*HEADER    PROTEIN BINDING                         07-DEC-07   2JY7              
*TITLE     NMR STRUCTURE OF THE UBIQUITIN ASSOCIATED (UBA) DOMAIN OF             
*TITLE    2 P62 (SQSTM1). RDC REFINED                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UBIQUITIN-BINDING PROTEIN P62;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UBA DOMAIN;                                                
*COMPND   5 SYNONYM: SEQUESTOSOME-1, PHOSPHOTYROSINE-INDEPENDENT                 
*COMPND   6 LIGAND FOR THE LCK SH2 DOMAIN OF 62 KDA, EBI3-ASSOCIATED             
*COMPND   7 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;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VARIANT: (DE3);                                    
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PGEX-4T-1                                  
*KEYWDS    UBIQUITIN BINDING, UBIQUITIN ASSOCIATED DOMAIN, HELICAL               
*KEYWDS   2 BUNDLE, THREE HELICES, ALTERNATIVE SPLICING, APOPTOSIS,              
*KEYWDS   3 CYTOPLASM, DIFFERENTIATION, DISEASE MUTATION, ENDOSOME,              
*KEYWDS   4 IMMUNE RESPONSE, METAL-BINDING, NUCLEUS, PHOSPHOPROTEIN,             
*KEYWDS   5 POLYMORPHISM, ZINC, ZINC-FINGER, PROTEIN BINDING                     
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    J.E.LONG, R.LAYFIELD, M.S.SEARLE                                      
*REVDAT   1   18-DEC-07 2JY7    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 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 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 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 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 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 HB2 ) 4.0 2.2 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 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 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 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 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 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 12 and name HN ) ( resid 7 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 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 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 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 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 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 21 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 23 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 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 26 and name HN ) 5.0 3.2 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 30 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 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 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 35 and name HN ) 5.0 3.2 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 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 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 37 and name HN ) 2.8 1 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 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 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 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 44 and name HN ) 2.8 1 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 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 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 48 and name HN ) 4.0 2.2 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 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 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 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 ) 5.0 3.2 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 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 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 8 and name HA ) ( resid 9 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 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 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 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 50 and name HA ) ( resid 50 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 HN ) ( resid 6 and name HB# ) 2.5 0.7 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 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 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 HB2 ) ( resid 10 and name HD2# ) 4.0 2.2 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 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 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 HB2 ) ( resid 14 and name HA ) 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 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 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 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 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 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 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 HB2 ) 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 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 HB1 ) ( resid 24 and name HB2) 2.8 1 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 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 28 and name HB1 ) ( resid 28 and name HB2 ) 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 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 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 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 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 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 HB2 ) ( resid 29 and name HD1# ) 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 HG1 ) ( resid 30 and name HB ) 2.8 1 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 HG2 ) 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 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 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 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 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 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 HD1# ) 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 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 HG2 ) ( resid 34 and name HB1 ) 4.0 2.2 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 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 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 HB2 ) 2.5 0.7 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 HB2 ) ( resid 39 and name HB1 ) 2.5 0.7 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 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 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 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 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 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 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 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 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 HG1 ) ( resid 46 and name HA ) 2.8 1 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 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 41 and name HN ) ( resid 42 and name HB# ) 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 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 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 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 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 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 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 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 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 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 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 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 HZ2 ) ( resid 47 and name HG2# ) 6.0 4.2 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 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 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 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
assign ( resid   5  and name N   )
       ( resid   5  and name HN  )   1.138   1.000

assign ( resid   6  and name N   )
       ( resid   6  and name HN  )   3.355  1.000
                                  
assign ( resid   9  and name N   )
       ( resid   9  and name HN  )   0.331   1.000
                                  
assign ( resid  10  and name N   )
       ( resid  10  and name HN  )  -4.130   1.000
                                                                    
assign ( resid  11  and name N   )
       ( resid  11  and name HN  )   12.215   1.000
                                                                    
assign ( resid  12  and name N   )
       ( resid  12  and name HN  )   2.549   1.000
                                                                    
assign ( resid  13  and name N   )
       ( resid  13  and name HN  )  -0.196   1.000
                                                                    
assign ( resid  14  and name N   )
       ( resid  14  and name HN  )  -3.287   1.000
                                                                    
assign ( resid  15  and name N   )
       ( resid  15  and name HN  )  -1.091   1.000
                                                                    
assign ( resid  16  and name N   )
       ( resid  16  and name HN  )   3.197   1.000
                                                                    
assign ( resid  17  and name N   )
       ( resid  17  and name HN  )  -1.787   1.000
                                  
assign ( resid  18  and name N   )
       ( resid  18  and name HN  )  -3.592   1.000

assign ( resid  19  and name N   )
       ( resid  19  and name HN  )   2.447   1.000
                                  
assign ( resid  20  and name N   )
       ( resid  20  and name HN  )  -0.428   1.000
                                                                   
assign ( resid  21  and name N   )
       ( resid  21  and name HN  )  -5.785   1.000
                                                                   
assign ( resid  22  and name N   )
       ( resid  22  and name HN  )  -4.397   1.000
                                                                   
assign ( resid  23  and name N   )
       ( resid  23  and name HN  )  -3.890   1.000
                                                                   
assign ( resid  24  and name N   )
       ( resid  24  and name HN  )   4.434   1.000
                                                                   
assign ( resid  25  and name N   )
       ( resid  25  and name HN  )  -3.253   1.000
                                                                   
assign ( resid  26  and name N   )
       ( resid  26  and name HN  )   4.876   1.000
                                                                   
assign ( resid  27  and name N   )
       ( resid  27  and name HN  )   3.361   1.000
                                   
assign ( resid  28  and name N   )
       ( resid  28  and name HN  )   9.530   1.000
                                  
assign ( resid  29  and name N   )
       ( resid  29  and name HN  )   11.338   1.000
                              
assign ( resid  30  and name N   )
       ( resid  30  and name HN  )   9.155   1.000
                               
assign ( resid  31  and name N   )
       ( resid  31  and name HN  )   6.613   1.000
                                                                    
assign ( resid  33  and name N   )
       ( resid  33  and name HN  )   11.368   1.000
                                                                     
assign ( resid  34  and name N   )
       ( resid  34  and name HN  )   6.424   1.000
                                                                    
assign ( resid  35  and name N   )
       ( resid  35  and name HN  )   7.410   1.000
                                                                    
assign ( resid  36  and name N   )
       ( resid  36  and name HN  )  -2.102   1.000
                                                                                                      
assign ( resid  37  and name N   )
       ( resid  37  and name HN  )  -3.540   1.000
                                                                                                      
assign ( resid  38  and name N   )
       ( resid  38  and name HN  )  -5.408   1.000
                                                                                                      
assign ( resid  39  and name N   )
       ( resid  39  and name HN  )  -1.915   1.000
                                                                                                      
assign ( resid  40  and name N   )
       ( resid  40  and name HN  )  -8.102   1.000
                                  
assign ( resid  41  and name N   )
       ( resid  41  and name HN  )  -4.678   1.000
                                  
assign ( resid  42  and name N   )
       ( resid  42  and name HN  )  -5.978   1.000
                                  
assign ( resid  43  and name N   )
       ( resid  43  and name HN  )  -8.035   1.000
                                  
assign ( resid  44  and name N   )
       ( resid  44  and name HN  )  -7.105   1.000
                                  
assign ( resid  45  and name N   )
       ( resid  45  and name HN  )  -5.284   1.000
                                  
assign ( resid  46  and name N   )
       ( resid  46  and name HN  )  -6.884   1.000
                                  
assign ( resid  47  and name N   )
       ( resid  47  and name HN  )  -8.259  1.000
                                  
assign ( resid  48  and name N   )
       ( resid  48  and name HN  )   4.758   1.000
                                  
assign ( resid  49  and name N   )
       ( resid  49  and name HN  )  -1.440   1.000
                                  
assign ( resid  50  and name N   )
       ( resid  50  and name HN  )   4.252   1.000
                                  
assign ( resid  51  and name N   )
       ( resid  51  and name HN  )   3.299   1.000
                                  
assign ( resid  52  and name N   )
       ( resid  52  and name HN  )   0.849   1.000
                                  
