  ASN  37          HD22      ASN  37  33.861  -0.815   9.814
  281    H    TYR  38           H        TYR  38  35.437  -4.036   4.804
  282    HA   TYR  38           HA       TYR  38  36.308  -2.492   3.385
  283    HD1  TYR  38           HD1      TYR  38  35.287  -1.848   1.293
  284    HD2  TYR  38           HD2      TYR  38  32.148  -1.229   4.089
  285    HE1  TYR  38           HE1      TYR  38  33.656  -2.611  -0.377
  286    HE2  TYR  38           HE2      TYR  38  30.510  -1.987   2.428
  287    HH   TYR  38           HH       TYR  38  30.228  -2.965   0.431
  288    HB2  TYR  38           HB2      TYR  38  34.281  -0.695   4.722
  289    HB3  TYR  38           HB3      TYR  38  35.343  -0.137   3.438
  290    H    ASP  39           H        ASP  39  38.133  -3.007   4.907
  291    HA   ASP  39           HA       ASP  39  38.820  -0.756   6.660
  292    HB2  ASP  39           HB2      ASP  39  38.836  -2.971   7.678
  293    HB3  ASP  39           HB3      ASP  39  40.009  -3.530   6.487
  294    H    ILE  40           H        ILE  40  40.503   0.553   6.327
  295    HA   ILE  40           HA       ILE  40  42.072   0.138   3.903
  296    HB   ILE  40           HB       ILE  40  43.013   2.393   4.337
  297   HG12  ILE  40          HG12      ILE  40  42.348   2.223   6.872
  298   HG13  ILE  40          HG13      ILE  40  42.343   3.782   6.054
  299   HG21  ILE  40          HG21      ILE  40  40.201   3.055   4.295
  300   HG22  ILE  40          HG22      ILE  40  40.572   1.658   3.282
  301   HG23  ILE  40          HG23      ILE  40  41.418   3.184   3.023
  302   HD11  ILE  40          HD11      ILE  40  39.774   2.553   5.783
  303   HD12  ILE  40          HD12      ILE  40  40.214   4.076   6.555
  304   HD13  ILE  40          HD13      ILE  40  40.257   2.574   7.480
  305    H    GLY  41           H        GLY  41  42.263  -0.738   7.062
  306    HA2  GLY  41           HA2      GLY  41  44.926  -0.160   7.717
  307    HA3  GLY  41           HA3      GLY  41  43.988  -1.477   8.390
  308    H    ALA  42           H        ALA  42  43.464  -2.825   6.040
  309    HA   ALA  42           HA       ALA  42  46.115  -3.872   5.353
  310    HB1  ALA  42           HB1      ALA  42  43.389  -5.107   5.382
  311    HB2  ALA  42           HB2      ALA  42  44.878  -5.673   6.141
  312    HB3  ALA  42           HB3      ALA  42  44.675  -5.798   4.392
  313    H    ALA  43           H        ALA  43  43.563  -2.024   4.139
  314    HA   ALA  43           HA       ALA  43  43.859  -2.691   1.372
  315    HB1  ALA  43           HB1      ALA  43  42.265  -1.123   0.940
  316    HB2  ALA  43           HB2      ALA  43  42.875  -0.002   2.156
  317    HB3  ALA  43           HB3      ALA  43  41.926  -1.406   2.648
  318    H    LEU  44           H        LEU  44  45.189  -0.206   3.511
  319    HA   LEU  44           HA       LEU  44  46.499   1.365   1.626
  320    HG   LEU  44           HG       LEU  44  47.017   3.452   2.916
  321    HB2  LEU  44           HB2      LEU  44  46.745   0.906   4.523
  322    HB3  LEU  44           HB3      LEU  44  48.207   1.494   3.746
  323   HD11  LEU  44          HD11      LEU  44  44.685   3.837   3.937
  324   HD12  LEU  44          HD12      LEU  44  44.641   2.082   4.116
  325   HD13  LEU  44          HD13      LEU  44  44.830   2.802   2.514
  326   HD21  LEU  44          HD21      LEU  44  46.121   3.684   5.659
  327   HD22  LEU  44          HD22      LEU  44  47.435   4.517   4.825
  328   HD23  LEU  44          HD23      LEU  44  47.714   2.934   5.547
  329    H    ASP  45           H        ASP  45  47.374  -1.706   3.012
  330    HA   ASP  45           HA       ASP  45  50.064  -1.921   2.345
  331    HB2  ASP  45           HB2      ASP  45  48.757  -3.581   3.640
  332    HB3  ASP  45           HB3      ASP  45  47.923  -4.057   2.168
  333    H    THR  46           H        THR  46  47.220  -2.649   0.321
  334    HA   THR  46           HA       THR  46  48.985  -3.119  -1.936
  335    HB   THR  46           HB       THR  46  46.782  -3.831  -3.031
  336    HG1  THR  46           HG1      THR  46  45.107  -3.322  -1.882
  337   HG21  THR  46          HG21      THR  46  48.530  -5.233  -1.441
  338   HG22  THR  46          HG22      THR  46  47.250  -5.918  -2.445
  339   HG23  THR  46          HG23      THR  46  46.956  -5.591  -0.737
  340    H    ILE  47           H        ILE  47  46.912  -0.541  -0.838
  341    HA   ILE  47           HA       ILE  47  46.674   0.556  -3.516
  342    HB   ILE  47           HB       ILE  47  45.699   2.599  -2.379
  343   HG12  ILE  47          HG12      ILE  47  45.718   0.723  -0.017
  344   HG13  ILE  47          HG13      ILE  47  46.514   2.290  -0.137
  345   HG21  ILE  47          HG21      ILE  47  43.835   0.507  -1.619
  346   HG22  ILE  47          HG22      ILE  47  44.558   0.231  -3.207
  347   HG23  ILE  47          HG23      ILE  47  43.709   1.737  -2.873
  348   HD11  ILE  47          HD11      ILE  47  44.072   1.837   0.980
  349   HD12  ILE  47          HD12      ILE  47  43.644   2.394  -0.636
  350   HD13  ILE  47          HD13      ILE  47  44.658   3.396   0.403
  351    H    GLN  48           H        GLN  48  49.252   0.159  -2.943
  352    HA   GLN  48           HA       GLN  48  51.200   1.143  -3.511
  353    HB2  GLN  48           HB2      GLN  48  49.729   3.774  -3.314
  354    HB3  GLN  48           HB3      GLN  48  51.359   3.566  -3.938
  355    HG2  GLN  48           HG2      GLN  48  50.434   3.372  -5.942
  356    HG3  GLN  48           HG3      GLN  48  49.850   1.789  -5.427
  357   HE21  GLN  48          HE21      GLN  48  47.742   1.473  -5.568
  358   HE22  GLN  48          HE22      GLN  48  46.529   2.709  -5.581
  359    H    TYR  49           H        TYR  49  50.575   0.506  -0.795
  360    HA   TYR  49           HA       TYR  49  52.773   1.990   0.361
  361    HD1  TYR  49           HD1      TYR  49  53.185   3.755   2.451
  362    HD2  TYR  49           HD2      TYR  49  49.466   4.168   0.429
  363    HE1  TYR  49           HE1      TYR  49  53.604   6.160   2.187
  364    HE2  TYR  49           HE2      TYR  49  49.872   6.573   0.162
  365    HH   TYR  49           HH       TYR  49  51.290   8.356   1.454
  366    HB2  TYR  49           HB2      TYR  49  50.001   2.125   1.452
  367    HB3  TYR  49           HB3      TYR  49  51.337   2.016   2.601
  368    H    SER  50           H        SER  50  53.106  -0.415  -0.511
  369    HA   SER  50           HA       SER  50  52.591  -2.352   1.604
  370    HG   SER  50           HG       SER  50  52.442  -4.411   0.800
  371    HB2  SER  50           HB2      SER  50  52.386  -2.811  -0.943
  372    HB3  SER  50           HB3      SER  50  54.149  -2.912  -0.913
  373    H    LYS  51           H        LYS  51  54.122  -0.520   2.685
  374    HA   LYS  51           HA       LYS  51  56.743  -1.820   2.866
  375    HB2  LYS  51           HB2      LYS  51  56.706   0.386   1.455
  376    HB3  LYS  51           HB3      LYS  51  56.519   1.183   3.010
  377    HG2  LYS  51           HG2      LYS  51  58.801  -0.663   2.319
  378    HG3  LYS  51           HG3      LYS  51  58.857   1.093   2.161
  379    HD2  LYS  51           HD2      LYS  51  58.544   1.371   4.527
  380    HD3  LYS  51           HD3      LYS  51  58.275  -0.362   4.739
  381    HE2  LYS  51           HE2      LYS  51  60.598  -0.741   3.890
  382    HE3  LYS  51           HE3      LYS  51  60.833   1.009   3.920
  383    HZ1  LYS  51           HZ1      LYS  51  61.622  -0.281   5.928
  384    HZ2  LYS  51           HZ2      LYS  51  59.984  -0.510   6.318
  385    HZ3  LYS  51           HZ3      LYS  51  60.625   1.061   6.244
  386    H    HIS  52           H        HIS  52  57.128  -2.355   4.915
  387    HA   HIS  52           HA       HIS  52  55.643  -0.918   7.002
  388    HD1  HIS  52           HD1      HIS  52  54.525  -5.377   7.749
  389    HD2  HIS  52           HD2      HIS  52  53.685  -1.691   6.008
  390    HE1  HIS  52           HE1      HIS  52  52.113  -5.480   6.989
  391    HB2  HIS  52           HB2      HIS  52  56.665  -3.762   6.910
  392    HB3  HIS  52           HB3      HIS  52  56.112  -3.003   8.396
  Start of MODEL   27
    1    H1   GLY   1           1H       GLY   1  19.599   8.199  -0.094
    2    H2   GLY   1           2H       GLY   1  19.531   8.790  -1.681
    3    H3   GLY   1           3H       GLY   1  20.916   9.048  -0.739
    4    HA2  GLY   1           HA2      GLY   1  20.294   6.277  -0.909
    5    HA3  GLY   1           HA3      GLY   1  20.486   6.991  -2.507
    6    H    SER   2           H        SER   2  22.184   5.106  -0.871
    7    HA   SER   2           HA       SER   2  24.622   6.747  -0.720
    8    HG   SER   2           HG       SER   2  24.027   6.622   1.746
    9    HB2  SER   2           HB2      SER   2  24.114   4.039   0.529
   10    HB3  SER   2           HB3      SER   2  25.489   5.103   0.830
   11    HA   PRO   3           HA       PRO   3  25.593   4.306  -4.444
   12    HB2  PRO   3           HB2      PRO   3  27.623   6.354  -4.887
   13    HB3  PRO   3           HB3      PRO   3  26.217   5.961  -5.875
   14    HG2  PRO   3           HG2      PRO   3  26.427   8.274  -4.472
   15    HG3  PRO   3           HG3      PRO   3  24.872   7.487  -4.806
   16    HD2  PRO   3           HD2      PRO   3  26.518   7.451  -2.299
   17    HD3  PRO   3           HD3      PRO   3  24.757   7.598  -2.491
   18    HA   PRO   4           HA       PRO   4  29.148   2.182  -2.873
   19    HB2  PRO   4           HB2      PRO   4  29.972   1.538  -5.611
   20    HB3  PRO   4           HB3      PRO   4  29.391   0.464  -4.338
   21    HG2  PRO   4           HG2      PRO   4  27.909   1.034  -6.516
   22    HG3  PRO   4           HG3      PRO   4  27.176   0.750  -4.924
   23    HD2  PRO   4           HD2      PRO   4  27.720   3.345  -6.329
   24    HD3  PRO   4           HD3      PRO   4  26.291   2.846  -5.395
   25    H    GLU   5           H        GLU   5  29.479   5.065  -3.808
   26    HA   GLU   5           HA       GLU   5  32.378   5.046  -3.603
   27    HB2  GLU   5           HB2      GLU   5  30.902   6.527  -5.789
   28    HB3  GLU   5           HB3      GLU   5  32.551   6.900  -5.313
   29    HG2  GLU   5           HG2      GLU   5  33.219   4.611  -5.925
   30    HG3  GLU   5           HG3      GLU   5  31.570   4.300  -6.470
   31    H    ALA   6           H        ALA   6  29.759   5.781  -2.188
   32    HA   ALA   6           HA       ALA   6  30.756   8.030  -0.745
   33    HB1  ALA   6           HB1      ALA   6  28.773   8.490  -2.892
   34    HB2  ALA   6           HB2      ALA   6  29.976   9.581  -2.204
   35    HB3  ALA   6           HB3      ALA   6  28.463   9.282  -1.346
   36    H    ASP   7           H        ASP   7  29.833   5.350  -0.362
   37    HA   ASP   7           HA       ASP   7  27.275   5.393   0.961
   38    HB2  ASP   7           HB2      ASP   7  28.191   3.364  -0.146
   39    HB3  ASP   7           HB3      ASP   7  29.537   3.363   0.983
   40    HA   PRO   8           HA       PRO   8  28.399   7.013   4.974
   41    HB2  PRO   8           HB2      PRO   8  27.466   4.367   6.010
   42    HB3  PRO   8           HB3      PRO   8  27.079   5.994   6.578
   43    HG2  PRO   8           HG2      PRO   8  25.369   4.561   5.067
   44    HG3  PRO   8           HG3      PRO   8  25.478   6.327   4.962
   45    HD2  PRO   8           HD2      PRO   8  26.334   4.281   3.021
   46    HD3  PRO   8           HD3      PRO   8  25.995   6.003   2.775
   47    H    ARG   9           H        ARG   9  29.213   3.688   4.188
   48    HA   ARG   9           HA       ARG   9  31.483   3.514   5.964
   49    HE   ARG   9           HE       ARG   9  30.590  -0.881   7.828
   50    HB2  ARG   9           HB2      ARG   9  30.575   1.807   3.640
   51    HB3  ARG   9           HB3      ARG   9  31.913   1.407   4.719
   52    HG2  ARG   9           HG2      ARG   9  29.081   1.792   5.652
   53    HG3  ARG   9           HG3      ARG   9  29.759   0.231   5.187
   54    HD2  ARG   9           HD2      ARG   9  31.642   0.909   6.900
   55    HD3  ARG   9           HD3      ARG   9  30.372   1.944   7.554
   56   HH11  ARG   9          HH11      ARG   9  28.276   1.726   7.548
   57   HH12  ARG   9          HH12      ARG   9  26.962   0.828   8.243
   58   HH21  ARG   9          HH21      ARG   9  28.876  -2.078   8.755
   59   HH22  ARG   9          HH22      ARG   9  27.316  -1.335   8.960
   60    H    LEU  10           H        LEU  10  31.055   3.521   2.446
   61    HA   LEU  10           HA       LEU  10  33.779   3.511   1.909
   62    HG   LEU  10           HG       LEU  10  31.164   1.945   1.063
   63    HB2  LEU  10           HB2      LEU  10  31.483   4.160   0.067
   64    HB3  LEU  10           HB3      LEU  10  33.105   3.714  -0.431
   65   HD11  LEU  10          HD11      LEU  10  31.561   0.593  -1.128
   66   HD12  LEU  10          HD12      LEU  10  31.975   2.173  -1.794
   67   HD13  LEU  10          HD13      LEU  10  30.379   1.902  -1.091
   68   HD21  LEU  10          HD21      LEU  10  33.983   1.455   0.134
   69   HD22  LEU  10          HD22      LEU  10  32.866   0.178   0.615
   70   HD23  LEU  10          HD23      LEU  10  33.370   1.398   1.788
   71    H    ILE  11           H        ILE  11  31.524   6.193   2.188
   72    HA   ILE  11           HA       ILE  11  33.191   8.122   0.912
   73    HB   ILE  11           HB       ILE  11  30.778   8.510   1.420
   74   HG12  ILE  11          HG12      ILE  11  32.676  10.539   2.607
   75   HG13  ILE  11          HG13      ILE  11  32.251  10.395   0.904
   76   HG21  ILE  11          HG21      ILE  11  30.058   8.015   3.463
   77   HG22  ILE  11          HG22      ILE  11  30.773   9.543   3.977
   78   HG23  ILE  11          HG23      ILE  11  31.690   8.045   4.130
   79   HD11  ILE  11          HD11      ILE  11  30.500  11.251   3.185
   80   HD12  ILE  11          HD12      ILE  11  29.865  10.829   1.594
   81   HD13  ILE  11          HD13      ILE  11  30.985  12.180   1.767
   82    H    GLU  12           H        GLU  12  33.317   6.454   3.873
   83    HA   GLU  12           HA       GLU  12  35.309   8.285   4.999
   84    HB2  GLU  12           HB2      GLU  12  33.538   7.483   6.506
   85    HB3  GLU  12           HB3      GLU  12  34.023   5.822   6.194
   86    HG2  GLU  12           HG2      GLU  12  36.227   6.315   7.177
   87    HG3  GLU  12           HG3      GLU  12  35.660   7.943   7.558
   88    H    SER  13           H        SER  13  34.933   4.790   4.474
   89    HA   SER  13           HA       SER  13  37.761   4.416   4.822
   90    HG   SER  13           HG       SER  13  37.179   1.137   5.667
   91    HB2  SER  13           HB2      SER  13  36.017   2.980   5.886
   92    HB3  SER  13           HB3      SER  13  35.621   2.350   4.288
   93    H    LEU  14           H        LEU  14  35.636   4.507   2.042
   94    HA   LEU  14           HA       LEU  14  37.652   3.166   0.397
   95    HG   LEU  14           HG       LEU  14  36.774   3.655  -2.264
   96    HB2  LEU  14           HB2      LEU  14  35.137   2.788   0.114
   97    HB3  LEU  14           HB3      LEU  14  35.069   4.418  -0.531
   98   HD11  LEU  14          HD11      LEU  14  37.696   1.667  -1.848
   99   HD12  LEU  14          HD12      LEU  14  36.190   0.986  -2.464
  100   HD13  LEU  14          HD13      LEU  14  36.414   1.205  -0.729
  101   HD21  LEU  14          HD21      LEU  14  33.914   3.048  -2.072
  102   HD22  LEU  14          HD22      LEU  14  34.785   2.098  -3.276
  103   HD23  LEU  14          HD23      LEU  14  34.823   3.860  -3.348
  104    H    SER  15           H        SER  15  35.944   6.199   0.796
  105    HA   SER  15           HA       SER  15  37.397   7.633  -1.128
  106    HG   SER  15           HG       SER  15  34.776   9.094  -1.112
  107    HB2  SER  15           HB2      SER  15  35.920   8.654   1.298
  108    HB3  SER  15           HB3      SER  15  36.487   9.654  -0.042
  109    H    GLN  16           H        GLN  16  38.236   6.547   1.991
  110    HA   GLN  16           HA       GLN  16  40.190   8.433   2.765
  111    HB2  GLN  16           HB2      GLN  16  39.355   6.526   4.182
  112    HB3  GLN  16           HB3      GLN  16  40.265   5.425   3.162
  113    HG2  GLN  16           HG2      GLN  16  41.710   7.668   4.475
  114    HG3  GLN  16           HG3      GLN  16  41.205   6.302   5.459
  115   HE21  GLN  16          HE21      GLN  16  41.695   4.971   2.537
  116   HE22  GLN  16          HE22      GLN  16  43.366   4.545   2.650
  117    H    MET  17           H        MET  17  40.235   5.632   0.640
  118    HA   MET  17           HA       MET  17  43.041   5.962   0.037
  119    HB2  MET  17           HB2      MET  17  41.349   4.102  -1.548
  120    HB3  MET  17           HB3      MET  17  42.945   3.852  -0.855
  121    HG2  MET  17           HG2      MET  17  41.687   3.885   1.414
  122    HG3  MET  17           HG3      MET  17  40.260   3.572   0.429
  123    HE1  MET  17           HE1      MET  17  44.032   2.227   0.079
  124    HE2  MET  17           HE2      MET  17  43.840   0.765   1.048
  125    HE3  MET  17           HE3      MET  17  43.607   2.351   1.787
  126    H    LEU  18           H        LEU  18  39.926   6.535  -1.501
  127    HA   LEU  18           HA       LEU  18  40.855   7.002  -4.109
  128    HG   LEU  18           HG       LEU  18  37.244   6.734  -4.579
  129    HB2  LEU  18           HB2      LEU  18  38.390   7.624  -2.602
  130    HB3  LEU  18           HB3      LEU  18  38.687   8.602  -4.025
  131   HD11  LEU  18          HD11      LEU  18  39.989   6.837  -5.723
  132   HD12  LEU  18          HD12      LEU  18  38.436   7.237  -6.460
  133   HD13  LEU  18          HD13      LEU  18  38.896   5.551  -6.236
  134   HD21  LEU  18          HD21      LEU  18  39.188   4.605  -4.324
  135   HD22  LEU  18          HD22      LEU  18  37.501   4.665  -3.812
  136   HD23  LEU  18          HD23      LEU  18  38.765   5.308  -2.762
  137    H    SER  19           H        SER  19  40.352   9.301  -1.434
  138    HA   SER  19           HA       SER  19  41.185  11.485  -3.124
  139    HG   SER  19           HG       SER  19  39.734  10.518   0.079
  140    HB2  SER  19           HB2      SER  19  40.804  12.874  -1.076
  141    HB3  SER  19           HB3      SER  19  39.401  11.933  -1.584
  142    H    MET  20           H        MET  20  42.708   9.425  -0.777
  143    HA   MET  20           HA       MET  20  44.840  11.258  -0.193
  144    HB2  MET  20           HB2      MET  20  44.115   9.520   1.415
  145    HB3  MET  20           HB3      MET  20  44.693   8.280   0.314
  146    HG2  MET  20           HG2      MET  20  46.967   9.101   0.553
  147    HG3  MET  20           HG3      MET  20  46.401  10.385   1.619
  148    HE1  MET  20           HE1      MET  20  45.264   8.498   4.789
  149    HE2  MET  20           HE2      MET  20  44.163   8.679   3.424
  150    HE3  MET  20           HE3      MET  20  45.245  10.002   3.866
  151    H    GLY  21           H        GLY  21  44.315   8.657  -2.474
  152    HA2  GLY  21           HA2      GLY  21  45.565   8.813  -4.575
  153    HA3  GLY  21           HA3      GLY  21  46.968   9.276  -3.616
  154    H    PHE  22           H        PHE  22  44.611   6.638  -3.221
  155    HA   PHE  22           HA       PHE  22  46.857   4.757  -3.400
  156    HD1  PHE  22           HD2      PHE  22  47.794   5.476  -1.976
  157    HD2  PHE  22           HD1      PHE  22  44.931   3.767   0.669
  158    HE1  PHE  22           HE2      PHE  22  49.287   5.917  -0.073
  159    HE2  PHE  22           HE1      PHE  22  46.420   4.209   2.575
  160    HZ   PHE  22           HZ       PHE  22  48.602   5.281   2.204
  161    HB2  PHE  22           HB2      PHE  22  44.365   4.690  -1.698
  162    HB3  PHE  22           HB3      PHE  22  45.279   3.227  -2.059
  163    H    SER  23           H        SER  23  46.139   2.603  -4.243
  164    HA   SER  23           HA       SER  23  43.758   2.719  -5.876
  165    HG   SER  23           HG       SER  23  46.231   4.379  -7.759
  166    HB2  SER  23           HB2      SER  23  46.516   2.408  -7.098
  167    HB3  SER  23           HB3      SER  23  45.012   2.068  -7.954
  168    H    ASP  24           H        ASP  24  43.087   0.634  -6.627
  169    HA   ASP  24           HA       ASP  24  43.902  -1.496  -4.926
  170    HB2  ASP  24           HB2      ASP  24  42.383  -2.856  -6.536
  171    HB3  ASP  24           HB3      ASP  24  41.660  -1.656  -5.474
  172    H    GLU  25           H        GLU  25  45.322  -2.995  -5.184
  173    HA   GLU  25           HA       GLU  25  47.288  -3.006  -7.136
  174    HB2  GLU  25           HB2      GLU  25  47.635  -3.989  -4.960
  175    HB3  GLU  25           HB3      GLU  25  46.358  -5.160  -5.237
  176    HG2  GLU  25           HG2      GLU  25  47.742  -6.136  -7.056
  177    HG3  GLU  25           HG3      GLU  25  49.042  -5.044  -6.577
  178    H    GLY  26           H        GLY  26  44.201  -4.604  -7.077
  179    HA2  GLY  26           HA2      GLY  26  44.665  -5.495  -9.829
  180    HA3  GLY  26           HA3      GLY  26  44.224  -6.713  -8.643
  181    H    GLY  27           H        GLY  27  42.436  -4.498  -7.376
  182    HA2  GLY  27           HA2      GLY  27  40.407  -3.409  -8.442
  183    HA3  GLY  27           HA3      GLY  27  40.203  -4.953  -9.260
  184    H    TRP  28           H        TRP  28  41.318  -4.804  -6.003
  185    HA   TRP  28           HA       TRP  28  38.973  -6.228  -5.081
  186    HD1  TRP  28           HD1      TRP  28  43.371  -6.574  -5.382
  187    HE1  TRP  28           HE1      TRP  28  45.120  -4.846  -4.625
  188    HE3  TRP  28           HE3      TRP  28  40.643  -4.120  -1.825
  189    HZ2  TRP  28           HZ2      TRP  28  45.314  -2.730  -2.782
  190    HZ3  TRP  28           HZ3      TRP  28  41.683  -2.257  -0.614
  191    HH2  TRP  28           HH2      TRP  28  43.973  -1.577  -1.083
  192    HB2  TRP  28           HB2      TRP  28  40.456  -6.543  -3.024
  193    HB3  TRP  28           HB3      TRP  28  41.031  -7.297  -4.515
  194    H    LEU  29           H        LEU  29  40.015  -3.073  -5.195
  195    HA   LEU  29           HA       LEU  29  40.066  -2.074  -2.720
  196    HG   LEU  29           HG       LEU  29  38.280   0.561  -3.090
  197    HB2  LEU  29           HB2      LEU  29  40.508  -0.725  -4.659
  198    HB3  LEU  29           HB3      LEU  29  38.822  -0.747  -5.114
  199   HD11  LEU  29          HD11      LEU  29  39.836   0.199  -1.466
  200   HD12  LEU  29          HD12      LEU  29  40.471   1.699  -2.142
  201   HD13  LEU  29          HD13      LEU  29  41.179   0.152  -2.610
  202   HD21  LEU  29          HD21      LEU  29  39.540   2.653  -3.825
  203   HD22  LEU  29          HD22      LEU  29  38.538   1.851  -5.034
  204   HD23  LEU  29          HD23      LEU  29  40.288   1.629  -5.051
  205    H    THR  30           H        THR  30  37.082  -2.970  -4.354
  206    HA   THR  30           HA       THR  30  35.528  -1.969  -2.092
  207    HB   THR  30           HB       THR  30  33.568  -2.803  -3.389
  208    HG1  THR  30           HG1      THR  30  33.833  -3.754  -5.296
  209   HG21  THR  30          HG21      THR  30  33.957  -1.281  -5.433
  210   HG22  THR  30          HG22      THR  30  35.463  -0.853  -4.621
  211   HG23  THR  30          HG23      THR  30  33.917  -0.564  -3.823
  212    H    ARG  31           H        ARG  31  36.472  -5.038  -3.596
  213    HA   ARG  31           HA       ARG  31  34.822  -6.621  -1.933
  214    HE   ARG  31           HE       ARG  31  37.269  -9.997  -1.890
  215    HB2  ARG  31           HB2      ARG  31  35.913  -8.537  -2.939
  216    HB3  ARG  31           HB3      ARG  31  35.514  -7.356  -4.162
  217    HG2  ARG  31           HG2      ARG  31  37.584  -7.964  -4.843
  218    HG3  ARG  31           HG3      ARG  31  38.025  -6.648  -3.752
  219    HD2  ARG  31           HD2      ARG  31  39.347  -8.797  -3.492
  220    HD3  ARG  31           HD3      ARG  31  38.620  -8.145  -2.022
  221   HH11  ARG  31          HH11      ARG  31  38.798  -9.925  -5.038
  222   HH12  ARG  31          HH12      ARG  31  38.172 -11.476  -5.515
  223   HH21  ARG  31          HH21      ARG  31  36.437 -12.004  -2.509
  224   HH22  ARG  31          HH22      ARG  31  36.827 -12.663  -4.069
  225    H    LEU  32           H        LEU  32  38.223  -5.701  -1.657
  226    HA   LEU  32           HA       LEU  32  38.931  -7.481   0.416
  227    HG   LEU  32           HG       LEU  32  42.215  -5.705   0.579
  228    HB2  LEU  32           HB2      LEU  32  40.513  -6.132  -0.968
  229    HB3  LEU  32           HB3      LEU  32  39.988  -4.696  -0.111
  230   HD11  LEU  32          HD11      LEU  32  42.030  -4.897   2.705
  231   HD12  LEU  32          HD12      LEU  32  40.450  -5.633   2.973
  232   HD13  LEU  32          HD13      LEU  32  40.593  -4.184   1.975
  233   HD21  LEU  32          HD21      LEU  32  40.393  -7.911   1.290
  234   HD22  LEU  32          HD22      LEU  32  41.646  -7.511   2.464
  235   HD23  LEU  32          HD23      LEU  32  42.091  -7.939   0.812
  236    H    LEU  33           H        LEU  33  37.952  -4.065   0.553
  237    HA   LEU  33           HA       LEU  33  37.779  -3.846   3.328
  238    HG   LEU  33           HG       LEU  33  38.375  -1.478   3.191
  239    HB2  LEU  33           HB2      LEU  33  36.424  -2.396   1.076
  240    HB3  LEU  33           HB3      LEU  33  35.986  -2.055   2.742
  241   HD11  LEU  33          HD11      LEU  33  39.368  -2.745   1.333
  242   HD12  LEU  33          HD12      LEU  33  39.871  -1.056   1.351
  243   HD13  LEU  33          HD13      LEU  33  38.655  -1.600   0.194
  244   HD21  LEU  33          HD21      LEU  33  37.676   0.338   1.004
  245   HD22  LEU  33          HD22      LEU  33  37.935   0.664   2.719
  246   HD23  LEU  33          HD23      LEU  33  36.380   0.043   2.163
  247    H    GLN  34           H        GLN  34  35.245  -4.630   0.967
  248    HA   GLN  34           HA       GLN  34  33.061  -4.888   2.601
  249    HB2  GLN  34           HB2      GLN  34  33.135  -5.113   0.119
  250    HB3  GLN  34           HB3      GLN  34  33.745  -6.746   0.323
  251    HG2  GLN  34           HG2      GLN  34  31.437  -6.931  -0.117
  252    HG3  GLN  34           HG3      GLN  34  31.650  -7.271   1.598
  253   HE21  GLN  34          HE21      GLN  34  32.059  -4.005   1.085
  254   HE22  GLN  34          HE22      GLN  34  30.459  -3.475   1.448
  255    H    THR  35           H        THR  35  35.530  -7.368   1.983
  256    HA   THR  35           HA       THR  35  34.266  -9.331   3.624
  257    HB   THR  35           HB       THR  35  37.177  -9.256   2.815
  258    HG1  THR  35           HG1      THR  35  35.954  -8.978   0.954
  259   HG21  THR  35          HG21      THR  35  35.648 -11.175   4.207
  260   HG22  THR  35          HG22      THR  35  37.305 -11.310   3.616
  261   HG23  THR  35          HG23      THR  35  35.961 -11.815   2.593
  262    H    LYS  36           H        LYS  36  36.786  -6.924   4.124
  263    HA   LYS  36           HA       LYS  36  37.207  -7.802   6.871
  264    HB2  LYS  36           HB2      LYS  36  38.551  -5.815   5.070
  265    HB3  LYS  36           HB3      LYS  36  38.792  -5.725   6.806
  266    HG2  LYS  36           HG2      LYS  36  40.602  -6.942   5.781
  267    HG3  LYS  36           HG3      LYS  36  39.652  -8.027   6.797
  268    HD2  LYS  36           HD2      LYS  36  38.531  -8.913   4.825
  269    HD3  LYS  36           HD3      LYS  36  39.412  -7.784   3.794
  270    HE2  LYS  36           HE2      LYS  36  40.373 -10.062   3.776
  271    HE3  LYS  36           HE3      LYS  36  41.505  -8.836   4.344
  272    HZ1  LYS  36           HZ1      LYS  36  39.902 -10.280   6.341
  273    HZ2  LYS  36           HZ2      LYS  36  41.471  -9.644   6.466
  274    HZ3  LYS  36           HZ3      LYS  36  41.210 -11.091   5.613
  275    H    ASN  37           H        ASN  37  34.606  -6.828   6.278
  276    HA   ASN  37           HA       ASN  37  33.032  -5.269   6.767
  277    HB2  ASN  37           HB2      ASN  37  32.987  -4.572   9.169
  278    HB3  ASN  37           HB3      ASN  37  33.136  -6.305   8.903
  279   HD21  ASN  37          HD21      ASN  37  34.460  -3.548  10.367
  280   HD22  ASN  37          HD22      ASN  37  35.863  -4.294  11.050
  281    H    TYR  38           H        TYR  38  34.532  -4.015   5.137
  282    HA   TYR  38           HA       TYR  38  35.230  -2.017   4.332
  283    HD1  TYR  38           HD1      TYR  38  31.905  -2.674   6.560
  284    HD2  TYR  38           HD2      TYR  38  32.761  -0.434   3.048
  285    HE1  TYR  38           HE1      TYR  38  29.816  -3.475   5.549
  286    HE2  TYR  38           HE2      TYR  38  30.669  -1.223   2.028
  287    HH   TYR  38           HH       TYR  38  28.370  -2.076   2.976
  288    HB2  TYR  38           HB2      TYR  38  33.573  -0.826   6.556
  289    HB3  TYR  38           HB3      TYR  38  34.021  -0.055   5.042
  290    H    ASP  39           H        ASP  39  37.322  -2.859   5.422
  291    HA   ASP  39           HA       ASP  39  38.218  -0.871   7.415
  292    HB2  ASP  39           HB2      ASP  39  38.086  -3.354   8.040
  293    HB3  ASP  39           HB3      ASP  39  39.485  -3.563   6.993
  294    H    ILE  40           H        ILE  40  39.961   0.318   7.033
  295    HA   ILE  40           HA       ILE  40  41.455  -0.088   4.557
  296    HB   ILE  40           HB       ILE  40  42.633   2.045   5.226
  297   HG12  ILE  40          HG12      ILE  40  41.712   1.773   7.679
  298   HG13  ILE  40          HG13      ILE  40  41.935   3.373   6.983
  299   HG21  ILE  40          HG21      ILE  40  39.669   2.123   4.727
  300   HG22  ILE  40          HG22      ILE  40  40.952   2.047   3.517
  301   HG23  ILE  40          HG23      ILE  40  40.765   3.487   4.517
  302   HD11  ILE  40          HD11      ILE  40  39.802   3.844   7.327
  303   HD12  ILE  40          HD12      ILE  40  39.606   2.272   8.102
  304   HD13  ILE  40          HD13      ILE  40  39.306   2.447   6.372
  305    H    GLY  41           H        GLY  41  41.509  -1.029   7.744
  306    HA2  GLY  41           HA2      GLY  41  44.210  -0.797   8.443
  307    HA3  GLY  41           HA3      GLY  41  43.110  -2.000   9.083