!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


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1H       GLY   1  31.136 -16.650   2.204
    2    H2   GLY   1           2H       GLY   1  32.127 -17.863   2.841
    3    H3   GLY   1           3H       GLY   1  32.654 -16.950   1.519
    4    HA2  GLY   1           HA2      GLY   1  32.429 -16.160   4.348
    5    HA3  GLY   1           HA3      GLY   1  33.810 -16.009   3.273
    6    H    SER   2           H        SER   2  34.229 -14.012   2.627
    7    HA   SER   2           HA       SER   2  32.042 -12.046   2.647
    8    HG   SER   2           HG       SER   2  35.385 -11.232   1.679
    9    HB2  SER   2           HB2      SER   2  33.724 -10.335   2.946
   10    HB3  SER   2           HB3      SER   2  34.010 -11.608   4.133
   11    HA   PRO   3           HA       PRO   3  32.839 -12.199  -1.796
   12    HB2  PRO   3           HB2      PRO   3  30.220 -12.049  -2.511
   13    HB3  PRO   3           HB3      PRO   3  31.014 -13.554  -2.047
   14    HG2  PRO   3           HG2      PRO   3  28.990 -12.024  -0.613
   15    HG3  PRO   3           HG3      PRO   3  29.561 -13.672  -0.318
   16    HD2  PRO   3           HD2      PRO   3  30.295 -11.203   1.041
   17    HD3  PRO   3           HD3      PRO   3  30.670 -12.879   1.489
   18    HA   PRO   4           HA       PRO   4  32.714  -7.828  -2.521
   19    HB2  PRO   4           HB2      PRO   4  32.950  -7.848  -5.235
   20    HB3  PRO   4           HB3      PRO   4  34.303  -8.167  -4.144
   21    HG2  PRO   4           HG2      PRO   4  32.574 -10.103  -5.634
   22    HG3  PRO   4           HG3      PRO   4  34.331 -10.123  -5.397
   23    HD2  PRO   4           HD2      PRO   4  32.655 -11.670  -3.944
   24    HD3  PRO   4           HD3      PRO   4  34.163 -11.012  -3.275
   25    H    GLU   5           H        GLU   5  30.278  -8.345  -1.858
   26    HA   GLU   5           HA       GLU   5  28.653  -7.094  -3.932
   27    HB2  GLU   5           HB2      GLU   5  26.809  -8.715  -3.564
   28    HB3  GLU   5           HB3      GLU   5  28.229  -9.442  -4.302
   29    HG2  GLU   5           HG2      GLU   5  28.876 -10.440  -2.223
   30    HG3  GLU   5           HG3      GLU   5  27.595  -9.585  -1.366
   31    H    ALA   6           H        ALA   6  29.801  -6.272  -1.363
   32    HA   ALA   6           HA       ALA   6  28.999  -4.652   0.109
   33    HB1  ALA   6           HB1      ALA   6  26.815  -4.107   0.287
   34    HB2  ALA   6           HB2      ALA   6  26.284  -5.789   0.350
   35    HB3  ALA   6           HB3      ALA   6  26.697  -5.051  -1.198
   36    H    ASP   7           H        ASP   7  30.437  -6.733   0.804
   37    HA   ASP   7           HA       ASP   7  29.143  -8.115   3.026
   38    HB2  ASP   7           HB2      ASP   7  30.854  -9.675   2.930
   39    HB3  ASP   7           HB3      ASP   7  30.770  -9.167   1.250
   40    HA   PRO   8           HA       PRO   8  30.460  -5.791   6.511
   41    HB2  PRO   8           HB2      PRO   8  32.571  -7.908   6.798
   42    HB3  PRO   8           HB3      PRO   8  31.569  -7.155   8.045
   43    HG2  PRO   8           HG2      PRO   8  30.999  -9.585   6.947
   44    HG3  PRO   8           HG3      PRO   8  29.764  -8.493   7.592
   45    HD2  PRO   8           HD2      PRO   8  30.227  -9.285   4.839
   46    HD3  PRO   8           HD3      PRO   8  28.896  -8.319   5.505
   47    H    ARG   9           H        ARG   9  33.350  -7.305   5.039
   48    HA   ARG   9           HA       ARG   9  35.067  -5.149   5.427
   49    HE   ARG   9           HE       ARG   9  37.992  -9.143   5.818
   50    HB2  ARG   9           HB2      ARG   9  35.139  -7.204   3.210
   51    HB3  ARG   9           HB3      ARG   9  36.493  -6.205   3.741
   52    HG2  ARG   9           HG2      ARG   9  36.778  -7.386   5.698
   53    HG3  ARG   9           HG3      ARG   9  35.114  -7.973   5.710
   54    HD2  ARG   9           HD2      ARG   9  35.595  -9.747   4.410
   55    HD3  ARG   9           HD3      ARG   9  36.720  -8.833   3.406
   56   HH11  ARG   9          HH11      ARG   9  36.640 -11.265   3.410
   57   HH12  ARG   9          HH12      ARG   9  37.747 -12.556   3.739
   58   HH21  ARG   9          HH21      ARG   9  39.456 -10.838   6.258
   59   HH22  ARG   9          HH22      ARG   9  39.347 -12.313   5.357
   60    H    LEU  10           H        LEU  10  33.291  -6.033   2.464
   61    HA   LEU  10           HA       LEU  10  34.137  -3.720   1.053
   62    HG   LEU  10           HG       LEU  10  33.552  -6.605  -1.198
   63    HB2  LEU  10           HB2      LEU  10  32.126  -5.870   0.505
   64    HB3  LEU  10           HB3      LEU  10  32.271  -4.480  -0.556
   65   HD11  LEU  10          HD11      LEU  10  35.706  -4.856  -1.385
   66   HD12  LEU  10          HD12      LEU  10  34.282  -3.816  -1.346
   67   HD13  LEU  10          HD13      LEU  10  34.416  -5.082  -2.567
   68   HD21  LEU  10          HD21      LEU  10  35.526  -5.575   0.826
   69   HD22  LEU  10          HD22      LEU  10  35.619  -7.048  -0.140
   70   HD23  LEU  10          HD23      LEU  10  34.428  -6.915   1.153
   71    H    ILE  11           H        ILE  11  31.539  -4.325   3.220
   72    HA   ILE  11           HA       ILE  11  30.131  -1.940   2.287
   73    HB   ILE  11           HB       ILE  11  28.906  -4.115   2.930
   74   HG12  ILE  11          HG12      ILE  11  28.158  -1.409   4.038
   75   HG13  ILE  11          HG13      ILE  11  27.647  -2.131   2.516
   76   HG21  ILE  11          HG21      ILE  11  28.328  -4.223   5.366
   77   HG22  ILE  11          HG22      ILE  11  29.625  -3.064   5.658
   78   HG23  ILE  11          HG23      ILE  11  29.994  -4.649   4.978
   79   HD11  ILE  11          HD11      ILE  11  26.069  -3.434   3.509
   80   HD12  ILE  11          HD12      ILE  11  26.070  -2.062   4.616
   81   HD13  ILE  11          HD13      ILE  11  26.947  -3.533   5.035
   82    H    GLU  12           H        GLU  12  32.252  -3.096   4.630