  308    H    ALA  42           H        ALA  42  42.532  -3.156   6.540
  309    HA   ALA  42           HA       ALA  42  45.050  -4.589   6.064
  310    HB1  ALA  42           HB1      ALA  42  42.450  -5.537   6.446
  311    HB2  ALA  42           HB2      ALA  42  43.858  -6.466   5.930
  312    HB3  ALA  42           HB3      ALA  42  42.780  -5.755   4.727
  313    H    ALA  43           H        ALA  43  42.787  -2.446   4.688
  314    HA   ALA  43           HA       ALA  43  43.321  -2.929   1.943
  315    HB1  ALA  43           HB1      ALA  43  42.507  -0.231   2.914
  316    HB2  ALA  43           HB2      ALA  43  41.397  -1.590   3.101
  317    HB3  ALA  43           HB3      ALA  43  41.968  -1.131   1.496
  318    H    LEU  44           H        LEU  44  44.786  -0.799   4.355
  319    HA   LEU  44           HA       LEU  44  46.439   0.618   2.523
  320    HG   LEU  44           HG       LEU  44  46.705   2.774   3.712
  321    HB2  LEU  44           HB2      LEU  44  46.279   0.349   5.472
  322    HB3  LEU  44           HB3      LEU  44  47.817   0.875   4.806
  323   HD11  LEU  44          HD11      LEU  44  44.254   1.531   4.904
  324   HD12  LEU  44          HD12      LEU  44  44.530   2.097   3.255
  325   HD13  LEU  44          HD13      LEU  44  44.330   3.262   4.565
  326   HD21  LEU  44          HD21      LEU  44  46.333   2.429   6.670
  327   HD22  LEU  44          HD22      LEU  44  45.981   3.948   5.847
  328   HD23  LEU  44          HD23      LEU  44  47.615   3.285   5.814
  329    H    ASP  45           H        ASP  45  46.602  -2.528   3.831
  330    HA   ASP  45           HA       ASP  45  49.469  -2.784   3.451
  331    HB2  ASP  45           HB2      ASP  45  48.400  -4.054   5.246
  332    HB3  ASP  45           HB3      ASP  45  47.341  -4.844   4.084
  333    H    THR  46           H        THR  46  46.504  -3.407   1.737
  334    HA   THR  46           HA       THR  46  47.855  -5.058  -0.212
  335    HB   THR  46           HB       THR  46  45.471  -5.248  -1.135
  336    HG1  THR  46           HG1      THR  46  44.438  -3.568  -0.194
  337   HG21  THR  46          HG21      THR  46  45.890  -7.165  -0.052
  338   HG22  THR  46          HG22      THR  46  44.779  -6.486   1.139
  339   HG23  THR  46          HG23      THR  46  46.523  -6.352   1.378
  340    H    ILE  47           H        ILE  47  46.778  -1.714  -0.086
  341    HA   ILE  47           HA       ILE  47  46.219  -1.487  -2.840
  342    HB   ILE  47           HB       ILE  47  46.915   1.062  -2.339
  343   HG12  ILE  47          HG12      ILE  47  46.102   1.591  -0.017
  344   HG13  ILE  47          HG13      ILE  47  46.244  -0.117   0.364
  345   HG21  ILE  47          HG21      ILE  47  44.357   0.665  -1.135
  346   HG22  ILE  47          HG22      ILE  47  44.545  -0.451  -2.487
  347   HG23  ILE  47          HG23      ILE  47  44.749   1.281  -2.740
  348   HD11  ILE  47          HD11      ILE  47  48.204   1.895   0.499
  349   HD12  ILE  47          HD12      ILE  47  48.693   0.768  -0.766
  350   HD13  ILE  47          HD13      ILE  47  48.369   0.177   0.867
  351    H    GLN  48           H        GLN  48  49.160  -1.477  -1.114
  352    HA   GLN  48           HA       GLN  48  50.832  -2.433  -2.781
  353    HB2  GLN  48           HB2      GLN  48  51.909  -0.990  -4.287
  354    HB3  GLN  48           HB3      GLN  48  50.197  -0.706  -4.517
  355    HG2  GLN  48           HG2      GLN  48  52.036   1.082  -2.943
  356    HG3  GLN  48           HG3      GLN  48  51.580   1.316  -4.627
  357   HE21  GLN  48          HE21      GLN  48  49.490   1.956  -5.134
  358   HE22  GLN  48          HE22      GLN  48  48.433   2.638  -3.941
  359    H    TYR  49           H        TYR  49  50.251  -0.462  -0.237
  360    HA   TYR  49           HA       TYR  49  53.032  -0.042   0.512
  361    HD1  TYR  49           HD2      TYR  49  52.709   1.536  -0.588
  362    HD2  TYR  49           HD1      TYR  49  50.713   3.141   2.806
  363    HE1  TYR  49           HE2      TYR  49  53.074   3.804  -1.453
  364    HE2  TYR  49           HE1      TYR  49  51.074   5.409   1.952
  365    HH   TYR  49           HH       TYR  49  52.697   5.980  -1.161
  366    HB2  TYR  49           HB2      TYR  49  50.398   0.634   1.811
  367    HB3  TYR  49           HB3      TYR  49  51.912   0.739   2.704
  368    H    SER  50           H        SER  50  52.929  -2.591   0.115
  369    HA   SER  50           HA       SER  50  51.953  -4.063   2.401
  370    HG   SER  50           HG       SER  50  50.802  -4.686   0.320
  371    HB2  SER  50           HB2      SER  50  53.610  -5.109   0.098
  372    HB3  SER  50           HB3      SER  50  52.553  -6.026   1.174
  373    H    LYS  51           H        LYS  51  54.177  -2.109   2.711
  374    HA   LYS  51           HA       LYS  51  56.020  -1.864   4.008
  375    HB2  LYS  51           HB2      LYS  51  55.001  -4.257   4.978
  376    HB3  LYS  51           HB3      LYS  51  56.638  -4.685   4.500
  377    HG2  LYS  51           HG2      LYS  51  55.851  -2.487   6.406
  378    HG3  LYS  51           HG3      LYS  51  56.568  -4.041   6.833
  379    HD2  LYS  51           HD2      LYS  51  58.590  -3.445   5.562
  380    HD3  LYS  51           HD3      LYS  51  57.868  -1.887   5.158
  381    HE2  LYS  51           HE2      LYS  51  59.430  -1.676   7.016
  382    HE3  LYS  51           HE3      LYS  51  57.783  -1.300   7.525
  383    HZ1  LYS  51           HZ1      LYS  51  59.263  -2.822   8.978
  384    HZ2  LYS  51           HZ2      LYS  51  58.828  -4.034   7.877
  385    HZ3  LYS  51           HZ3      LYS  51  57.626  -3.219   8.759
  386    H    HIS  52           H        HIS  52  56.631  -1.384   1.729
  387    HA   HIS  52           HA       HIS  52  58.094  -3.363   0.315
  388    HD1  HIS  52           HD1      HIS  52  58.230  -3.694  -2.167
  389    HD2  HIS  52           HD2      HIS  52  59.685   0.204  -2.204
  390    HE1  HIS  52           HE1      HIS  52  59.797  -3.541  -4.145
  391    HB2  HIS  52           HB2      HIS  52  56.794  -1.549  -0.810
  392    HB3  HIS  52           HB3      HIS  52  57.987  -0.392  -0.234
  Start of MODEL   28
    1    H1   GLY   1           1H       GLY   1  21.841   1.827  -4.848
    2    H2   GLY   1           2H       GLY   1  21.052   0.338  -4.677
    3    H3   GLY   1           3H       GLY   1  22.549   0.416  -5.460
    4    HA2  GLY   1           HA2      GLY   1  21.932   0.370  -2.627
    5    HA3  GLY   1           HA3      GLY   1  23.335  -0.261  -3.482
    6    H    SER   2           H        SER   2  24.022   0.880  -1.264
    7    HA   SER   2           HA       SER   2  24.226   3.676  -1.181
    8    HG   SER   2           HG       SER   2  26.245   0.932  -0.699
    9    HB2  SER   2           HB2      SER   2  26.094   3.194   0.489
   10    HB3  SER   2           HB3      SER   2  24.526   2.469   0.850
   11    HA   PRO   3           HA       PRO   3  27.250   4.409  -4.379
   12    HB2  PRO   3           HB2      PRO   3  27.683   6.933  -2.887
   13    HB3  PRO   3           HB3      PRO   3  27.240   6.687  -4.580
   14    HG2  PRO   3           HG2      PRO   3  25.446   7.568  -2.804
   15    HG3  PRO   3           HG3      PRO   3  24.988   6.445  -4.100
   16    HD2  PRO   3           HD2      PRO   3  25.472   5.901  -1.197
   17    HD3  PRO   3           HD3      PRO   3  24.243   5.220  -2.286
   18    HA   PRO   4           HA       PRO   4  30.677   3.124  -1.818
   19    HB2  PRO   4           HB2      PRO   4  31.963   2.214  -4.250
   20    HB3  PRO   4           HB3      PRO   4  31.239   1.258  -2.954
   21    HG2  PRO   4           HG2      PRO   4  30.198   1.425  -5.474
   22    HG3  PRO   4           HG3      PRO   4  29.226   1.095  -4.030
   23    HD2  PRO   4           HD2      PRO   4  29.589   3.662  -5.528
   24    HD3  PRO   4           HD3      PRO   4  28.119   2.975  -4.799
   25    H    GLU   5           H        GLU   5  30.656   5.916  -2.903
   26    HA   GLU   5           HA       GLU   5  33.567   6.227  -2.934
   27    HB2  GLU   5           HB2      GLU   5  31.677   7.523  -4.899
   28    HB3  GLU   5           HB3      GLU   5  33.316   8.092  -4.624
   29    HG2  GLU   5           HG2      GLU   5  34.183   5.913  -5.332
   30    HG3  GLU   5           HG3      GLU   5  32.534   5.366  -5.631
   31    H    ALA   6           H        ALA   6  31.114   6.693  -1.140
   32    HA   ALA   6           HA       ALA   6  32.140   8.826   0.345
   33    HB1  ALA   6           HB1      ALA   6  31.327  10.673  -0.600
   34    HB2  ALA   6           HB2      ALA   6  29.694  10.067  -0.316
   35    HB3  ALA   6           HB3      ALA   6  30.513   9.716  -1.839
   36    H    ASP   7           H        ASP   7  31.035   6.195   0.533
   37    HA   ASP   7           HA       ASP   7  28.492   6.399   1.887
   38    HB2  ASP   7           HB2      ASP   7  29.140   4.404   0.535
   39    HB3  ASP   7           HB3      ASP   7  30.448   4.087   1.668
   40    HA   PRO   8           HA       PRO   8  29.919   7.478   5.979
   41    HB2  PRO   8           HB2      PRO   8  28.429   5.016   6.794
   42    HB3  PRO   8           HB3      PRO   8  28.394   6.634   7.501
   43    HG2  PRO   8           HG2      PRO   8  26.425   5.764   5.899
   44    HG3  PRO   8           HG3      PRO   8  26.953   7.454   5.896
   45    HD2  PRO   8           HD2      PRO   8  27.365   5.351   3.860
   46    HD3  PRO   8           HD3      PRO   8  27.368   7.116   3.684
   47    H    ARG   9           H        ARG   9  30.125   4.170   4.834
   48    HA   ARG   9           HA       ARG   9  32.252   3.437   6.656
   49    HE   ARG   9           HE       ARG   9  29.010   0.761   8.439
   50    HB2  ARG   9           HB2      ARG   9  30.873   2.026   4.373
   51    HB3  ARG   9           HB3      ARG   9  32.129   1.293   5.379
   52    HG2  ARG   9           HG2      ARG   9  29.443   2.275   6.337
   53    HG3  ARG   9           HG3      ARG   9  29.925   0.588   6.115
   54    HD2  ARG   9           HD2      ARG   9  31.705   0.906   7.789
   55    HD3  ARG   9           HD3      ARG   9  31.152   2.559   8.046
   56   HH11  ARG   9          HH11      ARG   9  31.969   1.886   9.910
   57   HH12  ARG   9          HH12      ARG   9  31.501   1.430  11.520
   58   HH21  ARG   9          HH21      ARG   9  28.360   0.185  10.546
   59   HH22  ARG   9          HH22      ARG   9  29.427   0.478  11.884
   60    H    LEU  10           H        LEU  10  31.798   3.692   3.127
   61    HA   LEU  10           HA       LEU  10  34.534   3.142   2.645
   62    HG   LEU  10           HG       LEU  10  32.014   1.683   1.768
   63    HB2  LEU  10           HB2      LEU  10  32.294   3.929   0.791
   64    HB3  LEU  10           HB3      LEU  10  33.907   3.490   0.251
   65   HD11  LEU  10          HD11      LEU  10  32.496   0.488  -0.607
   66   HD12  LEU  10          HD12      LEU  10  32.477   2.186  -1.084
   67   HD13  LEU  10          HD13      LEU  10  31.084   1.484  -0.258
   68   HD21  LEU  10          HD21      LEU  10  34.768   1.216   0.636
   69   HD22  LEU  10          HD22      LEU  10  33.685  -0.064   1.182
   70   HD23  LEU  10          HD23      LEU  10  34.280   1.137   2.329
   71    H    ILE  11           H        ILE  11  32.888   6.054   3.279
   72    HA   ILE  11           HA       ILE  11  34.511   7.789   1.704
   73    HB   ILE  11           HB       ILE  11  32.346   8.480   2.750
   74   HG12  ILE  11          HG12      ILE  11  34.737  10.177   3.494
   75   HG13  ILE  11          HG13      ILE  11  33.963  10.137   1.914
   76   HG21  ILE  11          HG21      ILE  11  33.954   8.225   5.259
   77   HG22  ILE  11          HG22      ILE  11  32.332   7.629   4.909
   78   HG23  ILE  11          HG23      ILE  11  32.605   9.355   5.157
   79   HD11  ILE  11          HD11      ILE  11  32.859  11.918   2.686
   80   HD12  ILE  11          HD12      ILE  11  33.163  11.502   4.373
   81   HD13  ILE  11          HD13      ILE  11  31.851  10.716   3.493
   82    H    GLU  12           H        GLU  12  34.931   6.031   4.612
   83    HA   GLU  12           HA       GLU  12  37.434   7.418   5.269
   84    HB2  GLU  12           HB2      GLU  12  36.025   5.153   6.699
   85    HB3  GLU  12           HB3      GLU  12  37.471   5.976   7.264
   86    HG2  GLU  12           HG2      GLU  12  36.205   8.065   7.444
   87    HG3  GLU  12           HG3      GLU  12  34.756   7.219   6.902
   88    H    SER  13           H        SER  13  36.173   4.479   3.914
   89    HA   SER  13           HA       SER  13  38.721   3.124   4.123
   90    HG   SER  13           HG       SER  13  35.734   2.565   5.140
   91    HB2  SER  13           HB2      SER  13  36.107   2.096   3.008
   92    HB3  SER  13           HB3      SER  13  37.515   1.133   3.460
   93    H    LEU  14           H        LEU  14  36.454   3.821   1.439
   94    HA   LEU  14           HA       LEU  14  38.512   3.090  -0.473
   95    HG   LEU  14           HG       LEU  14  37.668   2.651  -2.753
   96    HB2  LEU  14           HB2      LEU  14  36.161   2.221  -0.636
   97    HB3  LEU  14           HB3      LEU  14  35.621   3.860  -0.932
   98   HD11  LEU  14          HD11      LEU  14  34.728   2.277  -3.218
   99   HD12  LEU  14          HD12      LEU  14  35.687   1.063  -2.372
  100   HD13  LEU  14          HD13      LEU  14  36.087   1.504  -4.032
  101   HD21  LEU  14          HD21      LEU  14  36.927   4.218  -4.284
  102   HD22  LEU  14          HD22      LEU  14  36.761   5.096  -2.765
  103   HD23  LEU  14          HD23      LEU  14  35.343   4.370  -3.525
  104    H    SER  15           H        SER  15  36.361   5.758   0.357
  105    HA   SER  15           HA       SER  15  37.267   7.510  -1.601
  106    HG   SER  15           HG       SER  15  34.474   8.169  -1.112
  107    HB2  SER  15           HB2      SER  15  36.141   8.299   1.083
  108    HB3  SER  15           HB3      SER  15  36.132   9.263  -0.394
  109    H    GLN  16           H        GLN  16  38.622   6.614   1.436
  110    HA   GLN  16           HA       GLN  16  40.369   8.804   1.848
  111    HB2  GLN  16           HB2      GLN  16  40.025   7.226   3.639
  112    HB3  GLN  16           HB3      GLN  16  40.558   5.888   2.635
  113    HG2  GLN  16           HG2      GLN  16  42.498   8.072   3.076
  114    HG3  GLN  16           HG3      GLN  16  42.109   7.057   4.461
  115   HE21  GLN  16          HE21      GLN  16  44.083   7.387   1.800
  116   HE22  GLN  16          HE22      GLN  16  44.659   5.761   1.678
  117    H    MET  17           H        MET  17  40.725   5.723   0.163
  118    HA   MET  17           HA       MET  17  43.386   6.297  -0.708
  119    HB2  MET  17           HB2      MET  17  41.504   4.186  -1.764
  120    HB3  MET  17           HB3      MET  17  43.263   4.186  -1.852
  121    HG2  MET  17           HG2      MET  17  43.434   3.912   0.526
  122    HG3  MET  17           HG3      MET  17  41.692   4.088   0.713
  123    HE1  MET  17           HE1      MET  17  42.002   0.380   1.648
  124    HE2  MET  17           HE2      MET  17  41.334   1.961   2.057
  125    HE3  MET  17           HE3      MET  17  43.078   1.702   2.101