   83    HA   GLU  12           HA       GLU  12  31.899  -0.761   6.379
   84    HB2  GLU  12           HB2      GLU  12  32.189  -3.117   7.313
   85    HB3  GLU  12           HB3      GLU  12  33.866  -3.009   6.796
   86    HG2  GLU  12           HG2      GLU  12  34.385  -1.957   8.665
   87    HG3  GLU  12           HG3      GLU  12  33.251  -0.667   8.270
   88    H    SER  13           H        SER  13  34.663  -2.491   4.940
   89    HA   SER  13           HA       SER  13  36.301  -0.143   5.069
   90    HG   SER  13           HG       SER  13  38.556  -0.716   4.150
   91    HB2  SER  13           HB2      SER  13  37.372  -2.221   5.492
   92    HB3  SER  13           HB3      SER  13  36.771  -2.917   3.988
   93    H    LEU  14           H        LEU  14  34.806  -1.991   2.355
   94    HA   LEU  14           HA       LEU  14  36.065  -0.298   0.424
   95    HG   LEU  14           HG       LEU  14  34.223  -0.200  -1.659
   96    HB2  LEU  14           HB2      LEU  14  35.428  -2.486  -0.288
   97    HB3  LEU  14           HB3      LEU  14  33.763  -2.210   0.153
   98   HD11  LEU  14          HD11      LEU  14  35.102  -1.885  -3.564
   99   HD12  LEU  14          HD12      LEU  14  36.048  -2.449  -2.186
  100   HD13  LEU  14          HD13      LEU  14  36.144  -0.762  -2.690
  101   HD21  LEU  14          HD21      LEU  14  32.436  -2.186  -1.320
  102   HD22  LEU  14          HD22      LEU  14  33.266  -2.755  -2.769
  103   HD23  LEU  14          HD23      LEU  14  32.506  -1.164  -2.755
  104    H    SER  15           H        SER  15  32.602  -0.564   1.334
  105    HA   SER  15           HA       SER  15  31.531   1.522   0.037
  106    HG   SER  15           HG       SER  15  28.860   0.616   1.677
  107    HB2  SER  15           HB2      SER  15  31.094   0.450   2.781
  108    HB3  SER  15           HB3      SER  15  30.338   1.993   2.388
  109    H    GLN  16           H        GLN  16  32.872   1.979   3.311
  110    HA   GLN  16           HA       GLN  16  32.895   4.698   3.400
  111    HB2  GLN  16           HB2      GLN  16  33.817   4.242   5.379
  112    HB3  GLN  16           HB3      GLN  16  34.155   2.601   4.857
  113    HG2  GLN  16           HG2      GLN  16  36.165   3.651   5.679
  114    HG3  GLN  16           HG3      GLN  16  36.309   3.341   3.952
  115   HE21  GLN  16          HE21      GLN  16  37.281   4.908   2.909
  116   HE22  GLN  16          HE22      GLN  16  37.179   6.597   3.261
  117    H    MET  17           H        MET  17  35.096   2.629   1.611
  118    HA   MET  17           HA       MET  17  36.958   4.719   0.991
  119    HB2  MET  17           HB2      MET  17  37.788   2.483   0.873
  120    HB3  MET  17           HB3      MET  17  36.493   1.985  -0.203
  121    HG2  MET  17           HG2      MET  17  38.704   2.280  -1.299
  122    HG3  MET  17           HG3      MET  17  37.396   3.224  -2.011
  123    HE1  MET  17           HE1      MET  17  40.694   4.863   0.725
  124    HE2  MET  17           HE2      MET  17  40.042   3.225   0.704
  125    HE3  MET  17           HE3      MET  17  39.122   4.531   1.452
  126    H    LEU  18           H        LEU  18  33.948   3.592  -0.257
  127    HA   LEU  18           HA       LEU  18  34.215   5.144  -2.721
  128    HG   LEU  18           HG       LEU  18  31.220   5.221  -3.158
  129    HB2  LEU  18           HB2      LEU  18  33.219   3.003  -3.018
  130    HB3  LEU  18           HB3      LEU  18  32.125   3.249  -1.672
  131   HD11  LEU  18          HD11      LEU  18  33.173   4.274  -4.845
  132   HD12  LEU  18          HD12      LEU  18  31.804   5.286  -5.309
  133   HD13  LEU  18          HD13      LEU  18  31.703   3.533  -5.478
  134   HD21  LEU  18          HD21      LEU  18  30.425   2.565  -4.204
  135   HD22  LEU  18          HD22      LEU  18  29.432   3.891  -3.597
  136   HD23  LEU  18          HD23      LEU  18  30.274   2.830  -2.467
  137    H    SER  19           H        SER  19  31.639   4.803  -0.274
  138    HA   SER  19           HA       SER  19  30.382   7.226  -0.820
  139    HG   SER  19           HG       SER  19  28.415   4.770   0.763
  140    HB2  SER  19           HB2      SER  19  30.340   5.530   1.677
  141    HB3  SER  19           HB3      SER  19  29.235   6.868   1.366
  142    H    MET  20           H        MET  20  33.420   7.060   0.401
  143    HA   MET  20           HA       MET  20  33.122   9.175   2.379
  144    HB2  MET  20           HB2      MET  20  34.811   7.627   2.969
  145    HB3  MET  20           HB3      MET  20  35.485   7.614   1.346
  146    HG2  MET  20           HG2      MET  20  36.884   9.253   1.845
  147    HG3  MET  20           HG3      MET  20  35.570  10.268   2.435
  148    HE1  MET  20           HE1      MET  20  36.458  10.784   5.857
  149    HE2  MET  20           HE2      MET  20  34.874  10.168   5.386
  150    HE3  MET  20           HE3      MET  20  35.737  11.283   4.326
  151    H    GLY  21           H        GLY  21  33.868   8.673  -0.924
  152    HA2  GLY  21           HA2      GLY  21  33.465  10.574  -2.431
  153    HA3  GLY  21           HA3      GLY  21  34.351  11.568  -1.275
  154    H    PHE  22           H        PHE  22  35.564   8.407  -1.757
  155    HA   PHE  22           HA       PHE  22  37.486   9.312  -3.758
  156    HD1  PHE  22           HD1      PHE  22  39.134  10.914  -3.245
  157    HD2  PHE  22           HD2      PHE  22  38.301   9.391   0.642
  158    HE1  PHE  22           HE1      PHE  22  39.557  13.140  -2.284
  159    HE2  PHE  22           HE2      PHE  22  38.723  11.614   1.608
  160    HZ   PHE  22           HZ       PHE  22  39.352  13.492   0.145
  161    HB2  PHE  22           HB2      PHE  22  38.207   7.965  -1.144
  162    HB3  PHE  22           HB3      PHE  22  39.333   8.318  -2.456
  163    H    SER  23           H        SER  23  39.004   7.105  -4.030
  164    HA   SER  23           HA       SER  23  37.439   4.724  -3.922