  126    H    LEU  18           H        LEU  18  40.172   6.387  -2.178
  127    HA   LEU  18           HA       LEU  18  41.033   6.828  -4.822
  128    HG   LEU  18           HG       LEU  18  38.699   8.636  -5.815
  129    HB2  LEU  18           HB2      LEU  18  38.749   6.116  -4.145
  130    HB3  LEU  18           HB3      LEU  18  38.455   7.740  -3.545
  131   HD11  LEU  18          HD11      LEU  18  38.481   6.223  -7.316
  132   HD12  LEU  18          HD12      LEU  18  39.928   6.144  -6.313
  133   HD13  LEU  18          HD13      LEU  18  39.702   7.491  -7.428
  134   HD21  LEU  18          HD21      LEU  18  36.777   6.551  -6.423
  135   HD22  LEU  18          HD22      LEU  18  36.531   8.280  -6.176
  136   HD23  LEU  18          HD23      LEU  18  36.581   7.189  -4.790
  137    H    SER  19           H        SER  19  40.363   9.082  -2.181
  138    HA   SER  19           HA       SER  19  40.744  11.369  -3.918
  139    HG   SER  19           HG       SER  19  40.795  13.494  -1.831
  140    HB2  SER  19           HB2      SER  19  39.146  11.196  -1.874
  141    HB3  SER  19           HB3      SER  19  40.591  11.506  -0.914
  142    H    MET  20           H        MET  20  42.675   9.391  -1.842
  143    HA   MET  20           HA       MET  20  44.718  11.353  -1.351
  144    HB2  MET  20           HB2      MET  20  44.252   9.396   0.150
  145    HB3  MET  20           HB3      MET  20  44.910   8.344  -1.095
  146    HG2  MET  20           HG2      MET  20  46.559   8.754   0.614
  147    HG3  MET  20           HG3      MET  20  47.070   9.485  -0.909
  148    HE1  MET  20           HE1      MET  20  48.328  10.530   2.169
  149    HE2  MET  20           HE2      MET  20  48.634  12.061   1.349
  150    HE3  MET  20           HE3      MET  20  48.827  10.538   0.479
  151    H    GLY  21           H        GLY  21  44.136   8.855  -3.740
  152    HA2  GLY  21           HA2      GLY  21  45.162   9.228  -5.951
  153    HA3  GLY  21           HA3      GLY  21  46.635   9.674  -5.090
  154    H    PHE  22           H        PHE  22  44.532   7.002  -4.235
  155    HA   PHE  22           HA       PHE  22  46.644   5.136  -5.060
  156    HD1  PHE  22           HD2      PHE  22  47.837   5.964  -3.835
  157    HD2  PHE  22           HD1      PHE  22  45.772   3.970  -0.694
  158    HE1  PHE  22           HE2      PHE  22  49.708   6.435  -2.311
  159    HE2  PHE  22           HE1      PHE  22  47.640   4.439   0.832
  160    HZ   PHE  22           HZ       PHE  22  49.610   5.667   0.025
  161    HB2  PHE  22           HB2      PHE  22  44.620   4.975  -2.820
  162    HB3  PHE  22           HB3      PHE  22  45.479   3.557  -3.421
  163    H    SER  23           H        SER  23  45.337   2.838  -5.285
  164    HA   SER  23           HA       SER  23  42.811   3.290  -6.609
  165    HG   SER  23           HG       SER  23  44.310   4.102  -9.463
  166    HB2  SER  23           HB2      SER  23  45.117   2.054  -8.148
  167    HB3  SER  23           HB3      SER  23  43.475   2.300  -8.740
  168    H    ASP  24           H        ASP  24  42.239   0.961  -7.704
  169    HA   ASP  24           HA       ASP  24  42.679  -0.997  -5.566
  170    HB2  ASP  24           HB2      ASP  24  40.814  -2.240  -6.471
  171    HB3  ASP  24           HB3      ASP  24  40.322  -0.556  -6.308
  172    H    GLU  25           H        GLU  25  43.610  -2.996  -5.987
  173    HA   GLU  25           HA       GLU  25  45.028  -3.126  -8.566
  174    HB2  GLU  25           HB2      GLU  25  46.363  -3.034  -6.383
  175    HB3  GLU  25           HB3      GLU  25  45.780  -4.666  -6.080
  176    HG2  GLU  25           HG2      GLU  25  46.826  -5.446  -8.123
  177    HG3  GLU  25           HG3      GLU  25  47.385  -3.812  -8.477
  178    H    GLY  26           H        GLY  26  42.609  -3.897  -8.996
  179    HA2  GLY  26           HA2      GLY  26  42.425  -6.194 -10.204
  180    HA3  GLY  26           HA3      GLY  26  42.424  -6.801  -8.554
  181    H    GLY  27           H        GLY  27  40.861  -4.468  -7.603
  182    HA2  GLY  27           HA2      GLY  27  38.589  -3.633  -8.196
  183    HA3  GLY  27           HA3      GLY  27  38.251  -5.277  -8.731
  184    H    TRP  28           H        TRP  28  40.250  -5.038  -6.034
  185    HA   TRP  28           HA       TRP  28  38.255  -6.267  -4.371
  186    HD1  TRP  28           HD1      TRP  28  42.452  -6.318  -5.724
  187    HE1  TRP  28           HE1      TRP  28  44.255  -4.522  -5.350
  188    HE3  TRP  28           HE3      TRP  28  40.527  -4.104  -1.551
  189    HZ2  TRP  28           HZ2      TRP  28  44.769  -2.415  -3.532
  190    HZ3  TRP  28           HZ3      TRP  28  41.726  -2.211  -0.553
  191    HH2  TRP  28           HH2      TRP  28  43.799  -1.392  -1.520
  192    HB2  TRP  28           HB2      TRP  28  40.160  -6.431  -2.732
  193    HB3  TRP  28           HB3      TRP  28  40.460  -7.213  -4.287
  194    H    LEU  29           H        LEU  29  39.276  -3.063  -4.917
  195    HA   LEU  29           HA       LEU  29  39.160  -2.133  -2.259
  196    HG   LEU  29           HG       LEU  29  38.058   0.798  -2.865
  197    HB2  LEU  29           HB2      LEU  29  40.243  -0.892  -4.086
  198    HB3  LEU  29           HB3      LEU  29  38.678  -0.561  -4.791
  199   HD11  LEU  29          HD11      LEU  29  40.028   1.321  -1.261
  200   HD12  LEU  29          HD12      LEU  29  40.645  -0.245  -1.787
  201   HD13  LEU  29          HD13      LEU  29  39.069  -0.136  -1.005
  202   HD21  LEU  29          HD21      LEU  29  39.355   2.651  -3.383
  203   HD22  LEU  29          HD22      LEU  29  39.530   1.646  -4.819
  204   HD23  LEU  29          HD23      LEU  29  40.816   1.691  -3.614
  205    H    THR  30           H        THR  30  36.747  -3.092  -4.430
  206    HA   THR  30           HA       THR  30  34.646  -2.010  -2.690
  207    HB   THR  30           HB       THR  30  33.923  -1.625  -4.858
  208    HG1  THR  30           HG1      THR  30  32.846  -4.181  -4.867
  209   HG21  THR  30          HG21      THR  30  35.679  -2.804  -6.061
  210   HG22  THR  30          HG22      THR  30  34.083  -3.140  -6.729
  211   HG23  THR  30          HG23      THR  30  34.884  -4.341  -5.717
  212    H    ARG  31           H        ARG  31  36.256  -4.927  -3.721
  213    HA   ARG  31           HA       ARG  31  34.369  -6.690  -2.441
  214    HE   ARG  31           HE       ARG  31  36.083 -11.847  -3.943
  215    HB2  ARG  31           HB2      ARG  31  35.216  -7.495  -4.465
  216    HB3  ARG  31           HB3      ARG  31  36.863  -7.035  -4.073
  217    HG2  ARG  31           HG2      ARG  31  37.159  -8.873  -2.661
  218    HG3  ARG  31           HG3      ARG  31  35.426  -9.213  -2.591
  219    HD2  ARG  31           HD2      ARG  31  35.430  -9.877  -4.917
  220    HD3  ARG  31           HD3      ARG  31  37.126  -9.415  -5.079
  221   HH11  ARG  31          HH11      ARG  31  38.839  -9.714  -4.208
  222   HH12  ARG  31          HH12      ARG  31  39.963 -10.869  -3.562
  223   HH21  ARG  31          HH21      ARG  31  37.551 -13.383  -3.103
  224   HH22  ARG  31          HH22      ARG  31  39.233 -12.964  -2.932
  225    H    LEU  32           H        LEU  32  37.911  -6.441  -2.093
  226    HA   LEU  32           HA       LEU  32  38.416  -7.907   0.128
  227    HG   LEU  32           HG       LEU  32  41.792  -6.221   0.211
  228    HB2  LEU  32           HB2      LEU  32  40.041  -6.644  -1.310
  229    HB3  LEU  32           HB3      LEU  32  39.613  -5.188  -0.442
  230   HD11  LEU  32          HD11      LEU  32  41.420  -6.068   2.666
  231   HD12  LEU  32          HD12      LEU  32  39.694  -5.914   2.339
  232   HD13  LEU  32          HD13      LEU  32  40.818  -4.693   1.740
  233   HD21  LEU  32          HD21      LEU  32  41.821  -8.194   1.587
  234   HD22  LEU  32          HD22      LEU  32  41.106  -8.556   0.015
  235   HD23  LEU  32          HD23      LEU  32  40.072  -8.361   1.433
  236    H    LEU  33           H        LEU  33  37.788  -4.410   0.250
  237    HA   LEU  33           HA       LEU  33  37.846  -3.990   2.923
  238    HG   LEU  33           HG       LEU  33  38.317  -2.196   0.439
  239    HB2  LEU  33           HB2      LEU  33  35.984  -2.731   0.913
  240    HB3  LEU  33           HB3      LEU  33  36.165  -2.151   2.561
  241   HD11  LEU  33          HD11      LEU  33  37.090  -0.370  -0.139
  242   HD12  LEU  33          HD12      LEU  33  38.103   0.351   1.114
  243   HD13  LEU  33          HD13      LEU  33  36.452  -0.141   1.491
  244   HD21  LEU  33          HD21      LEU  33  38.369  -1.638   3.367
  245   HD22  LEU  33          HD22      LEU  33  39.415  -0.715   2.289
  246   HD23  LEU  33          HD23      LEU  33  39.551  -2.471   2.356
  247    H    GLN  34           H        GLN  34  34.736  -4.311   1.268
  248    HA   GLN  34           HA       GLN  34  33.192  -4.400   3.523
  249    HB2  GLN  34           HB2      GLN  34  32.464  -5.804   0.965
  250    HB3  GLN  34           HB3      GLN  34  31.381  -5.025   2.115
  251    HG2  GLN  34           HG2      GLN  34  32.935  -2.939   1.487
  252    HG3  GLN  34           HG3      GLN  34  33.059  -3.860  -0.012
  253   HE21  GLN  34          HE21      GLN  34  31.270  -1.718   1.781
  254   HE22  GLN  34          HE22      GLN  34  29.828  -1.701   0.825
  255    H    THR  35           H        THR  35  34.897  -7.059   2.067
  256    HA   THR  35           HA       THR  35  33.426  -9.132   3.365
  257    HB   THR  35           HB       THR  35  36.267  -9.245   2.334
  258    HG1  THR  35           HG1      THR  35  35.023  -8.484   0.657
  259   HG21  THR  35          HG21      THR  35  34.766 -11.223   3.549
  260   HG22  THR  35          HG22      THR  35  36.187 -11.454   2.528
  261   HG23  THR  35          HG23      THR  35  34.573 -11.534   1.823
  262    H    LYS  36           H        LYS  36  35.919  -6.965   4.354
  263    HA   LYS  36           HA       LYS  36  36.377  -8.575   6.782
  264    HB2  LYS  36           HB2      LYS  36  38.311  -6.595   5.586
  265    HB3  LYS  36           HB3      LYS  36  38.623  -7.769   6.859
  266    HG2  LYS  36           HG2      LYS  36  38.219  -9.581   5.206
  267    HG3  LYS  36           HG3      LYS  36  38.089  -8.340   3.954
  268    HD2  LYS  36           HD2      LYS  36  40.320  -9.181   3.897
  269    HD3  LYS  36           HD3      LYS  36  40.378  -7.565   4.605
  270    HE2  LYS  36           HE2      LYS  36  41.779  -9.315   5.765
  271    HE3  LYS  36           HE3      LYS  36  40.655  -8.428   6.795
  272    HZ1  LYS  36           HZ1      LYS  36  39.312 -10.249   7.064
  273    HZ2  LYS  36           HZ2      LYS  36  40.824 -11.013   6.945
  274    HZ3  LYS  36           HZ3      LYS  36  39.784 -10.975   5.602
  275    H    ASN  37           H        ASN  37  34.251  -6.670   6.576
  276    HA   ASN  37           HA       ASN  37  33.285  -5.009   7.795
  277    HB2  ASN  37           HB2      ASN  37  34.213  -6.256   9.712
  278    HB3  ASN  37           HB3      ASN  37  35.717  -5.348   9.580
  279   HD21  ASN  37          HD21      ASN  37  35.894  -3.868  11.057
  280   HD22  ASN  37          HD22      ASN  37  34.621  -2.905  11.714
  281    H    TYR  38           H        TYR  38  34.822  -4.291   5.578
  282    HA   TYR  38           HA       TYR  38  35.810  -2.558   4.504
  283    HD1  TYR  38           HD1      TYR  38  32.856  -2.525   6.969
  284    HD2  TYR  38           HD2      TYR  38  33.597  -0.074   3.578
  285    HE1  TYR  38           HE1      TYR  38  30.523  -2.811   6.266
  286    HE2  TYR  38           HE2      TYR  38  31.261  -0.344   2.868
  287    HH   TYR  38           HH       TYR  38  28.858  -1.464   4.839
  288    HB2  TYR  38           HB2      TYR  38  34.828  -0.832   6.801
  289    HB3  TYR  38           HB3      TYR  38  35.259  -0.296   5.185
  290    H    ASP  39           H        ASP  39  37.699  -3.852   5.268
  291    HA   ASP  39           HA       ASP  39  39.156  -2.783   7.502
  292    HB2  ASP  39           HB2      ASP  39  38.935  -5.248   6.842
  293    HB3  ASP  39           HB3      ASP  39  40.191  -4.911   5.655
  294    H    ILE  40           H        ILE  40  40.693  -1.370   7.481
  295    HA   ILE  40           HA       ILE  40  41.883  -0.485   4.969
  296    HB   ILE  40           HB       ILE  40  42.608   0.644   7.651
  297   HG12  ILE  40          HG12      ILE  40  40.090   0.278   7.434
  298   HG13  ILE  40          HG13      ILE  40  40.632   1.912   7.836
  299   HG21  ILE  40          HG21      ILE  40  43.464   1.317   5.244
  300   HG22  ILE  40          HG22      ILE  40  43.179   2.533   6.490
  301   HG23  ILE  40          HG23      ILE  40  41.971   2.259   5.235
  302   HD11  ILE  40          HD11      ILE  40  40.505   1.819   5.045
  303   HD12  ILE  40          HD12      ILE  40  39.397   2.640   6.144
  304   HD13  ILE  40          HD13      ILE  40  39.057   0.990   5.619
  305    H    GLY  41           H        GLY  41  42.496  -2.357   7.786
  306    HA2  GLY  41           HA2      GLY  41  45.288  -2.214   7.833
  307    HA3  GLY  41           HA3      GLY  41  44.332  -3.483   8.553
  308    H    ALA  42           H        ALA  42  43.099  -4.214   6.059
  309    HA   ALA  42           HA       ALA  42  45.357  -5.764   4.989
  310    HB1  ALA  42           HB1      ALA  42  42.728  -6.487   5.697
  311    HB2  ALA  42           HB2      ALA  42  43.989  -7.512   5.006
  312    HB3  ALA  42           HB3      ALA  42  42.858  -6.671   3.946
  313    H    ALA  43           H        ALA  43  43.149  -3.320   4.147
  314    HA   ALA  43           HA       ALA  43  43.285  -3.645   1.311
  315    HB1  ALA  43           HB1      ALA  43  41.732  -2.142   2.964
  316    HB2  ALA  43           HB2      ALA  43  41.858  -1.915   1.219
  317    HB3  ALA  43           HB3      ALA  43  42.828  -0.925   2.308
  318    H    LEU  44           H        LEU  44  45.205  -1.986   3.716
  319    HA   LEU  44           HA       LEU  44  46.673  -0.326   1.983
  320    HG   LEU  44           HG       LEU  44  47.552   1.467   3.589
  321    HB2  LEU  44           HB2      LEU  44  46.920  -1.239   4.776
  322    HB3  LEU  44           HB3      LEU  44  48.420  -0.737   4.009
  323   HD11  LEU  44          HD11      LEU  44  45.266   2.070   4.467
  324   HD12  LEU  44          HD12      LEU  44  44.944   0.334   4.577
  325   HD13  LEU  44          HD13      LEU  44  45.296   1.074   3.011
  326   HD21  LEU  44          HD21      LEU  44  47.253   0.368   6.342
  327   HD22  LEU  44          HD22      LEU  44  46.810   2.045   6.021
  328   HD23  LEU  44          HD23      LEU  44  48.452   1.489   5.700
  329    H    ASP  45           H        ASP  45  47.144  -3.667   2.975
  330    HA   ASP  45           HA       ASP  45  49.766  -4.051   2.174
  331    HB2  ASP  45           HB2      ASP  45  48.704  -5.820   3.324
  332    HB3  ASP  45           HB3      ASP  45  47.388  -5.899   2.160
  333    H    THR  46           H        THR  46  46.852  -4.004   0.170
  334    HA   THR  46           HA       THR  46  48.483  -4.619  -2.156
  335    HB   THR  46           HB       THR  46  46.102  -4.518  -3.249
  336    HG1  THR  46           HG1      THR  46  44.764  -3.854  -1.736