  165    HG   SER  23           HG       SER  23  35.604   5.718  -6.719
  166    HB2  SER  23           HB2      SER  23  37.919   6.030  -6.614
  167    HB3  SER  23           HB3      SER  23  37.382   4.362  -6.403
  168    H    ASP  24           H        ASP  24  39.228   4.233  -6.624
  169    HA   ASP  24           HA       ASP  24  41.667   3.657  -5.083
  170    HB2  ASP  24           HB2      ASP  24  41.997   1.701  -6.575
  171    HB3  ASP  24           HB3      ASP  24  40.520   1.582  -5.617
  172    H    GLU  25           H        GLU  25  43.330   4.843  -5.757
  173    HA   GLU  25           HA       GLU  25  43.272   6.406  -8.104
  174    HB2  GLU  25           HB2      GLU  25  44.664   6.575  -5.819
  175    HB3  GLU  25           HB3      GLU  25  45.889   5.818  -6.827
  176    HG2  GLU  25           HG2      GLU  25  45.605   7.651  -8.466
  177    HG3  GLU  25           HG3      GLU  25  44.484   8.426  -7.348
  178    H    GLY  26           H        GLY  26  42.731   4.036  -9.131
  179    HA2  GLY  26           HA2      GLY  26  43.992   3.551 -11.303
  180    HA3  GLY  26           HA3      GLY  26  45.219   2.933 -10.207
  181    H    GLY  27           H        GLY  27  44.888   0.994  -9.142
  182    HA2  GLY  27           HA2      GLY  27  42.411  -0.429  -9.221
  183    HA3  GLY  27           HA3      GLY  27  43.570  -1.050 -10.396
  184    H    TRP  28           H        TRP  28  44.279   0.399  -7.333
  185    HA   TRP  28           HA       TRP  28  45.711  -2.013  -6.503
  186    HD1  TRP  28           HD1      TRP  28  46.475   2.438  -6.981
  187    HE1  TRP  28           HE1      TRP  28  45.127   4.314  -5.857
  188    HE3  TRP  28           HE3      TRP  28  44.474  -0.198  -3.116
  189    HZ2  TRP  28           HZ2      TRP  28  43.439   4.639  -3.621
  190    HZ3  TRP  28           HZ3      TRP  28  43.007   0.952  -1.517
  191    HH2  TRP  28           HH2      TRP  28  42.495   3.316  -1.764
  192    HB2  TRP  28           HB2      TRP  28  46.681  -0.506  -4.741
  193    HB3  TRP  28           HB3      TRP  28  47.033  -0.010  -6.399
  194    H    LEU  29           H        LEU  29  42.986   0.002  -5.589
  195    HA   LEU  29           HA       LEU  29  42.555  -0.646  -2.984
  196    HG   LEU  29           HG       LEU  29  39.820  -1.791  -3.113
  197    HB2  LEU  29           HB2      LEU  29  40.965   0.770  -3.859
  198    HB3  LEU  29           HB3      LEU  29  40.679  -0.232  -5.265
  199   HD11  LEU  29          HD11      LEU  29  38.089   0.010  -2.257
  200   HD12  LEU  29          HD12      LEU  29  39.419   1.107  -2.627
  201   HD13  LEU  29          HD13      LEU  29  39.658  -0.212  -1.481
  202   HD21  LEU  29          HD21      LEU  29  38.764  -1.693  -5.297
  203   HD22  LEU  29          HD22      LEU  29  38.253  -0.032  -4.996
  204   HD23  LEU  29          HD23      LEU  29  37.583  -1.348  -4.032
  205    H    THR  30           H        THR  30  41.179  -2.596  -5.645
  206    HA   THR  30           HA       THR  30  40.278  -4.756  -4.289
  207    HB   THR  30           HB       THR  30  40.032  -4.889  -6.610
  208    HG1  THR  30           HG1      THR  30  42.196  -6.661  -6.406
  209   HG21  THR  30          HG21      THR  30  42.154  -5.101  -8.085
  210   HG22  THR  30          HG22      THR  30  42.938  -4.250  -6.754
  211   HG23  THR  30          HG23      THR  30  41.578  -3.508  -7.597
  212    H    ARG  31           H        ARG  31  43.587  -3.791  -4.708
  213    HA   ARG  31           HA       ARG  31  44.604  -6.237  -3.482
  214    HE   ARG  31           HE       ARG  31  49.516  -4.527  -2.832
  215    HB2  ARG  31           HB2      ARG  31  46.287  -5.844  -4.904
  216    HB3  ARG  31           HB3      ARG  31  45.665  -4.247  -5.285
  217    HG2  ARG  31           HG2      ARG  31  46.921  -3.240  -3.551
  218    HG3  ARG  31           HG3      ARG  31  47.323  -4.804  -2.838
  219    HD2  ARG  31           HD2      ARG  31  48.375  -5.222  -5.225
  220    HD3  ARG  31           HD3      ARG  31  48.445  -3.460  -5.245
  221   HH11  ARG  31          HH11      ARG  31  50.229  -3.963  -6.195
  222   HH12  ARG  31          HH12      ARG  31  51.942  -3.884  -5.952
  223   HH21  ARG  31          HH21      ARG  31  51.772  -4.423  -2.502
  224   HH22  ARG  31          HH22      ARG  31  52.820  -4.145  -3.853
  225    H    LEU  32           H        LEU  32  45.149  -2.728  -2.982
  226    HA   LEU  32           HA       LEU  32  46.371  -2.617  -0.614
  227    HG   LEU  32           HG       LEU  32  44.896   0.828  -0.068
  228    HB2  LEU  32           HB2      LEU  32  45.640  -0.645  -1.789
  229    HB3  LEU  32           HB3      LEU  32  43.957  -1.002  -1.429
  230   HD11  LEU  32          HD11      LEU  32  44.345  -1.430   1.803
  231   HD12  LEU  32          HD12      LEU  32  43.095  -0.888   0.683
  232   HD13  LEU  32          HD13      LEU  32  43.777   0.239   1.856
  233   HD21  LEU  32          HD21      LEU  32  46.386  -0.136   1.882
  234   HD22  LEU  32          HD22      LEU  32  47.094   0.435   0.370
  235   HD23  LEU  32          HD23      LEU  32  46.850  -1.292   0.633
  236    H    LEU  33           H        LEU  33  42.790  -2.636  -0.675
  237    HA   LEU  33           HA       LEU  33  42.212  -3.014   1.947
  238    HG   LEU  33           HG       LEU  33  40.790  -1.846  -0.211
  239    HB2  LEU  33           HB2      LEU  33  41.001  -4.394  -0.453
  240    HB3  LEU  33           HB3      LEU  33  40.298  -4.480   1.152
  241   HD11  LEU  33          HD11      LEU  33  38.159  -3.285  -0.278
  242   HD12  LEU  33          HD12      LEU  33  39.348  -3.470  -1.567
  243   HD13  LEU  33          HD13      LEU  33  38.678  -1.879  -1.207
  244   HD21  LEU  33          HD21      LEU  33  39.746  -0.940   1.547
  245   HD22  LEU  33          HD22      LEU  33  40.064  -2.475   2.354
  246   HD23  LEU  33          HD23      LEU  33  38.506  -2.194   1.576
  247    H    GLN  34           H        GLN  34  42.373  -5.731  -0.228
  248    HA   GLN  34           HA       GLN  34  42.525  -7.862   1.423
  249    HB2  GLN  34           HB2      GLN  34  43.334  -7.280  -1.250
  250    HB3  GLN  34           HB3      GLN  34  44.507  -8.373  -0.523
  251    HG2  GLN  34           HG2      GLN  34  43.112  -9.992  -1.155
  252    HG3  GLN  34           HG3      GLN  34  42.138  -9.498   0.229
  253   HE21  GLN  34          HE21      GLN  34  41.057  -7.165  -0.614
  254   HE22  GLN  34          HE22      GLN  34  40.021  -7.441  -1.968
  255    H    THR  35           H        THR  35  45.378  -5.993   0.382
  256    HA   THR  35           HA       THR  35  47.162  -7.389   2.144
  257    HB   THR  35           HB       THR  35  47.745  -6.254  -0.083
  258    HG1  THR  35           HG1      THR  35  49.822  -5.495   0.951
  259   HG21  THR  35          HG21      THR  35  48.773  -3.874   0.907
  260   HG22  THR  35          HG22      THR  35  47.102  -3.918   1.467
  261   HG23  THR  35          HG23      THR  35  47.460  -4.071  -0.252
  262    H    LYS  36           H        LYS  36  44.816  -5.313   2.798
  263    HA   LYS  36           HA       LYS  36  46.170  -4.237   5.177
  264    HB2  LYS  36           HB2      LYS  36  44.798  -2.775   3.076
  265    HB3  LYS  36           HB3      LYS  36  44.074  -2.473   4.649
  266    HG2  LYS  36           HG2      LYS  36  45.764  -0.822   4.200
  267    HG3  LYS  36           HG3      LYS  36  46.292  -1.862   5.525
  268    HD2  LYS  36           HD2      LYS  36  47.498  -3.221   3.710
  269    HD3  LYS  36           HD3      LYS  36  47.242  -1.813   2.679
  270    HE2  LYS  36           HE2      LYS  36  48.396  -0.417   4.366
  271    HE3  LYS  36           HE3      LYS  36  48.713  -1.872   5.312
  272    HZ1  LYS  36           HZ1      LYS  36  50.218  -0.830   3.205
  273    HZ2  LYS  36           HZ2      LYS  36  49.579  -2.305   2.680
  274    HZ3  LYS  36           HZ3      LYS  36  50.505  -2.242   4.094
  275    H    ASN  37           H        ASN  37  44.488  -6.645   4.640
  276    HA   ASN  37           HA       ASN  37  42.776  -7.803   5.605
  277    HB2  ASN  37           HB2      ASN  37  43.853  -7.493   7.685
  278    HB3  ASN  37           HB3      ASN  37  43.471  -5.773   7.725
  279   HD21  ASN  37          HD21      ASN  37  41.595  -5.102   8.600
  280   HD22  ASN  37          HD22      ASN  37  40.438  -6.147   9.341
  281    H    TYR  38           H        TYR  38  42.131  -5.753   3.737
  282    HA   TYR  38           HA       TYR  38  40.336  -4.597   2.930
  283    HD1  TYR  38           HD1      TYR  38  38.515  -5.219   1.409
  284    HD2  TYR  38           HD2      TYR  38  39.119  -8.559   3.977
  285    HE1  TYR  38           HE1      TYR  38  38.284  -6.734  -0.515
  286    HE2  TYR  38           HE2      TYR  38  38.892 -10.081   2.059
  287    HH   TYR  38           HH       TYR  38  39.140 -10.010  -0.391
  288    HB2  TYR  38           HB2      TYR  38  39.040  -6.455   4.904
  289    HB3  TYR  38           HB3      TYR  38  38.077  -5.245   4.065
  290    H    ASP  39           H        ASP  39  41.795  -3.017   4.343
  291    HA   ASP  39           HA       ASP  39  39.906  -1.597   6.113
  292    HB2  ASP  39           HB2      ASP  39  41.478  -1.240   7.748
  293    HB3  ASP  39           HB3      ASP  39  42.010  -2.811   7.152
  294    H    ILE  40           H        ILE  40  39.771   0.584   5.977
  295    HA   ILE  40           HA       ILE  40  40.901   1.762   3.587
  296    HB   ILE  40           HB       ILE  40  39.505   3.741   4.186
  297   HG12  ILE  40          HG12      ILE  40  39.506   2.969   6.688
  298   HG13  ILE  40          HG13      ILE  40  38.103   3.799   6.028
  299   HG21  ILE  40          HG21      ILE  40  38.727   1.230   3.175
  300   HG22  ILE  40          HG22      ILE  40  38.032   2.813   2.830
  301   HG23  ILE  40          HG23      ILE  40  37.389   1.837   4.148
  302   HD11  ILE  40          HD11      ILE  40  38.265   1.240   7.255
  303   HD12  ILE  40          HD12      ILE  40  37.705   1.044   5.595
  304   HD13  ILE  40          HD13      ILE  40  36.841   2.116   6.696
  305    H    GLY  41           H        GLY  41  41.410   1.670   6.961
  306    HA2  GLY  41           HA2      GLY  41  42.442   4.025   7.693
  307    HA3  GLY  41           HA3      GLY  41  43.207   2.520   8.155
  308    H    ALA  42           H        ALA  42  44.139   1.624   5.807
  309    HA   ALA  42           HA       ALA  42  46.244   3.560   5.195
  310    HB1  ALA  42           HB1      ALA  42  47.043   1.233   4.017
  311    HB2  ALA  42           HB2      ALA  42  46.125   0.643   5.403
  312    HB3  ALA  42           HB3      ALA  42  47.483   1.743   5.647
  313    H    ALA  43           H        ALA  43  43.508   2.039   3.826
  314    HA   ALA  43           HA       ALA  43  44.173   2.013   1.115
  315    HB1  ALA  43           HB1      ALA  43  41.427   2.739   2.085
  316    HB2  ALA  43           HB2      ALA  43  42.067   1.103   2.249
  317    HB3  ALA  43           HB3      ALA  43  41.886   1.823   0.650
  318    H    LEU  44           H        LEU  44  42.865   4.606   3.126
  319    HA   LEU  44           HA       LEU  44  42.513   6.502   1.082
  320    HG   LEU  44           HG       LEU  44  40.588   6.733   2.303
  321    HB2  LEU  44           HB2      LEU  44  42.683   6.556   4.032
  322    HB3  LEU  44           HB3      LEU  44  43.051   8.071   3.218
  323   HD11  LEU  44          HD11      LEU  44  41.006   7.553   5.135
  324   HD12  LEU  44          HD12      LEU  44  40.068   6.213   4.473
  325   HD13  LEU  44          HD13      LEU  44  39.447   7.861   4.370
  326   HD21  LEU  44          HD21      LEU  44  41.339   8.956   1.535
  327   HD22  LEU  44          HD22      LEU  44  41.179   9.555   3.186
  328   HD23  LEU  44          HD23      LEU  44  39.754   9.000   2.307
  329    H    ASP  45           H        ASP  45  45.168   6.255   3.448