  337   HG21  THR  46          HG21      THR  46  47.632  -6.563  -2.273
  338   HG22  THR  46          HG22      THR  46  46.146  -6.740  -3.205
  339   HG23  THR  46          HG23      THR  46  46.095  -6.793  -1.441
  340    H    ILE  47           H        ILE  47  47.011  -1.794  -0.717
  341    HA   ILE  47           HA       ILE  47  47.149  -0.309  -3.213
  342    HB   ILE  47           HB       ILE  47  46.681   1.729  -1.794
  343   HG12  ILE  47          HG12      ILE  47  45.964  -0.326   0.294
  344   HG13  ILE  47          HG13      ILE  47  47.410   0.679   0.349
  345   HG21  ILE  47          HG21      ILE  47  44.704   1.352  -2.718
  346   HG22  ILE  47          HG22      ILE  47  44.255   0.480  -1.255
  347   HG23  ILE  47          HG23      ILE  47  44.923  -0.393  -2.634
  348   HD11  ILE  47          HD11      ILE  47  44.565   1.648   0.400
  349   HD12  ILE  47          HD12      ILE  47  45.999   2.676   0.399
  350   HD13  ILE  47          HD13      ILE  47  45.689   1.597   1.759
  351    H    GLN  48           H        GLN  48  49.568  -1.397  -2.634
  352    HA   GLN  48           HA       GLN  48  51.743  -0.847  -2.888
  353    HB2  GLN  48           HB2      GLN  48  50.923   2.051  -2.644
  354    HB3  GLN  48           HB3      GLN  48  52.405   1.426  -3.348
  355    HG2  GLN  48           HG2      GLN  48  51.407   1.474  -5.328
  356    HG3  GLN  48           HG3      GLN  48  50.328   0.195  -4.768
  357   HE21  GLN  48          HE21      GLN  48  48.258   0.627  -4.984
  358   HE22  GLN  48          HE22      GLN  48  47.524   2.197  -4.928
  359    H    TYR  49           H        TYR  49  50.261  -0.840  -0.134
  360    HA   TYR  49           HA       TYR  49  52.616   0.119   1.370
  361    HD1  TYR  49           HD2      TYR  49  52.333   1.921   0.638
  362    HD2  TYR  49           HD1      TYR  49  49.312   2.422   3.588
  363    HE1  TYR  49           HE2      TYR  49  52.473   4.357   0.360
  364    HE2  TYR  49           HE1      TYR  49  49.439   4.860   3.311
  365    HH   TYR  49           HH       TYR  49  50.911   6.546   2.521
  366    HB2  TYR  49           HB2      TYR  49  49.699   0.204   2.151
  367    HB3  TYR  49           HB3      TYR  49  50.983   0.275   3.353
  368    H    SER  50           H        SER  50  52.832  -2.342   0.386
  369    HA   SER  50           HA       SER  50  51.630  -4.311   2.090
  370    HG   SER  50           HG       SER  50  51.704  -6.459   0.827
  371    HB2  SER  50           HB2      SER  50  52.170  -4.629  -0.367
  372    HB3  SER  50           HB3      SER  50  53.865  -4.759   0.107
  373    H    LYS  51           H        LYS  51  53.845  -2.240   2.892
  374    HA   LYS  51           HA       LYS  51  55.088  -4.092   4.775
  375    HB2  LYS  51           HB2      LYS  51  57.304  -3.018   4.495
  376    HB3  LYS  51           HB3      LYS  51  56.781  -3.883   3.058
  377    HG2  LYS  51           HG2      LYS  51  56.064  -1.731   2.070
  378    HG3  LYS  51           HG3      LYS  51  56.707  -0.904   3.491
  379    HD2  LYS  51           HD2      LYS  51  58.316  -0.816   1.691
  380    HD3  LYS  51           HD3      LYS  51  58.933  -1.833   2.997
  381    HE2  LYS  51           HE2      LYS  51  58.194  -3.831   1.756
  382    HE3  LYS  51           HE3      LYS  51  57.639  -2.793   0.442
  383    HZ1  LYS  51           HZ1      LYS  51  60.338  -3.592   1.168
  384    HZ2  LYS  51           HZ2      LYS  51  60.160  -1.975   0.671
  385    HZ3  LYS  51           HZ3      LYS  51  59.683  -3.239  -0.353
  386    H    HIS  52           H        HIS  52  53.030  -1.894   4.682
  387    HA   HIS  52           HA       HIS  52  52.250  -0.250   6.035
  388    HD1  HIS  52           HD1      HIS  52  53.723  -0.486  10.455
  389    HD2  HIS  52           HD2      HIS  52  51.728   1.591   7.446
  390    HE1  HIS  52           HE1      HIS  52  52.384   1.328  11.604
  391    HB2  HIS  52           HB2      HIS  52  53.237  -1.723   7.855
  392    HB3  HIS  52           HB3      HIS  52  54.664  -0.698   7.799
  Start of MODEL   29
    1    H1   GLY   1           1H       GLY   1  19.013   6.865   1.953
    2    H2   GLY   1           2H       GLY   1  18.399   6.021   3.288
    3    H3   GLY   1           3H       GLY   1  18.492   5.265   1.774
    4    HA2  GLY   1           HA2      GLY   1  20.636   5.881   3.679
    5    HA3  GLY   1           HA3      GLY   1  20.306   4.376   2.829
    6    H    SER   2           H        SER   2  22.841   5.398   2.893
    7    HA   SER   2           HA       SER   2  23.293   6.883   0.436
    8    HG   SER   2           HG       SER   2  26.409   6.298   0.685
    9    HB2  SER   2           HB2      SER   2  24.559   7.456   2.480
   10    HB3  SER   2           HB3      SER   2  25.253   5.833   2.495
   11    HA   PRO   3           HA       PRO   3  24.112   3.280  -2.053
   12    HB2  PRO   3           HB2      PRO   3  25.976   4.976  -3.577
   13    HB3  PRO   3           HB3      PRO   3  24.499   4.173  -4.115
   14    HG2  PRO   3           HG2      PRO   3  24.626   6.844  -3.814
   15    HG3  PRO   3           HG3      PRO   3  23.147   5.929  -3.469
   16    HD2  PRO   3           HD2      PRO   3  25.184   7.030  -1.565
   17    HD3  PRO   3           HD3      PRO   3  23.412   6.999  -1.429
   18    HA   PRO   4           HA       PRO   4  27.853   1.730  -0.310
   19    HB2  PRO   4           HB2      PRO   4  27.917  -0.280  -2.445
   20    HB3  PRO   4           HB3      PRO   4  27.667  -0.492  -0.711
   21    HG2  PRO   4           HG2      PRO   4  25.670  -0.835  -2.480
   22    HG3  PRO   4           HG3      PRO   4  25.386  -0.168  -0.862
   23    HD2  PRO   4           HD2      PRO   4  25.611   1.264  -3.489
   24    HD3  PRO   4           HD3      PRO   4  24.465   1.528  -2.153
   25    H    GLU   5           H        GLU   5  28.162   3.795  -2.474
   26    HA   GLU   5           HA       GLU   5  30.917   3.080  -3.134
   27    HB2  GLU   5           HB2      GLU   5  28.955   4.321  -5.072
   28    HB3  GLU   5           HB3      GLU   5  30.688   4.228  -5.348
   29    HG2  GLU   5           HG2      GLU   5  30.552   1.773  -5.251
   30    HG3  GLU   5           HG3      GLU   5  28.807   1.899  -5.036
   31    H    ALA   6           H        ALA   6  29.053   4.938  -1.430
   32    HA   ALA   6           HA       ALA   6  31.012   6.965  -1.041
   33    HB1  ALA   6           HB1      ALA   6  28.757   7.572  -2.803
   34    HB2  ALA   6           HB2      ALA   6  30.284   8.427  -2.575
   35    HB3  ALA   6           HB3      ALA   6  28.943   8.706  -1.463
   36    H    ASP   7           H        ASP   7  29.468   4.914   0.362
   37    HA   ASP   7           HA       ASP   7  27.710   6.351   2.148
   38    HB2  ASP   7           HB2      ASP   7  27.361   4.180   3.235
   39    HB3  ASP   7           HB3      ASP   7  27.142   4.080   1.504
   40    HA   PRO   8           HA       PRO   8  30.330   7.699   5.333
   41    HB2  PRO   8           HB2      PRO   8  28.936   5.790   7.169
   42    HB3  PRO   8           HB3      PRO   8  29.301   7.505   7.394
   43    HG2  PRO   8           HG2      PRO   8  26.847   6.713   6.710
   44    HG3  PRO   8           HG3      PRO   8  27.551   8.198   6.043
   45    HD2  PRO   8           HD2      PRO   8  27.082   5.575   4.740
   46    HD3  PRO   8           HD3      PRO   8  27.142   7.199   4.027
   47    H    ARG   9           H        ARG   9  30.192   4.318   4.664
   48    HA   ARG   9           HA       ARG   9  32.518   3.717   6.320
   49    HE   ARG   9           HE       ARG   9  29.129   1.337   4.378
   50    HB2  ARG   9           HB2      ARG   9  30.918   1.885   4.527
   51    HB3  ARG   9           HB3      ARG   9  32.100   1.403   5.745
   52    HG2  ARG   9           HG2      ARG   9  30.688   2.099   7.517
   53    HG3  ARG   9           HG3      ARG   9  29.588   2.919   6.406
   54    HD2  ARG   9           HD2      ARG   9  30.066  -0.047   6.638
   55    HD3  ARG   9           HD3      ARG   9  28.602   0.832   7.084
   56   HH11  ARG   9          HH11      ARG   9  28.184  -1.324   6.452
   57   HH12  ARG   9          HH12      ARG   9  27.359  -2.181   5.181
   58   HH21  ARG   9          HH21      ARG   9  28.051   0.244   2.730
   59   HH22  ARG   9          HH22      ARG   9  27.284  -1.288   3.050
   60    H    LEU  10           H        LEU  10  31.588   3.747   2.872
   61    HA   LEU  10           HA       LEU  10  34.331   3.118   2.151
   62    HG   LEU  10           HG       LEU  10  32.193   1.089   1.830
   63    HB2  LEU  10           HB2      LEU  10  31.773   3.157   0.579
   64    HB3  LEU  10           HB3      LEU  10  33.343   3.016  -0.194
   65   HD11  LEU  10          HD11      LEU  10  31.423  -0.145   0.146
   66   HD12  LEU  10          HD12      LEU  10  32.881   0.101  -0.816
   67   HD13  LEU  10          HD13      LEU  10  31.595   1.307  -0.839
   68   HD21  LEU  10          HD21      LEU  10  34.411   0.055   0.389
   69   HD22  LEU  10          HD22      LEU  10  34.246   0.310   2.126
   70   HD23  LEU  10          HD23      LEU  10  34.882   1.597   1.101
   71    H    ILE  11           H        ILE  11  32.103   5.782   2.151
   72    HA   ILE  11           HA       ILE  11  33.762   7.445   0.459
   73    HB   ILE  11           HB       ILE  11  31.264   7.874   1.034
   74   HG12  ILE  11          HG12      ILE  11  33.299  10.107   1.210
   75   HG13  ILE  11          HG13      ILE  11  32.651   9.413  -0.274
   76   HG21  ILE  11          HG21      ILE  11  31.151   9.570   2.977
   77   HG22  ILE  11          HG22      ILE  11  32.630   8.788   3.534
   78   HG23  ILE  11          HG23      ILE  11  31.151   7.845   3.349
   79   HD11  ILE  11          HD11      ILE  11  30.467  10.264   0.222
   80   HD12  ILE  11          HD12      ILE  11  31.639  11.578   0.339
   81   HD13  ILE  11          HD13      ILE  11  31.004  10.827   1.804
   82    H    GLU  12           H        GLU  12  33.851   6.118   3.538
   83    HA   GLU  12           HA       GLU  12  35.775   8.115   4.522
   84    HB2  GLU  12           HB2      GLU  12  34.052   7.274   6.095
   85    HB3  GLU  12           HB3      GLU  12  34.726   5.658   5.935
   86    HG2  GLU  12           HG2      GLU  12  35.512   6.663   7.970
   87    HG3  GLU  12           HG3      GLU  12  36.857   6.480   6.848
   88    H    SER  13           H        SER  13  35.644   4.546   4.222
   89    HA   SER  13           HA       SER  13  38.481   4.391   4.544
   90    HG   SER  13           HG       SER  13  36.950   1.801   6.216
   91    HB2  SER  13           HB2      SER  13  36.497   2.214   3.854
   92    HB3  SER  13           HB3      SER  13  38.156   1.964   4.399
   93    H    LEU  14           H        LEU  14  36.338   4.126   1.733
   94    HA   LEU  14           HA       LEU  14  38.569   3.231   0.088
   95    HG   LEU  14           HG       LEU  14  37.920   2.361  -2.124
   96    HB2  LEU  14           HB2      LEU  14  36.271   2.206  -0.057
   97    HB3  LEU  14           HB3      LEU  14  35.687   3.733  -0.682
   98   HD11  LEU  14          HD11      LEU  14  35.690   1.469  -3.420
   99   HD12  LEU  14          HD12      LEU  14  35.220   1.300  -1.728
  100   HD13  LEU  14          HD13      LEU  14  36.678   0.505  -2.321
  101   HD21  LEU  14          HD21      LEU  14  37.489   4.274  -3.257
  102   HD22  LEU  14          HD22      LEU  14  35.832   4.384  -2.664
  103   HD23  LEU  14          HD23      LEU  14  36.225   3.281  -3.982
  104    H    SER  15           H        SER  15  36.389   5.935   0.524
  105    HA   SER  15           HA       SER  15  37.376   7.317  -1.716
  106    HG   SER  15           HG       SER  15  35.120   9.300  -1.885
  107    HB2  SER  15           HB2      SER  15  35.106   7.638  -0.625
  108    HB3  SER  15           HB3      SER  15  35.938   8.618   0.583
  109    H    GLN  16           H        GLN  16  38.556   7.011   1.528
  110    HA   GLN  16           HA       GLN  16  40.128   9.423   1.489
  111    HB2  GLN  16           HB2      GLN  16  41.221   8.632   3.436
  112    HB3  GLN  16           HB3      GLN  16  39.549   8.124   3.593
  113    HG2  GLN  16           HG2      GLN  16  40.568   6.214   4.246
  114    HG3  GLN  16           HG3      GLN  16  40.509   5.902   2.513
  115   HE21  GLN  16          HE21      GLN  16  42.323   5.133   1.729
  116   HE22  GLN  16          HE22      GLN  16  43.920   5.478   2.281
  117    H    MET  17           H        MET  17  40.352   6.261   0.183
  118    HA   MET  17           HA       MET  17  43.149   6.339  -0.447
  119    HB2  MET  17           HB2      MET  17  40.960   4.657  -1.691
  120    HB3  MET  17           HB3      MET  17  42.692   4.379  -1.824
  121    HG2  MET  17           HG2      MET  17  42.816   3.970   0.577
  122    HG3  MET  17           HG3      MET  17  41.083   4.251   0.720
  123    HE1  MET  17           HE1      MET  17  43.611   1.017  -0.697
  124    HE2  MET  17           HE2      MET  17  43.593   2.626  -1.417
  125    HE3  MET  17           HE3      MET  17  42.706   1.307  -2.183
  126    H    LEU  18           H        LEU  18  40.103   6.917  -2.187
  127    HA   LEU  18           HA       LEU  18  41.324   7.584  -4.656
  128    HG   LEU  18           HG       LEU  18  37.827   6.963  -5.524
  129    HB2  LEU  18           HB2      LEU  18  38.635   7.961  -3.468
  130    HB3  LEU  18           HB3      LEU  18  39.047   8.978  -4.833
  131   HD11  LEU  18          HD11      LEU  18  39.668   8.091  -6.904
  132   HD12  LEU  18          HD12      LEU  18  39.144   6.479  -7.387
  133   HD13  LEU  18          HD13      LEU  18  40.650   6.684  -6.495
  134   HD21  LEU  18          HD21      LEU  18  40.231   5.383  -4.640
  135   HD22  LEU  18          HD22      LEU  18  38.707   4.775  -5.289
  136   HD23  LEU  18          HD23      LEU  18  38.751   5.513  -3.688
  137    H    SER  19           H        SER  19  40.393   9.615  -1.899
  138    HA   SER  19           HA       SER  19  41.011  12.079  -3.171
  139    HG   SER  19           HG       SER  19  38.869  11.346  -0.379
  140    HB2  SER  19           HB2      SER  19  40.951  11.499  -0.199
  141    HB3  SER  19           HB3      SER  19  40.777  13.073  -0.975
  142    H    MET  20           H        MET  20  43.010   9.657  -1.798
  143    HA   MET  20           HA       MET  20  45.187  11.561  -1.331
  144    HB2  MET  20           HB2      MET  20  44.463   9.765   0.358
  145    HB3  MET  20           HB3      MET  20  45.255   8.620  -0.714
  146    HG2  MET  20           HG2      MET  20  47.369   9.646  -0.389
  147    HG3  MET  20           HG3      MET  20  46.644  11.013   0.456
  148    HE1  MET  20           HE1      MET  20  45.154  10.713   2.481
  149    HE2  MET  20           HE2      MET  20  45.489   9.579   3.790
  150    HE3  MET  20           HE3      MET  20  44.464   9.091   2.438
  151    H    GLY  21           H        GLY  21  44.260   8.906  -3.401
  152    HA2  GLY  21           HA2      GLY  21  45.251   8.924  -5.653
  153    HA3  GLY  21           HA3      GLY  21  46.794   9.279  -4.874
  154    H    PHE  22           H        PHE  22  44.272   6.936  -4.053