  330    HA   ASP  45           HA       ASP  45  46.842   8.193   2.727
  331    HB2  ASP  45           HB2      ASP  45  47.522   6.637   4.407
  332    HB3  ASP  45           HB3      ASP  45  47.573   5.311   3.247
  333    H    THR  46           H        THR  46  46.084   5.443   0.694
  334    HA   THR  46           HA       THR  46  48.138   6.217  -1.226
  335    HB   THR  46           HB       THR  46  47.607   4.143  -2.380
  336    HG1  THR  46           HG1      THR  46  45.502   3.776  -2.141
  337   HG21  THR  46          HG21      THR  46  47.568   2.846   0.149
  338   HG22  THR  46          HG22      THR  46  48.611   4.265   0.245
  339   HG23  THR  46          HG23      THR  46  48.905   3.036  -0.985
  340    H    ILE  47           H        ILE  47  44.661   6.387  -0.844
  341    HA   ILE  47           HA       ILE  47  44.089   6.766  -3.612
  342    HB   ILE  47           HB       ILE  47  41.869   7.296  -3.004
  343   HG12  ILE  47          HG12      ILE  47  42.923   7.781  -0.212
  344   HG13  ILE  47          HG13      ILE  47  42.282   8.991  -1.315
  345   HG21  ILE  47          HG21      ILE  47  43.232   5.143  -1.536
  346   HG22  ILE  47          HG22      ILE  47  41.893   5.067  -2.675
  347   HG23  ILE  47          HG23      ILE  47  41.599   5.530  -0.999
  348   HD11  ILE  47          HD11      ILE  47  40.327   8.702  -0.336
  349   HD12  ILE  47          HD12      ILE  47  40.905   7.292   0.548
  350   HD13  ILE  47          HD13      ILE  47  40.258   7.107  -1.082
  351    H    GLN  48           H        GLN  48  44.776   8.979  -0.948
  352    HA   GLN  48           HA       GLN  48  45.582  11.045  -2.695
  353    HB2  GLN  48           HB2      GLN  48  42.752  11.034  -1.820
  354    HB3  GLN  48           HB3      GLN  48  43.594  12.571  -1.700
  355    HG2  GLN  48           HG2      GLN  48  43.433  12.916  -3.879
  356    HG3  GLN  48           HG3      GLN  48  44.105  11.329  -4.245
  357   HE21  GLN  48          HE21      GLN  48  42.115   9.765  -3.006
  358   HE22  GLN  48          HE22      GLN  48  40.653   9.922  -3.924
  359    H    TYR  49           H        TYR  49  46.638   9.795  -0.372
  360    HA   TYR  49           HA       TYR  49  47.335  12.109   1.140
  361    HD1  TYR  49           HD2      TYR  49  46.222  13.671   2.835
  362    HD2  TYR  49           HD1      TYR  49  43.388  10.647   1.871
  363    HE1  TYR  49           HE2      TYR  49  44.446  15.370   2.748
  364    HE2  TYR  49           HE1      TYR  49  41.605  12.338   1.780
  365    HH   TYR  49           HH       TYR  49  42.309  15.780   2.263
  366    HB2  TYR  49           HB2      TYR  49  45.553  10.023   2.404
  367    HB3  TYR  49           HB3      TYR  49  46.556  11.123   3.350
  368    H    SER  50           H        SER  50  48.927  10.451  -0.304
  369    HA   SER  50           HA       SER  50  50.120   8.531   1.541
  370    HG   SER  50           HG       SER  50  50.033   9.561  -2.048
  371    HB2  SER  50           HB2      SER  50  51.595   8.637  -0.873
  372    HB3  SER  50           HB3      SER  50  50.477   7.379  -0.343
  373    H    LYS  51           H        LYS  51  50.403  11.234   2.296
  374    HA   LYS  51           HA       LYS  51  53.281  11.363   2.471
  375    HB2  LYS  51           HB2      LYS  51  51.884  12.977   0.549
  376    HB3  LYS  51           HB3      LYS  51  52.588  14.015   1.782
  377    HG2  LYS  51           HG2      LYS  51  54.702  12.476   1.331
  378    HG3  LYS  51           HG3      LYS  51  53.910  12.298  -0.236
  379    HD2  LYS  51           HD2      LYS  51  53.823  14.759  -0.434
  380    HD3  LYS  51           HD3      LYS  51  54.693  14.891   1.096
  381    HE2  LYS  51           HE2      LYS  51  56.590  13.701   0.133
  382    HE3  LYS  51           HE3      LYS  51  55.719  13.521  -1.389
  383    HZ1  LYS  51           HZ1      LYS  51  56.547  16.094  -0.157
  384    HZ2  LYS  51           HZ2      LYS  51  55.695  15.932  -1.609
  385    HZ3  LYS  51           HZ3      LYS  51  57.279  15.353  -1.490
  386    H    HIS  52           H        HIS  52  51.966  10.825   4.588
  387    HA   HIS  52           HA       HIS  52  51.675  13.364   6.053
  388    HD1  HIS  52           HD1      HIS  52  47.511  12.708   6.937
  389    HD2  HIS  52           HD2      HIS  52  51.169  13.637   8.671
  390    HE1  HIS  52           HE1      HIS  52  47.023  14.382   8.768
  391    HB2  HIS  52           HB2      HIS  52  49.555  11.868   5.599
  392    HB3  HIS  52           HB3      HIS  52  50.198  10.915   6.932
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  29.391 -17.738   1.743
    2    H2   GLY   1           2H       GLY   1  28.683 -19.190   1.240
    3    H3   GLY   1           3H       GLY   1  28.596 -18.725   2.865
    4    HA2  GLY   1           HA2      GLY   1  27.080 -17.741   0.558
    5    HA3  GLY   1           HA3      GLY   1  26.516 -18.129   2.178
    6    H    SER   2           H        SER   2  29.051 -15.962   0.918
    7    HA   SER   2           HA       SER   2  28.026 -13.864   2.681
    8    HG   SER   2           HG       SER   2  29.497 -12.105   2.881
    9    HB2  SER   2           HB2      SER   2  30.563 -14.655   2.358
   10    HB3  SER   2           HB3      SER   2  30.497 -13.443   1.077
   11    HA   PRO   3           HA       PRO   3  26.075 -11.981  -0.862
   12    HB2  PRO   3           HB2      PRO   3  25.235  -9.731   0.406
   13    HB3  PRO   3           HB3      PRO   3  24.431 -11.294   0.591
   14    HG2  PRO   3           HG2      PRO   3  26.408  -9.954   2.397
   15    HG3  PRO   3           HG3      PRO   3  24.918 -10.820   2.815
   16    HD2  PRO   3           HD2      PRO   3  27.368 -11.951   3.027
   17    HD3  PRO   3           HD3      PRO   3  25.917 -12.888   2.620
   18    HA   PRO   4           HA       PRO   4  29.506  -9.303  -1.969
   19    HB2  PRO   4           HB2      PRO   4  29.054  -9.287  -4.610
   20    HB3  PRO   4           HB3      PRO   4  29.698 -10.717  -3.792
   21    HG2  PRO   4           HG2      PRO   4  26.904 -10.147  -4.697
   22    HG3  PRO   4           HG3      PRO   4  27.830 -11.656  -4.797
   23    HD2  PRO   4           HD2      PRO   4  25.951 -11.105  -2.857
   24    HD3  PRO   4           HD3      PRO   4  27.276 -12.270  -2.668
   25    H    GLU   5           H        GLU   5  27.748  -7.790  -0.735
   26    HA   GLU   5           HA       GLU   5  27.516  -5.482  -2.432
   27    HB2  GLU   5           HB2      GLU   5  25.075  -5.169  -2.012
   28    HB3  GLU   5           HB3      GLU   5  25.453  -6.521  -3.069
   29    HG2  GLU   5           HG2      GLU   5  25.322  -7.944  -0.923
   30    HG3  GLU   5           HG3      GLU   5  24.478  -6.554  -0.243
   31    H    ALA   6           H        ALA   6  28.665  -6.475   0.180
   32    HA   ALA   6           HA       ALA   6  29.083  -4.319   1.624
   33    HB1  ALA   6           HB1      ALA   6  27.064  -3.436   2.088
   34    HB2  ALA   6           HB2      ALA   6  27.092  -4.598   3.415
   35    HB3  ALA   6           HB3      ALA   6  26.231  -4.983   1.926
   36    H    ASP   7           H        ASP   7  30.597  -6.297   1.668
   37    HA   ASP   7           HA       ASP   7  30.042  -7.986   4.005
   38    HB2  ASP   7           HB2      ASP   7  32.334  -8.339   2.082
   39    HB3  ASP   7           HB3      ASP   7  31.624  -9.532   3.166
   40    HA   PRO   8           HA       PRO   8  32.705  -5.956   6.861
   41    HB2  PRO   8           HB2      PRO   8  34.063  -8.620   7.005
   42    HB3  PRO   8           HB3      PRO   8  33.545  -7.550   8.315
   43    HG2  PRO   8           HG2      PRO   8  32.103  -9.692   7.652
   44    HG3  PRO   8           HG3      PRO   8  31.323  -8.173   8.125
   45    HD2  PRO   8           HD2      PRO   8  31.544  -9.426   5.448
   46    HD3  PRO   8           HD3      PRO   8  30.306  -8.325   6.083
   47    H    ARG   9           H        ARG   9  33.989  -7.658   4.110
   48    HA   ARG   9           HA       ARG   9  36.697  -6.804   4.475
   49    HE   ARG   9           HE       ARG   9  39.305 -10.528   2.596
   50    HB2  ARG   9           HB2      ARG   9  35.220  -8.040   2.156
   51    HB3  ARG   9           HB3      ARG   9  36.917  -7.579   2.059
   52    HG2  ARG   9           HG2      ARG   9  35.959  -9.386   4.242
   53    HG3  ARG   9           HG3      ARG   9  36.304 -10.017   2.629
   54    HD2  ARG   9           HD2      ARG   9  38.505  -8.474   3.134
   55    HD3  ARG   9           HD3      ARG   9  38.130  -9.118   4.731
   56   HH11  ARG   9          HH11      ARG   9  36.921 -10.921   5.104
   57   HH12  ARG   9          HH12      ARG   9  37.151 -12.633   5.233
   58   HH21  ARG   9          HH21      ARG   9  39.614 -12.781   2.755
   59   HH22  ARG   9          HH22      ARG   9  38.683 -13.692   3.897
   60    H    LEU  10           H        LEU  10  34.368  -6.007   1.880
   61    HA   LEU  10           HA       LEU  10  35.759  -3.479   1.504
   62    HG   LEU  10           HG       LEU  10  36.734  -4.897  -0.075
   63    HB2  LEU  10           HB2      LEU  10  33.943  -5.117  -0.237
   64    HB3  LEU  10           HB3      LEU  10  34.299  -3.443  -0.614
   65   HD11  LEU  10          HD11      LEU  10  36.749  -6.519  -1.746
   66   HD12  LEU  10          HD12      LEU  10  35.262  -5.914  -2.478
   67   HD13  LEU  10          HD13      LEU  10  35.204  -6.752  -0.927
   68   HD21  LEU  10          HD21      LEU  10  35.691  -3.505  -2.537
   69   HD22  LEU  10          HD22      LEU  10  37.361  -4.002  -2.260
   70   HD23  LEU  10          HD23      LEU  10  36.629  -2.764  -1.239
   71    H    ILE  11           H        ILE  11  33.094  -4.706   3.065
   72    HA   ILE  11           HA       ILE  11  31.209  -2.599   2.642
   73    HB   ILE  11           HB       ILE  11  30.716  -4.886   3.702
   74   HG12  ILE  11          HG12      ILE  11  29.730  -2.264   4.793
   75   HG13  ILE  11          HG13      ILE  11  28.944  -3.346   3.647
   76   HG21  ILE  11          HG21      ILE  11  32.632  -4.515   5.390
   77   HG22  ILE  11          HG22      ILE  11  31.140  -5.268   5.955
   78   HG23  ILE  11          HG23      ILE  11  31.449  -3.563   6.285
   79   HD11  ILE  11          HD11      ILE  11  27.989  -3.257   5.985
   80   HD12  ILE  11          HD12      ILE  11  29.436  -4.123   6.500
   81   HD13  ILE  11          HD13      ILE  11  28.337  -4.859   5.333
   82    H    GLU  12           H        GLU  12  34.021  -3.132   4.562
   83    HA   GLU  12           HA       GLU  12  33.621  -0.685   6.105
   84    HB2  GLU  12           HB2      GLU  12  34.414  -2.770   7.234
   85    HB3  GLU  12           HB3      GLU  12  35.873  -2.698   6.255
   86    HG2  GLU  12           HG2      GLU  12  36.820  -1.341   7.715
   87    HG3  GLU  12           HG3      GLU  12  35.506  -0.179   7.528
   88    H    SER  13           H        SER  13  36.163  -2.184   4.095
   89    HA   SER  13           HA       SER  13  37.667   0.190   3.835
   90    HG   SER  13           HG       SER  13  37.619  -3.323   3.320
   91    HB2  SER  13           HB2      SER  13  37.883  -1.894   1.731
   92    HB3  SER  13           HB3      SER  13  39.153  -1.082   2.649
   93    H    LEU  14           H        LEU  14  35.364  -1.376   1.634
   94    HA   LEU  14           HA       LEU  14  35.640   0.740  -0.310
   95    HG   LEU  14           HG       LEU  14  33.283   0.110  -2.249
   96    HB2  LEU  14           HB2      LEU  14  35.042  -1.770  -0.709
   97    HB3  LEU  14           HB3      LEU  14  33.407  -1.255  -0.348
   98   HD11  LEU  14          HD11      LEU  14  35.557   0.198  -3.663
   99   HD12  LEU  14          HD12      LEU  14  36.224   0.133  -2.032
  100   HD13  LEU  14          HD13      LEU  14  35.106   1.420  -2.475
  101   HD21  LEU  14          HD21      LEU  14  34.927  -1.805  -3.682
  102   HD22  LEU  14          HD22      LEU  14  33.183  -1.541  -3.742
  103   HD23  LEU  14          HD23      LEU  14  33.876  -2.576  -2.493