  155    HA   PHE  22           HA       PHE  22  46.107   4.753  -4.694
  156    HD1  PHE  22           HD1      PHE  22  47.942   4.353  -3.396
  157    HD2  PHE  22           HD2      PHE  22  45.475   6.137  -0.429
  158    HE1  PHE  22           HE1      PHE  22  49.944   5.225  -2.268
  159    HE2  PHE  22           HE2      PHE  22  47.473   7.018   0.707
  160    HZ   PHE  22           HZ       PHE  22  49.710   6.560  -0.211
  161    HB2  PHE  22           HB2      PHE  22  44.485   4.990  -2.141
  162    HB3  PHE  22           HB3      PHE  22  45.395   3.564  -2.638
  163    H    SER  23           H        SER  23  44.829   2.655  -4.788
  164    HA   SER  23           HA       SER  23  41.998   2.958  -5.228
  165    HG   SER  23           HG       SER  23  42.726   4.650  -6.684
  166    HB2  SER  23           HB2      SER  23  43.841   2.386  -7.571
  167    HB3  SER  23           HB3      SER  23  42.089   2.211  -7.615
  168    H    ASP  24           H        ASP  24  42.916   0.620  -7.309
  169    HA   ASP  24           HA       ASP  24  43.387  -1.392  -5.237
  170    HB2  ASP  24           HB2      ASP  24  42.323  -3.076  -6.828
  171    HB3  ASP  24           HB3      ASP  24  41.224  -1.985  -5.993
  172    H    GLU  25           H        GLU  25  45.202  -2.538  -5.513
  173    HA   GLU  25           HA       GLU  25  46.900  -1.781  -7.701
  174    HB2  GLU  25           HB2      GLU  25  48.612  -3.122  -6.577
  175    HB3  GLU  25           HB3      GLU  25  47.789  -2.044  -5.457
  176    HG2  GLU  25           HG2      GLU  25  47.879  -3.917  -4.199
  177    HG3  GLU  25           HG3      GLU  25  46.323  -4.149  -4.984
  178    H    GLY  26           H        GLY  26  44.427  -3.804  -7.599
  179    HA2  GLY  26           HA2      GLY  26  45.301  -5.128 -10.008
  180    HA3  GLY  26           HA3      GLY  26  44.861  -6.231  -8.703
  181    H    GLY  27           H        GLY  27  42.705  -5.843  -7.702
  182    HA2  GLY  27           HA2      GLY  27  40.743  -4.245  -8.920
  183    HA3  GLY  27           HA3      GLY  27  40.609  -5.880  -9.558
  184    H    TRP  28           H        TRP  28  41.765  -5.259  -6.350
  185    HA   TRP  28           HA       TRP  28  39.539  -6.799  -5.308
  186    HD1  TRP  28           HD1      TRP  28  43.870  -6.742  -5.711
  187    HE1  TRP  28           HE1      TRP  28  45.515  -4.916  -4.970
  188    HE3  TRP  28           HE3      TRP  28  41.116  -4.578  -1.992
  189    HZ2  TRP  28           HZ2      TRP  28  45.639  -2.837  -3.086
  190    HZ3  TRP  28           HZ3      TRP  28  42.064  -2.668  -0.776
  191    HH2  TRP  28           HH2      TRP  28  44.280  -1.816  -1.309
  192    HB2  TRP  28           HB2      TRP  28  41.012  -6.908  -3.242
  193    HB3  TRP  28           HB3      TRP  28  41.654  -7.692  -4.690
  194    H    LEU  29           H        LEU  29  40.723  -3.545  -5.278
  195    HA   LEU  29           HA       LEU  29  40.381  -2.603  -2.838
  196    HG   LEU  29           HG       LEU  29  38.236  -0.165  -3.558
  197    HB2  LEU  29           HB2      LEU  29  40.970  -1.053  -4.486
  198    HB3  LEU  29           HB3      LEU  29  39.476  -1.284  -5.373
  199   HD11  LEU  29          HD11      LEU  29  39.443  -0.561  -1.612
  200   HD12  LEU  29          HD12      LEU  29  39.722   1.150  -1.930
  201   HD13  LEU  29          HD13      LEU  29  40.963  -0.036  -2.333
  202   HD21  LEU  29          HD21      LEU  29  40.549   1.540  -4.439
  203   HD22  LEU  29          HD22      LEU  29  38.898   2.048  -4.082
  204   HD23  LEU  29          HD23      LEU  29  39.233   1.070  -5.514
  205    H    THR  30           H        THR  30  37.493  -2.877  -4.960
  206    HA   THR  30           HA       THR  30  35.731  -2.096  -2.855
  207    HB   THR  30           HB       THR  30  33.940  -2.732  -4.405
  208    HG1  THR  30           HG1      THR  30  34.572  -4.501  -5.469
  209   HG21  THR  30          HG21      THR  30  34.256  -0.850  -5.506
  210   HG22  THR  30          HG22      THR  30  35.519  -1.601  -6.480
  211   HG23  THR  30          HG23      THR  30  35.930  -0.823  -4.952
  212    H    ARG  31           H        ARG  31  37.222  -5.043  -3.654
  213    HA   ARG  31           HA       ARG  31  35.177  -6.717  -2.439
  214    HE   ARG  31           HE       ARG  31  35.117  -8.970  -7.127
  215    HB2  ARG  31           HB2      ARG  31  37.809  -7.743  -3.438
  216    HB3  ARG  31           HB3      ARG  31  36.226  -8.508  -3.490
  217    HG2  ARG  31           HG2      ARG  31  35.576  -6.702  -5.160
  218    HG3  ARG  31           HG3      ARG  31  37.287  -6.313  -5.246
  219    HD2  ARG  31           HD2      ARG  31  37.738  -8.082  -6.538
  220    HD3  ARG  31           HD3      ARG  31  36.751  -9.163  -5.552
  221   HH11  ARG  31          HH11      ARG  31  37.195  -6.166  -7.434
  222   HH12  ARG  31          HH12      ARG  31  36.250  -5.459  -8.706
  223   HH21  ARG  31          HH21      ARG  31  33.889  -8.028  -8.794
  224   HH22  ARG  31          HH22      ARG  31  34.386  -6.511  -9.479
  225    H    LEU  32           H        LEU  32  38.620  -6.016  -1.973
  226    HA   LEU  32           HA       LEU  32  39.258  -7.623   0.149
  227    HG   LEU  32           HG       LEU  32  42.459  -5.686   0.330
  228    HB2  LEU  32           HB2      LEU  32  40.757  -6.142  -1.200
  229    HB3  LEU  32           HB3      LEU  32  40.176  -4.776  -0.273
  230   HD11  LEU  32          HD11      LEU  32  40.310  -5.379   2.393
  231   HD12  LEU  32          HD12      LEU  32  41.518  -4.203   1.871
  232   HD13  LEU  32          HD13      LEU  32  42.006  -5.610   2.816
  233   HD21  LEU  32          HD21      LEU  32  42.354  -7.964   0.351
  234   HD22  LEU  32          HD22      LEU  32  40.769  -7.997   1.128
  235   HD23  LEU  32          HD23      LEU  32  42.207  -7.598   2.071
  236    H    LEU  33           H        LEU  33  38.637  -4.154   0.650
  237    HA   LEU  33           HA       LEU  33  38.308  -4.448   3.399
  238    HG   LEU  33           HG       LEU  33  38.516  -2.386   0.459
  239    HB2  LEU  33           HB2      LEU  33  37.119  -2.109   3.122
  240    HB3  LEU  33           HB3      LEU  33  38.853  -2.300   2.937
  241   HD11  LEU  33          HD11      LEU  33  35.942  -1.081   0.479
  242   HD12  LEU  33          HD12      LEU  33  35.841  -2.730   1.099
  243   HD13  LEU  33          HD13      LEU  33  36.523  -2.429  -0.502
  244   HD21  LEU  33          HD21      LEU  33  39.186  -0.293   0.786
  245   HD22  LEU  33          HD22      LEU  33  38.201  -0.120   2.238
  246   HD23  LEU  33          HD23      LEU  33  37.487   0.163   0.651
  247    H    GLN  34           H        GLN  34  35.983  -4.851   0.874
  248    HA   GLN  34           HA       GLN  34  33.614  -4.336   2.242
  249    HB2  GLN  34           HB2      GLN  34  33.915  -4.833  -0.199
  250    HB3  GLN  34           HB3      GLN  34  34.018  -6.534   0.221
  251    HG2  GLN  34           HG2      GLN  34  31.799  -6.166  -0.473
  252    HG3  GLN  34           HG3      GLN  34  31.751  -6.312   1.280
  253   HE21  GLN  34          HE21      GLN  34  32.974  -3.379  -0.077
  254   HE22  GLN  34          HE22      GLN  34  31.590  -2.404   0.250
  255    H    THR  35           H        THR  35  35.650  -7.213   2.281
  256    HA   THR  35           HA       THR  35  33.732  -8.583   4.006
  257    HB   THR  35           HB       THR  35  36.372  -9.639   2.985
  258    HG1  THR  35           HG1      THR  35  35.511  -9.778   1.086
  259   HG21  THR  35          HG21      THR  35  34.763 -10.811   4.771
  260   HG22  THR  35          HG22      THR  35  35.710 -11.705   3.582
  261   HG23  THR  35          HG23      THR  35  34.005 -11.368   3.279
  262    H    LYS  36           H        LYS  36  36.435  -6.588   4.300
  263    HA   LYS  36           HA       LYS  36  37.161  -7.741   6.906
  264    HB2  LYS  36           HB2      LYS  36  38.684  -6.039   4.950
  265    HB3  LYS  36           HB3      LYS  36  39.183  -6.141   6.630
  266    HG2  LYS  36           HG2      LYS  36  40.494  -7.690   5.413
  267    HG3  LYS  36           HG3      LYS  36  39.326  -8.627   6.345
  268    HD2  LYS  36           HD2      LYS  36  37.989  -9.022   4.408
  269    HD3  LYS  36           HD3      LYS  36  38.920  -7.860   3.458
  270    HE2  LYS  36           HE2      LYS  36  39.587 -10.083   2.840
  271    HE3  LYS  36           HE3      LYS  36  40.909  -9.309   3.710
  272    HZ1  LYS  36           HZ1      LYS  36  40.923 -11.183   4.888
  273    HZ2  LYS  36           HZ2      LYS  36  39.363 -11.644   4.396
  274    HZ3  LYS  36           HZ3      LYS  36  39.563 -10.558   5.692
  275    H    ASN  37           H        ASN  37  34.795  -6.144   6.672
  276    HA   ASN  37           HA       ASN  37  33.707  -4.449   7.726
  277    HB2  ASN  37           HB2      ASN  37  34.771  -5.482   9.705
  278    HB3  ASN  37           HB3      ASN  37  36.165  -4.421   9.497
  279   HD21  ASN  37          HD21      ASN  37  36.182  -2.660  10.653
  280   HD22  ASN  37          HD22      ASN  37  34.814  -1.852  11.320
  281    H    TYR  38           H        TYR  38  35.211  -3.752   5.456
  282    HA   TYR  38           HA       TYR  38  36.002  -1.983   4.279
  283    HD1  TYR  38           HD1      TYR  38  34.031  -1.289   2.845
  284    HD2  TYR  38           HD2      TYR  38  32.478  -1.331   6.807
  285    HE1  TYR  38           HE1      TYR  38  31.945  -2.267   2.009
  286    HE2  TYR  38           HE2      TYR  38  30.378  -2.303   5.973
  287    HH   TYR  38           HH       TYR  38  30.024  -3.261   2.587
  288    HB2  TYR  38           HB2      TYR  38  34.580  -0.379   6.418
  289    HB3  TYR  38           HB3      TYR  38  34.979   0.167   4.787
  290    H    ASP  39           H        ASP  39  37.996  -2.958   5.422
  291    HA   ASP  39           HA       ASP  39  39.218  -1.201   7.377
  292    HB2  ASP  39           HB2      ASP  39  39.265  -3.877   7.107
  293    HB3  ASP  39           HB3      ASP  39  40.742  -3.479   6.231
  294    H    ILE  40           H        ILE  40  40.720   0.272   6.996
  295    HA   ILE  40           HA       ILE  40  41.939   0.425   4.335
  296    HB   ILE  40           HB       ILE  40  43.087   2.502   5.502
  297   HG12  ILE  40          HG12      ILE  40  41.603   1.746   7.631
  298   HG13  ILE  40          HG13      ILE  40  42.079   3.412   7.331
  299   HG21  ILE  40          HG21      ILE  40  41.376   2.261   3.552
  300   HG22  ILE  40          HG22      ILE  40  41.676   3.833   4.290
  301   HG23  ILE  40          HG23      ILE  40  40.241   2.912   4.734
  302   HD11  ILE  40          HD11      ILE  40  39.826   3.578   7.818
  303   HD12  ILE  40          HD12      ILE  40  39.420   2.109   6.929
  304   HD13  ILE  40          HD13      ILE  40  39.843   3.582   6.052
  305    H    GLY  41           H        GLY  41  42.459  -0.975   7.291
  306    HA2  GLY  41           HA2      GLY  41  45.238  -0.534   7.589
  307    HA3  GLY  41           HA3      GLY  41  44.313  -1.801   8.373
  308    H    ALA  42           H        ALA  42  43.338  -3.059   6.130
  309    HA   ALA  42           HA       ALA  42  45.730  -4.439   5.216
  310    HB1  ALA  42           HB1      ALA  42  44.130  -6.130   4.330
  311    HB2  ALA  42           HB2      ALA  42  42.815  -5.158   4.991
  312    HB3  ALA  42           HB3      ALA  42  44.012  -5.875   6.071
  313    H    ALA  43           H        ALA  43  43.352  -2.257   4.084
  314    HA   ALA  43           HA       ALA  43  43.534  -2.814   1.306
  315    HB1  ALA  43           HB1      ALA  43  42.018  -1.170   1.040
  316    HB2  ALA  43           HB2      ALA  43  42.900  -0.043   2.069
  317    HB3  ALA  43           HB3      ALA  43  41.875  -1.282   2.796
  318    H    LEU  44           H        LEU  44  45.240  -0.539   3.424
  319    HA   LEU  44           HA       LEU  44  46.743   0.625   1.269
  320    HG   LEU  44           HG       LEU  44  46.779   2.982   2.143
  321    HB2  LEU  44           HB2      LEU  44  46.820   0.817   4.255
  322    HB3  LEU  44           HB3      LEU  44  48.205   1.375   3.330
  323   HD11  LEU  44          HD11      LEU  44  44.622   1.654   3.726
  324   HD12  LEU  44          HD12      LEU  44  44.644   2.126   2.025
  325   HD13  LEU  44          HD13      LEU  44  44.470   3.355   3.279
  326   HD21  LEU  44          HD21      LEU  44  46.209   4.410   4.133
  327   HD22  LEU  44          HD22      LEU  44  47.871   3.824   4.063
  328   HD23  LEU  44          HD23      LEU  44  46.709   3.058   5.148
  329    H    ASP  45           H        ASP  45  47.172  -1.962   3.556
  330    HA   ASP  45           HA       ASP  45  49.907  -2.469   3.329
  331    HB2  ASP  45           HB2      ASP  45  48.337  -3.483   4.984
  332    HB3  ASP  45           HB3      ASP  45  47.678  -4.486   3.700
  333    H    THR  46           H        THR  46  47.242  -3.387   1.247
  334    HA   THR  46           HA       THR  46  48.874  -5.155  -0.322
  335    HB   THR  46           HB       THR  46  46.656  -5.112  -1.739
  336    HG1  THR  46           HG1      THR  46  45.227  -3.828  -0.924
  337   HG21  THR  46          HG21      THR  46  46.478  -7.105  -0.816
  338   HG22  THR  46          HG22      THR  46  45.720  -6.353   0.589
  339   HG23  THR  46          HG23      THR  46  47.466  -6.600   0.556
  340    H    ILE  47           H        ILE  47  47.333  -1.966  -0.886
  341    HA   ILE  47           HA       ILE  47  47.850  -1.913  -3.631
  342    HB   ILE  47           HB       ILE  47  47.721   0.656  -3.320
  343   HG12  ILE  47          HG12      ILE  47  46.841  -0.272  -0.580
  344   HG13  ILE  47          HG13      ILE  47  48.303   0.645  -0.933
  345   HG21  ILE  47          HG21      ILE  47  45.296   0.581  -3.086
  346   HG22  ILE  47          HG22      ILE  47  45.397  -1.090  -2.537
  347   HG23  ILE  47          HG23      ILE  47  45.886  -0.670  -4.179
  348   HD11  ILE  47          HD11      ILE  47  46.667   2.368  -1.951
  349   HD12  ILE  47          HD12      ILE  47  46.853   2.268  -0.199
  350   HD13  ILE  47          HD13      ILE  47  45.459   1.523  -0.984
  351    H    GLN  48           H        GLN  48  49.943  -0.910  -0.978
  352    HA   GLN  48           HA       GLN  48  52.216  -0.738  -2.722
  353    HB2  GLN  48           HB2      GLN  48  50.851   1.758  -1.828
  354    HB3  GLN  48           HB3      GLN  48  52.606   1.740  -1.789
  355    HG2  GLN  48           HG2      GLN  48  52.579   2.316  -3.926
  356    HG3  GLN  48           HG3      GLN  48  51.938   0.713  -4.288
  357   HE21  GLN  48          HE21      GLN  48  49.600   2.031  -2.490
  358   HE22  GLN  48          HE22      GLN  48  48.622   2.746  -3.731
  359    H    TYR  49           H        TYR  49  50.786  -0.244   0.450
  360    HA   TYR  49           HA       TYR  49  53.309  -0.069   1.821
  361    HD1  TYR  49           HD1      TYR  49  50.389   1.635   1.098
  362    HD2  TYR  49           HD2      TYR  49  52.301   1.593   4.895
  363    HE1  TYR  49           HE1      TYR  49  50.193   4.084   1.217
  364    HE2  TYR  49           HE2      TYR  49  52.114   4.037   5.029
  365    HH   TYR  49           HH       TYR  49  50.470   5.819   3.951
  366    HB2  TYR  49           HB2      TYR  49  50.476  -0.467   2.801
  367    HB3  TYR  49           HB3      TYR  49  51.862  -0.407   3.884
  368    H    SER  50           H        SER  50  53.308  -2.316   0.193
  369    HA   SER  50           HA       SER  50  52.669  -4.630   1.797
  370    HG   SER  50           HG       SER  50  51.318  -4.505  -0.170
  371    HB2  SER  50           HB2      SER  50  54.061  -4.513  -0.887
  372    HB3  SER  50           HB3      SER  50  53.279  -5.915  -0.153
  373    H    LYS  51           H        LYS  51  54.856  -2.667   2.501
  374    HA   LYS  51           HA       LYS  51  57.034  -4.629   2.764
  375    HB2  LYS  51           HB2      LYS  51  57.253  -1.618   3.025
  376    HB3  LYS  51           HB3      LYS  51  58.574  -2.774   3.077
  377    HG2  LYS  51           HG2      LYS  51  56.847  -2.161   0.686
  378    HG3  LYS  51           HG3      LYS  51  58.502  -1.613   0.945
  379    HD2  LYS  51           HD2      LYS  51  57.705  -4.520   0.789
  380    HD3  LYS  51           HD3      LYS  51  58.244  -3.577  -0.602
  381    HE2  LYS  51           HE2      LYS  51  60.190  -4.636   0.084
  382    HE3  LYS  51           HE3      LYS  51  60.321  -3.053   0.842
  383    HZ1  LYS  51           HZ1      LYS  51  59.972  -3.920   2.925
  384    HZ2  LYS  51           HZ2      LYS  51  60.772  -5.225   2.187
  385    HZ3  LYS  51           HZ3      LYS  51  59.084  -5.254   2.356
  386    H    HIS  52           H        HIS  52  54.702  -4.655   4.266
  387    HA   HIS  52           HA       HIS  52  55.631  -3.773   6.906
  388    HD1  HIS  52           HD1      HIS  52  52.423  -4.964   8.370
  389    HD2  HIS  52           HD2      HIS  52  53.522  -0.957   8.264
  390    HE1  HIS  52           HE1      HIS  52  51.820  -4.007  10.629
  391    HB2  HIS  52           HB2      HIS  52  53.825  -2.322   5.993
  392    HB3  HIS  52           HB3      HIS  52  52.782  -3.733   5.873
  Start of MODEL   30
    1    H1   GLY   1           1H       GLY   1  18.836   3.730   0.311
    2    H2   GLY   1           2H       GLY   1  19.236   2.729   1.618
    3    H3   GLY   1           3H       GLY   1  18.314   2.117   0.331
    4    HA2  GLY   1           HA2      GLY   1  20.775   1.508   0.412
    5    HA3  GLY   1           HA3      GLY   1  20.092   2.040  -1.118
    6    H    SER   2           H        SER   2  22.675   2.391   0.870
    7    HA   SER   2           HA       SER   2  23.099   5.226   0.363
    8    HG   SER   2           HG       SER   2  25.480   2.775   2.534
    9    HB2  SER   2           HB2      SER   2  25.269   4.713   1.670
   10    HB3  SER   2           HB3      SER   2  23.740   4.635   2.548
   11    HA   PRO   3           HA       PRO   3  25.405   4.609  -3.367
   12    HB2  PRO   3           HB2      PRO   3  26.914   7.017  -2.536
   13    HB3  PRO   3           HB3      PRO   3  25.968   6.732  -3.999
   14    HG2  PRO   3           HG2      PRO   3  25.077   8.348  -2.059
   15    HG3  PRO   3           HG3      PRO   3  23.975   7.312  -2.985
   16    HD2  PRO   3           HD2      PRO   3  25.046   6.949  -0.219
   17    HD3  PRO   3           HD3      PRO   3  23.426   6.597  -0.857
   18    HA   PRO   4           HA       PRO   4  29.015   2.585  -1.749
   19    HB2  PRO   4           HB2      PRO   4  29.756   2.010  -4.514
   20    HB3  PRO   4           HB3      PRO   4  29.230   0.902  -3.243
   21    HG2  PRO   4           HG2      PRO   4  27.687   1.485  -5.394
   22    HG3  PRO   4           HG3      PRO   4  27.007   1.101  -3.804
   23    HD2  PRO   4           HD2      PRO   4  27.395   3.775  -5.101
   24    HD3  PRO   4           HD3      PRO   4  26.013   3.163  -4.162
   25    H    GLU   5           H        GLU   5  29.106   5.503  -2.629
   26    HA   GLU   5           HA       GLU   5  32.017   5.637  -2.671
   27    HB2  GLU   5           HB2      GLU   5  30.302   7.285  -4.540
   28    HB3  GLU   5           HB3      GLU   5  32.032   7.475  -4.313
   29    HG2  GLU   5           HG2      GLU   5  32.338   5.161  -5.161
   30    HG3  GLU   5           HG3      GLU   5  30.610   5.113  -5.514
   31    H    ALA   6           H        ALA   6  29.475   6.161  -1.014
   32    HA   ALA   6           HA       ALA   6  30.506   8.415   0.434
   33    HB1  ALA   6           HB1      ALA   6  27.929   9.325   0.125
   34    HB2  ALA   6           HB2      ALA   6  28.362   8.807  -1.503
   35    HB3  ALA   6           HB3      ALA   6  29.360   9.992  -0.660
   36    H    ASP   7           H        ASP   7  29.666   5.582   0.570
   37    HA   ASP   7           HA       ASP   7  27.470   5.428   2.425
   38    HB2  ASP   7           HB2      ASP   7  27.964   3.536   0.965
   39    HB3  ASP   7           HB3      ASP   7  29.620   3.471   1.547
   40    HA   PRO   8           HA       PRO   8  29.488   6.594   6.214
   41    HB2  PRO   8           HB2      PRO   8  28.630   3.882   7.152
   42    HB3  PRO   8           HB3      PRO   8  28.467   5.450   7.952
   43    HG2  PRO   8           HG2      PRO   8  26.398   4.284   6.703
   44    HG3  PRO   8           HG3      PRO   8  26.619   6.042   6.713
   45    HD2  PRO   8           HD2      PRO   8  26.956   4.120   4.494
   46    HD3  PRO   8           HD3      PRO   8  26.646   5.864   4.444
   47    H    ARG   9           H        ARG   9  30.099   3.498   4.730
   48    HA   ARG   9           HA       ARG   9  32.582   3.059   6.190
   49    HE   ARG   9           HE       ARG   9  31.351  -1.307   8.235
   50    HB2  ARG   9           HB2      ARG   9  31.134   1.471   4.073
   51    HB3  ARG   9           HB3      ARG   9  32.619   0.950   4.870
   52    HG2  ARG   9           HG2      ARG   9  30.104   1.565   6.389
   53    HG3  ARG   9           HG3      ARG   9  30.447  -0.029   5.718
   54    HD2  ARG   9           HD2      ARG   9  32.657   0.097   6.992
   55    HD3  ARG   9           HD3      ARG   9  31.949   1.468   7.851
   56   HH11  ARG   9          HH11      ARG   9  30.117   1.948   8.550
   57   HH12  ARG   9          HH12      ARG   9  28.808   1.496   9.606
   58   HH21  ARG   9          HH21      ARG   9  29.684  -1.914   9.644
   59   HH22  ARG   9          HH22      ARG   9  28.571  -0.717  10.246
   60    H    LEU  10           H        LEU  10  31.491   3.752   2.884
   61    HA   LEU  10           HA       LEU  10  34.175   3.516   1.875
   62    HG   LEU  10           HG       LEU  10  31.943   1.645   1.503
   63    HB2  LEU  10           HB2      LEU  10  31.517   3.937   0.510
   64    HB3  LEU  10           HB3      LEU  10  33.046   3.773  -0.337
   65   HD11  LEU  10          HD11      LEU  10  30.351   1.610  -0.160
   66   HD12  LEU  10          HD12      LEU  10  31.560   0.493  -0.792
   67   HD13  LEU  10          HD13      LEU  10  31.484   2.145  -1.404
   68   HD21  LEU  10          HD21      LEU  10  34.288   1.418   1.223
   69   HD22  LEU  10          HD22      LEU  10  34.177   1.726  -0.510
   70   HD23  LEU  10          HD23      LEU  10  33.527   0.232   0.163
   71    H    ILE  11           H        ILE  11  32.025   6.006   2.827
   72    HA   ILE  11           HA       ILE  11  33.209   8.118   1.295
   73    HB   ILE  11           HB       ILE  11  30.963   8.212   2.517
   74   HG12  ILE  11          HG12      ILE  11  32.351  10.204   1.604
   75   HG13  ILE  11          HG13      ILE  11  31.003  10.533   2.684
   76   HG21  ILE  11          HG21      ILE  11  31.331   9.233   4.910
   77   HG22  ILE  11          HG22      ILE  11  32.806   8.269   4.848
   78   HG23  ILE  11          HG23      ILE  11  31.235   7.490   4.661
   79   HD11  ILE  11          HD11      ILE  11  33.939  10.679   3.241
   80   HD12  ILE  11          HD12      ILE  11  32.756  10.555   4.546
   81   HD13  ILE  11          HD13      ILE  11  32.702  11.924   3.434
   82    H    GLU  12           H        GLU  12  34.007   6.236   4.040
   83    HA   GLU  12           HA       GLU  12  36.284   7.953   4.705
   84    HB2  GLU  12           HB2      GLU  12  35.363   5.433   6.104
   85    HB3  GLU  12           HB3      GLU  12  36.606   6.546   6.659
   86    HG2  GLU  12           HG2      GLU  12  34.831   8.319   6.761
   87    HG3  GLU  12           HG3      GLU  12  33.648   7.041   6.467
   88    H    SER  13           H        SER  13  35.731   4.451   4.243
   89    HA   SER  13           HA       SER  13  38.510   4.009   3.885
   90    HG   SER  13           HG       SER  13  37.043   1.459   5.693
   91    HB2  SER  13           HB2      SER  13  36.210   2.088   3.513
   92    HB3  SER  13           HB3      SER  13  37.910   1.648   3.681
   93    H    LEU  14           H        LEU  14  35.988   4.560   1.536
   94    HA   LEU  14           HA       LEU  14  37.630   3.362  -0.575
   95    HG   LEU  14           HG       LEU  14  36.412   4.572  -2.871
   96    HB2  LEU  14           HB2      LEU  14  35.188   2.996  -0.652
   97    HB3  LEU  14           HB3      LEU  14  34.932   4.732  -0.693
   98   HD11  LEU  14          HD11      LEU  14  35.041   1.977  -3.223
   99   HD12  LEU  14          HD12      LEU  14  36.527   1.983  -2.272
  100   HD13  LEU  14          HD13      LEU  14  36.539   2.582  -3.932
  101   HD21  LEU  14          HD21      LEU  14  33.498   3.903  -2.579
  102   HD22  LEU  14          HD22      LEU  14  34.269   4.145  -4.146
  103   HD23  LEU  14          HD23      LEU  14  34.237   5.456  -2.968
  104    H    SER  15           H        SER  15  36.194   6.359   0.478
  105    HA   SER  15           HA       SER  15  37.319   7.960  -1.526
  106    HG   SER  15           HG       SER  15  36.669  10.182  -1.291
  107    HB2  SER  15           HB2      SER  15  35.321   8.574  -0.182
  108    HB3  SER  15           HB3      SER  15  36.380   8.849   1.201
  109    H    GLN  16           H        GLN  16  38.591   6.792   1.492
  110    HA   GLN  16           HA       GLN  16  40.598   8.625   2.060
  111    HB2  GLN  16           HB2      GLN  16  40.185   6.828   3.585
  112    HB3  GLN  16           HB3      GLN  16  40.526   5.620   2.359
  113    HG2  GLN  16           HG2      GLN  16  42.707   7.497   3.096
  114    HG3  GLN  16           HG3      GLN  16  42.260   6.248   4.255
  115   HE21  GLN  16          HE21      GLN  16  44.341   6.930   1.829
  116   HE22  GLN  16          HE22      GLN  16  44.675   5.331   1.256
  117    H    MET  17           H        MET  17  40.787   5.769  -0.047
  118    HA   MET  17           HA       MET  17  43.411   6.601  -0.903
  119    HB2  MET  17           HB2      MET  17  43.145   4.451  -2.347
  120    HB3  MET  17           HB3      MET  17  43.403   4.326  -0.614
  121    HG2  MET  17           HG2      MET  17  40.991   4.005  -0.293
  122    HG3  MET  17           HG3      MET  17  40.762   4.090  -2.042
  123    HE1  MET  17           HE1      MET  17  41.606   1.399  -3.664
  124    HE2  MET  17           HE2      MET  17  43.284   1.428  -3.126
  125    HE3  MET  17           HE3      MET  17  42.450   2.938  -3.490
  126    H    LEU  18           H        LEU  18  40.141   6.730  -2.170
  127    HA   LEU  18           HA       LEU  18  40.987   7.054  -4.886
  128    HG   LEU  18           HG       LEU  18  38.674   5.300  -3.816
  129    HB2  LEU  18           HB2      LEU  18  38.388   7.667  -3.505
  130    HB3  LEU  18           HB3      LEU  18  38.648   7.974  -5.212
  131   HD11  LEU  18          HD11      LEU  18  36.597   5.050  -4.548
  132   HD12  LEU  18          HD12      LEU  18  37.032   5.583  -6.170
  133   HD13  LEU  18          HD13      LEU  18  36.606   6.771  -4.936
  134   HD21  LEU  18          HD21      LEU  18  40.360   4.982  -5.360
  135   HD22  LEU  18          HD22      LEU  18  39.651   6.106  -6.522
  136   HD23  LEU  18          HD23      LEU  18  38.928   4.516  -6.279
  137    H    SER  19           H        SER  19  40.987   9.190  -2.214
  138    HA   SER  19           HA       SER  19  41.006  11.546  -3.944
  139    HG   SER  19           HG       SER  19  40.361  10.490  -0.428
  140    HB2  SER  19           HB2      SER  19  41.163  12.801  -1.762
  141    HB3  SER  19           HB3      SER  19  39.703  11.827  -1.952
  142    H    MET  20           H        MET  20  43.179   9.428  -2.309
  143    HA   MET  20           HA       MET  20  45.369  11.330  -2.307
  144    HB2  MET  20           HB2      MET  20  45.281   8.393  -1.593
  145    HB3  MET  20           HB3      MET  20  46.711   9.405  -1.459
  146    HG2  MET  20           HG2      MET  20  45.585  10.815   0.168
  147    HG3  MET  20           HG3      MET  20  44.126   9.836   0.018
  148    HE1  MET  20           HE1      MET  20  48.092   8.824   1.960
  149    HE2  MET  20           HE2      MET  20  47.810   9.778   0.503
  150    HE3  MET  20           HE3      MET  20  47.930   8.022   0.398
  151    H    GLY  21           H        GLY  21  44.234   8.638  -4.220
  152    HA2  GLY  21           HA2      GLY  21  44.898   8.526  -6.568
  153    HA3  GLY  21           HA3      GLY  21  46.496   9.081  -6.063
  154    H    PHE  22           H        PHE  22  44.542   6.686  -4.404
  155    HA   PHE  22           HA       PHE  22  46.488   4.624  -5.162
  156    HD1  PHE  22           HD2      PHE  22  47.879   5.667  -4.355
  157    HD2  PHE  22           HD1      PHE  22  46.443   4.404  -0.554
  158    HE1  PHE  22           HE2      PHE  22  49.993   6.378  -3.324
  159    HE2  PHE  22           HE1      PHE  22  48.553   5.118   0.483
  160    HZ   PHE  22           HZ       PHE  22  50.336   6.100  -0.900
  161    HB2  PHE  22           HB2      PHE  22  44.916   4.992  -2.602
  162    HB3  PHE  22           HB3      PHE  22  45.661   3.456  -3.037
  163    H    SER  23           H        SER  23  45.597   2.625  -5.780
  164    HA   SER  23           HA       SER  23  42.702   2.691  -6.182
  165    HG   SER  23           HG       SER  23  44.594   4.194  -8.401
  166    HB2  SER  23           HB2      SER  23  44.782   2.064  -8.292
  167    HB3  SER  23           HB3      SER  23  43.042   1.875  -8.510
  168    H    ASP  24           H        ASP  24  42.175   0.402  -7.400
  169    HA   ASP  24           HA       ASP  24  43.048  -1.606  -5.514
  170    HB2  ASP  24           HB2      ASP  24  41.533  -3.126  -6.878
  171    HB3  ASP  24           HB3      ASP  24  40.751  -1.778  -6.059
  172    H    GLU  25           H        GLU  25  44.714  -2.867  -5.769
  173    HA   GLU  25           HA       GLU  25  46.406  -2.640  -8.020
  174    HB2  GLU  25           HB2      GLU  25  47.103  -3.168  -5.644
  175    HB3  GLU  25           HB3      GLU  25  46.511  -4.802  -5.916
  176    HG2  GLU  25           HG2      GLU  25  48.891  -4.750  -6.189
  177    HG3  GLU  25           HG3      GLU  25  48.133  -5.050  -7.753
  178    H    GLY  26           H        GLY  26  44.037  -4.979  -7.039
  179    HA2  GLY  26           HA2      GLY  26  44.155  -6.152  -9.727
  180    HA3  GLY  26           HA3      GLY  26  44.234  -7.228  -8.337
  181    H    GLY  27           H        GLY  27  42.275  -4.403  -8.031
  182    HA2  GLY  27           HA2      GLY  27  39.967  -4.121  -8.395
  183    HA3  GLY  27           HA3      GLY  27  39.860  -5.811  -8.870
  184    H    TRP  28           H        TRP  28  41.545  -5.005  -5.974
  185    HA   TRP  28           HA       TRP  28  39.574  -6.470  -4.446
  186    HD1  TRP  28           HD1      TRP  28  43.984  -6.158  -5.176
  187    HE1  TRP  28           HE1      TRP  28  45.476  -4.105  -4.755
  188    HE3  TRP  28           HE3      TRP  28  41.121  -3.759  -1.690
  189    HZ2  TRP  28           HZ2      TRP  28  45.432  -1.767  -3.181
  190    HZ3  TRP  28           HZ3      TRP  28  41.913  -1.620  -0.776
  191    HH2  TRP  28           HH2      TRP  28  44.025  -0.647  -1.505
  192    HB2  TRP  28           HB2      TRP  28  41.275  -6.305  -2.602
  193    HB3  TRP  28           HB3      TRP  28  41.855  -7.121  -4.056
  194    H    LEU  29           H        LEU  29  40.285  -3.198  -5.090
  195    HA   LEU  29           HA       LEU  29  39.679  -2.084  -2.576
  196    HG   LEU  29           HG       LEU  29  37.768   0.130  -4.233
  197    HB2  LEU  29           HB2      LEU  29  40.689  -0.576  -3.992
  198    HB3  LEU  29           HB3      LEU  29  39.715  -1.028  -5.371
  199   HD11  LEU  29          HD11      LEU  29  38.442   0.215  -1.979
  200   HD12  LEU  29          HD12      LEU  29  38.499   1.878  -2.562
  201   HD13  LEU  29          HD13      LEU  29  39.991   0.953  -2.385
  202   HD21  LEU  29          HD21      LEU  29  39.799   1.112  -5.829
  203   HD22  LEU  29          HD22      LEU  29  39.653   2.308  -4.540
  204   HD23  LEU  29          HD23      LEU  29  38.245   1.882  -5.513
  205    H    THR  30           H        THR  30  37.742  -3.571  -4.935
  206    HA   THR  30           HA       THR  30  35.279  -2.638  -3.669
  207    HB   THR  30           HB       THR  30  34.785  -2.650  -5.904
  208    HG1  THR  30           HG1      THR  30  34.007  -4.897  -4.662
  209   HG21  THR  30          HG21      THR  30  36.832  -4.787  -6.173
  210   HG22  THR  30          HG22      THR  30  36.645  -3.274  -7.061
  211   HG23  THR  30          HG23      THR  30  35.574  -4.636  -7.398
  212    H    ARG  31           H        ARG  31  37.446  -5.368  -3.808
  213    HA   ARG  31           HA       ARG  31  35.481  -7.134  -2.573
  214    HE   ARG  31           HE       ARG  31  35.119  -9.378  -4.301
  215    HB2  ARG  31           HB2      ARG  31  38.318  -7.927  -3.154
  216    HB3  ARG  31           HB3      ARG  31  36.887  -8.938  -3.077
  217    HG2  ARG  31           HG2      ARG  31  37.763  -7.109  -5.290
  218    HG3  ARG  31           HG3      ARG  31  37.475  -8.848  -5.339
  219    HD2  ARG  31           HD2      ARG  31  35.424  -6.656  -5.080
  220    HD3  ARG  31           HD3      ARG  31  35.670  -7.735  -6.454
  221   HH11  ARG  31          HH11      ARG  31  33.550  -6.767  -5.998
  222   HH12  ARG  31          HH12      ARG  31  31.939  -7.311  -5.644
  223   HH21  ARG  31          HH21      ARG  31  33.002 -10.131  -3.832
  224   HH22  ARG  31          HH22      ARG  31  31.632  -9.241  -4.415
  225    H    LEU  32           H        LEU  32  38.893  -6.477  -1.944
  226    HA   LEU  32           HA       LEU  32  39.381  -7.597   0.418
  227    HG   LEU  32           HG       LEU  32  42.530  -5.635   0.503
  228    HB2  LEU  32           HB2      LEU  32  40.876  -6.187  -1.063
  229    HB3  LEU  32           HB3      LEU  32  40.265  -4.783  -0.213
  230   HD11  LEU  32          HD11      LEU  32  42.057  -5.383   2.925
  231   HD12  LEU  32          HD12      LEU  32  40.336  -5.399   2.543
  232   HD13  LEU  32          HD13      LEU  32  41.365  -4.110   1.919
  233   HD21  LEU  32          HD21      LEU  32  42.067  -8.013   0.422
  234   HD22  LEU  32          HD22      LEU  32  40.875  -7.837   1.712
  235   HD23  LEU  32          HD23      LEU  32  42.579  -7.527   2.040
  236    H    LEU  33           H        LEU  33  38.135  -4.262   0.205
  237    HA   LEU  33           HA       LEU  33  37.968  -3.722   2.901
  238    HG   LEU  33           HG       LEU  33  38.421  -2.157   0.210
  239    HB2  LEU  33           HB2      LEU  33  36.088  -2.770   0.736
  240    HB3  LEU  33           HB3      LEU  33  36.261  -2.039   2.323
  241   HD11  LEU  33          HD11      LEU  33  36.312  -0.206   0.864
  242   HD12  LEU  33          HD12      LEU  33  37.150  -0.511  -0.656
  243   HD13  LEU  33          HD13      LEU  33  37.928   0.449   0.603
  244   HD21  LEU  33          HD21      LEU  33  38.332  -0.929   2.955
  245   HD22  LEU  33          HD22      LEU  33  39.530  -0.508   1.733
  246   HD23  LEU  33          HD23      LEU  33  39.448  -2.157   2.357
  247    H    GLN  34           H        GLN  34  35.238  -4.664   0.865
  248    HA   GLN  34           HA       GLN  34  33.176  -4.826   2.513
  249    HB2  GLN  34           HB2      GLN  34  33.965  -6.842   0.433
  250    HB3  GLN  34           HB3      GLN  34  32.376  -6.816   1.181
  251    HG2  GLN  34           HG2      GLN  34  33.550  -4.484  -0.312
  252    HG3  GLN  34           HG3      GLN  34  32.543  -5.715  -1.063
  253   HE21  GLN  34          HE21      GLN  34  31.378  -5.499   1.956
  254   HE22  GLN  34          HE22      GLN  34  30.161  -4.292   1.732
  255    H    THR  35           H        THR  35  35.316  -7.657   2.112
  256    HA   THR  35           HA       THR  35  33.824  -9.146   3.976
  257    HB   THR  35           HB       THR  35  35.819 -10.777   3.695
  258    HG1  THR  35           HG1      THR  35  37.413  -9.547   2.880
  259   HG21  THR  35          HG21      THR  35  34.525 -11.718   2.177
  260   HG22  THR  35          HG22      THR  35  34.952 -10.482   0.994
  261   HG23  THR  35          HG23      THR  35  33.591 -10.224   2.083
  262    H    LYS  36           H        LYS  36  36.018  -6.775   4.725
  263    HA   LYS  36           HA       LYS  36  36.842  -8.217   7.162
  264    HB2  LYS  36           HB2      LYS  36  38.125  -5.848   5.796
  265    HB3  LYS  36           HB3      LYS  36  38.665  -6.539   7.323
  266    HG2  LYS  36           HG2      LYS  36  39.173  -8.639   6.227
  267    HG3  LYS  36           HG3      LYS  36  38.556  -8.009   4.697
  268    HD2  LYS  36           HD2      LYS  36  40.317  -6.410   4.557
  269    HD3  LYS  36           HD3      LYS  36  40.841  -6.755   6.210
  270    HE2  LYS  36           HE2      LYS  36  40.947  -8.665   3.873
  271    HE3  LYS  36           HE3      LYS  36  42.319  -7.802   4.567
  272    HZ1  LYS  36           HZ1      LYS  36  42.571  -9.537   5.905
  273    HZ2  LYS  36           HZ2      LYS  36  41.093 -10.224   5.429
  274    HZ3  LYS  36           HZ3      LYS  36  41.132  -9.090   6.690
  275    H    ASN  37           H        ASN  37  35.242  -5.446   5.920
  276    HA   ASN  37           HA       ASN  37  33.382  -4.673   7.439
  277    HB2  ASN  37           HB2      ASN  37  33.970  -3.422   9.437
  278    HB3  ASN  37           HB3      ASN  37  34.626  -5.049   9.568
  279   HD21  ASN  37          HD21      ASN  37  36.482  -4.998  10.598
  280   HD22  ASN  37          HD22      ASN  37  37.725  -3.810  10.427
  281    H    TYR  38           H        TYR  38  35.382  -3.968   5.241
  282    HA   TYR  38           HA       TYR  38  35.787  -2.248   3.816
  283    HD1  TYR  38           HD1      TYR  38  32.522  -2.498   5.749
  284    HD2  TYR  38           HD2      TYR  38  33.442  -0.205   2.286
  285    HE1  TYR  38           HE1      TYR  38  30.389  -3.182   4.736
  286    HE2  TYR  38           HE2      TYR  38  31.315  -0.886   1.265
  287    HH   TYR  38           HH       TYR  38  28.848  -1.797   2.599
  288    HB2  TYR  38           HB2      TYR  38  34.211  -0.499   5.724
  289    HB3  TYR  38           HB3      TYR  38  34.816  -0.014   4.147
  290    H    ASP  39           H        ASP  39  37.691  -3.118   5.256
  291    HA   ASP  39           HA       ASP  39  38.723  -1.038   7.019
  292    HB2  ASP  39           HB2      ASP  39  38.626  -3.272   7.925
  293    HB3  ASP  39           HB3      ASP  39  39.569  -3.909   6.581
  294    H    ILE  40           H        ILE  40  40.324   0.272   6.504
  295    HA   ILE  40           HA       ILE  40  41.861  -0.233   4.079
  296    HB   ILE  40           HB       ILE  40  42.864   2.025   4.517
  297   HG12  ILE  40          HG12      ILE  40  42.057   1.897   7.028
  298   HG13  ILE  40          HG13      ILE  40  42.143   3.440   6.192
  299   HG21  ILE  40          HG21      ILE  40  40.017   2.628   4.353
  300   HG22  ILE  40          HG22      ILE  40  40.539   1.321   3.291
  301   HG23  ILE  40          HG23      ILE  40  41.311   2.905   3.186
  302   HD11  ILE  40          HD11      ILE  40  39.995   3.799   6.535
  303   HD12  ILE  40          HD12      ILE  40  39.948   2.329   7.511
  304   HD13  ILE  40          HD13      ILE  40  39.567   2.261   5.789
  305    H    GLY  41           H        GLY  41  41.985  -0.885   7.334
  306    HA2  GLY  41           HA2      GLY  41  44.690  -0.499   7.939
  307    HA3  GLY  41           HA3      GLY  41  43.655  -1.698   8.687
  308    H    ALA  42           H        ALA  42  43.021  -3.063   6.295
  309    HA   ALA  42           HA       ALA  42  45.564  -4.434   5.791
  310    HB1  ALA  42           HB1      ALA  42  42.956  -5.403   6.286
  311    HB2  ALA  42           HB2      ALA  42  44.418  -6.331   5.945
  312    HB3  ALA  42           HB3      ALA  42  43.368  -5.821   4.623
  313    H    ALA  43           H        ALA  43  43.187  -2.448   4.350
  314    HA   ALA  43           HA       ALA  43  43.661  -3.106   1.621
  315    HB1  ALA  43           HB1      ALA  43  42.769  -0.400   2.580
  316    HB2  ALA  43           HB2      ALA  43  41.688  -1.794   2.553
  317    HB3  ALA  43           HB3      ALA  43  42.405  -1.203   1.053
  318    H    LEU  44           H        LEU  44  45.215  -0.934   3.903
  319    HA   LEU  44           HA       LEU  44  46.752   0.526   2.037
  320    HG   LEU  44           HG       LEU  44  47.321   2.623   3.379
  321    HB2  LEU  44           HB2      LEU  44  46.793   0.103   4.964
  322    HB3  LEU  44           HB3      LEU  44  48.317   0.593   4.240
  323   HD11  LEU  44          HD11      LEU  44  44.757   1.394   4.326
  324   HD12  LEU  44          HD12      LEU  44  45.143   2.118   2.762
  325   HD13  LEU  44          HD13      LEU  44  44.929   3.145   4.180
  326   HD21  LEU  44          HD21      LEU  44  48.018   2.317   5.861
  327   HD22  LEU  44          HD22      LEU  44  46.291   2.487   6.175
  328   HD23  LEU  44          HD23      LEU  44  47.173   3.780   5.361
  329    H    ASP  45           H        ASP  45  47.175  -2.603   3.490
  330    HA   ASP  45           HA       ASP  45  49.887  -3.066   2.896
  331    HB2  ASP  45           HB2      ASP  45  48.684  -4.615   4.287
  332    HB3  ASP  45           HB3      ASP  45  47.507  -4.926   3.017
  333    H    THR  46           H        THR  46  46.963  -3.347   0.942
  334    HA   THR  46           HA       THR  46  48.506  -4.347  -1.297
  335    HB   THR  46           HB       THR  46  46.150  -4.469  -2.334
  336    HG1  THR  46           HG1      THR  46  44.894  -3.277  -1.055
  337   HG21  THR  46          HG21      THR  46  45.514  -6.391  -0.717
  338   HG22  THR  46          HG22      THR  46  47.109  -6.094  -0.027
  339   HG23  THR  46          HG23      THR  46  46.951  -6.536  -1.727
  340    H    ILE  47           H        ILE  47  47.713  -1.280  -0.211
  341    HA   ILE  47           HA       ILE  47  47.749  -0.245  -2.961
  342    HB   ILE  47           HB       ILE  47  47.350   2.045  -1.801
  343   HG12  ILE  47          HG12      ILE  47  46.210   0.131   0.235
  344   HG13  ILE  47          HG13      ILE  47  47.483   1.324   0.497
  345   HG21  ILE  47          HG21      ILE  47  44.779   1.342  -1.790
  346   HG22  ILE  47          HG22      ILE  47  45.450  -0.065  -2.617
  347   HG23  ILE  47          HG23      ILE  47  45.711   1.549  -3.273
  348   HD11  ILE  47          HD11      ILE  47  44.874   1.706   1.079
  349   HD12  ILE  47          HD12      ILE  47  44.962   2.412  -0.534
  350   HD13  ILE  47          HD13      ILE  47  46.023   3.003   0.746
  351    H    GLN  48           H        GLN  48  50.016  -1.318  -2.095
  352    HA   GLN  48           HA       GLN  48  52.215  -0.924  -2.433
  353    HB2  GLN  48           HB2      GLN  48  51.570   2.030  -2.366
  354    HB3  GLN  48           HB3      GLN  48  53.076   1.306  -2.912
  355    HG2  GLN  48           HG2      GLN  48  52.256   1.180  -4.963
  356    HG3  GLN  48           HG3      GLN  48  50.988   0.099  -4.386
  357   HE21  GLN  48          HE21      GLN  48  48.976   0.764  -4.660
  358   HE22  GLN  48          HE22      GLN  48  48.459   2.405  -4.867
  359    H    TYR  49           H        TYR  49  51.105  -1.270   0.181
  360    HA   TYR  49           HA       TYR  49  53.439  -0.345   1.662
  361    HD1  TYR  49           HD1      TYR  49  53.885   1.799   2.831
  362    HD2  TYR  49           HD2      TYR  49  49.763   2.008   1.811
  363    HE1  TYR  49           HE1      TYR  49  54.142   4.187   2.314
  364    HE2  TYR  49           HE2      TYR  49  50.007   4.397   1.292
  365    HH   TYR  49           HH       TYR  49  52.757   5.876   0.671
  366    HB2  TYR  49           HB2      TYR  49  50.596   0.033   2.625
  367    HB3  TYR  49           HB3      TYR  49  52.000   0.109   3.688
  368    H    SER  50           H        SER  50  53.450  -2.770   0.759
  369    HA   SER  50           HA       SER  50  52.041  -4.555   2.578
  370    HG   SER  50           HG       SER  50  53.196  -4.640  -1.084
  371    HB2  SER  50           HB2      SER  50  52.991  -6.323   0.979
  372    HB3  SER  50           HB3      SER  50  51.776  -5.214   0.338
  373    H    LYS  51           H        LYS  51  54.501  -3.007   3.388
  374    HA   LYS  51           HA       LYS  51  56.017  -5.355   4.294
  375    HB2  LYS  51           HB2      LYS  51  57.232  -3.993   2.561
  376    HB3  LYS  51           HB3      LYS  51  57.215  -2.646   3.692
  377    HG2  LYS  51           HG2      LYS  51  58.665  -3.733   5.180
  378    HG3  LYS  51           HG3      LYS  51  58.410  -5.304   4.414
  379    HD2  LYS  51           HD2      LYS  51  60.579  -4.458   3.784
  380    HD3  LYS  51           HD3      LYS  51  59.520  -4.441   2.374
  381    HE2  LYS  51           HE2      LYS  51  60.789  -2.400   2.430
  382    HE3  LYS  51           HE3      LYS  51  59.099  -2.031   2.776
  383    HZ1  LYS  51           HZ1      LYS  51  60.971  -2.507   5.005
  384    HZ2  LYS  51           HZ2      LYS  51  59.552  -1.569   4.973
  385    HZ3  LYS  51           HZ3      LYS  51  60.965  -1.000   4.221
  386    H    HIS  52           H        HIS  52  54.950  -5.465   6.233
  387    HA   HIS  52           HA       HIS  52  55.045  -3.091   7.947
  388    HD1  HIS  52           HD1      HIS  52  52.682  -4.021   5.655
  389    HD2  HIS  52           HD2      HIS  52  51.443  -2.717   9.401
  390    HE1  HIS  52           HE1      HIS  52  50.783  -2.404   5.247
  391    HB2  HIS  52           HB2      HIS  52  53.312  -5.563   8.005
  392    HB3  HIS  52           HB3      HIS  52  53.430  -4.484   9.389