  104    H    SER  15           H        SER  15  32.731  -0.541   1.328
  105    HA   SER  15           HA       SER  15  31.063   1.574   0.926
  106    HG   SER  15           HG       SER  15  29.359   0.340   1.173
  107    HB2  SER  15           HB2      SER  15  31.041  -0.709   2.537
  108    HB3  SER  15           HB3      SER  15  30.711   0.627   3.639
  109    H    GLN  16           H        GLN  16  33.928   1.835   2.651
  110    HA   GLN  16           HA       GLN  16  33.008   4.096   4.260
  111    HB2  GLN  16           HB2      GLN  16  34.488   2.490   5.368
  112    HB3  GLN  16           HB3      GLN  16  35.719   2.751   4.140
  113    HG2  GLN  16           HG2      GLN  16  34.685   4.818   6.052
  114    HG3  GLN  16           HG3      GLN  16  36.187   3.924   6.239
  115   HE21  GLN  16          HE21      GLN  16  36.966   3.985   3.509
  116   HE22  GLN  16          HE22      GLN  16  37.413   5.611   3.124
  117    H    MET  17           H        MET  17  35.090   3.234   1.578
  118    HA   MET  17           HA       MET  17  35.770   6.038   1.109
  119    HB2  MET  17           HB2      MET  17  36.915   3.420   0.307
  120    HB3  MET  17           HB3      MET  17  37.092   4.745  -0.835
  121    HG2  MET  17           HG2      MET  17  37.937   6.039   1.277
  122    HG3  MET  17           HG3      MET  17  38.250   4.414   1.885
  123    HE1  MET  17           HE1      MET  17  38.713   3.171  -1.193
  124    HE2  MET  17           HE2      MET  17  39.602   2.587   0.214
  125    HE3  MET  17           HE3      MET  17  40.475   3.123  -1.222
  126    H    LEU  18           H        LEU  18  33.544   3.691   0.085
  127    HA   LEU  18           HA       LEU  18  33.275   4.478  -2.635
  128    HG   LEU  18           HG       LEU  18  30.768   3.877  -3.439
  129    HB2  LEU  18           HB2      LEU  18  32.505   2.306  -1.579
  130    HB3  LEU  18           HB3      LEU  18  31.149   3.205  -0.929
  131   HD11  LEU  18          HD11      LEU  18  32.746   1.696  -3.577
  132   HD12  LEU  18          HD12      LEU  18  32.394   2.988  -4.724
  133   HD13  LEU  18          HD13      LEU  18  31.363   1.559  -4.663
  134   HD21  LEU  18          HD21      LEU  18  29.510   1.618  -3.683
  135   HD22  LEU  18          HD22      LEU  18  29.044   2.739  -2.404
  136   HD23  LEU  18          HD23      LEU  18  30.052   1.342  -2.028
  137    H    SER  19           H        SER  19  30.994   4.981   0.075
  138    HA   SER  19           HA       SER  19  29.659   7.087  -1.340
  139    HG   SER  19           HG       SER  19  29.015   5.313   2.174
  140    HB2  SER  19           HB2      SER  19  28.209   7.212   0.613
  141    HB3  SER  19           HB3      SER  19  28.453   5.524   0.159
  142    H    MET  20           H        MET  20  32.555   7.141  -0.021
  143    HA   MET  20           HA       MET  20  32.254   9.745   1.303
  144    HB2  MET  20           HB2      MET  20  34.208   7.524   1.520
  145    HB3  MET  20           HB3      MET  20  34.867   9.147   1.654
  146    HG2  MET  20           HG2      MET  20  32.589   8.104   3.317
  147    HG3  MET  20           HG3      MET  20  34.277   8.092   3.822
  148    HE1  MET  20           HE1      MET  20  34.518  11.200   5.705
  149    HE2  MET  20           HE2      MET  20  35.238   9.683   5.169
  150    HE3  MET  20           HE3      MET  20  33.738   9.667   6.096
  151    H    GLY  21           H        GLY  21  33.534   8.107  -1.454
  152    HA2  GLY  21           HA2      GLY  21  33.929   9.254  -3.512
  153    HA3  GLY  21           HA3      GLY  21  34.335  10.699  -2.589
  154    H    PHE  22           H        PHE  22  35.465   7.334  -2.340
  155    HA   PHE  22           HA       PHE  22  38.142   8.228  -3.094
  156    HD1  PHE  22           HD1      PHE  22  39.001   9.835  -1.747
  157    HD2  PHE  22           HD2      PHE  22  36.980   7.645   1.291
  158    HE1  PHE  22           HE1      PHE  22  38.806  11.886  -0.404
  159    HE2  PHE  22           HE2      PHE  22  36.781   9.692   2.641
  160    HZ   PHE  22           HZ       PHE  22  37.694  11.817   1.793
  161    HB2  PHE  22           HB2      PHE  22  37.584   6.569  -0.631
  162    HB3  PHE  22           HB3      PHE  22  39.168   7.089  -1.205
  163    H    SER  23           H        SER  23  39.361   6.650  -4.108
  164    HA   SER  23           HA       SER  23  38.307   3.965  -4.211
  165    HG   SER  23           HG       SER  23  36.190   4.645  -6.568
  166    HB2  SER  23           HB2      SER  23  38.574   5.619  -6.734
  167    HB3  SER  23           HB3      SER  23  38.157   3.906  -6.665
  168    H    ASP  24           H        ASP  24  39.773   2.742  -6.036
  169    HA   ASP  24           HA       ASP  24  42.414   2.822  -5.017
  170    HB2  ASP  24           HB2      ASP  24  42.855   1.013  -6.476
  171    HB3  ASP  24           HB3      ASP  24  41.151   0.843  -6.051
  172    H    GLU  25           H        GLU  25  43.843   4.362  -5.448
  173    HA   GLU  25           HA       GLU  25  43.631   5.940  -7.863
  174    HB2  GLU  25           HB2      GLU  25  44.259   6.738  -5.460
  175    HB3  GLU  25           HB3      GLU  25  45.878   6.221  -5.906
  176    HG2  GLU  25           HG2      GLU  25  45.301   7.691  -8.056
  177    HG3  GLU  25           HG3      GLU  25  44.280   8.506  -6.873
  178    H    GLY  26           H        GLY  26  44.222   3.327  -8.528
  179    HA2  GLY  26           HA2      GLY  26  46.038   3.393 -10.456
  180    HA3  GLY  26           HA3      GLY  26  47.092   3.227  -9.063
  181    H    GLY  27           H        GLY  27  44.091   1.581  -8.721
  182    HA2  GLY  27           HA2      GLY  27  43.507  -0.643  -8.953
  183    HA3  GLY  27           HA3      GLY  27  44.872  -0.840 -10.044
  184    H    TRP  28           H        TRP  28  45.265   0.516  -6.919
  185    HA   TRP  28           HA       TRP  28  46.912  -1.770  -6.136
  186    HD1  TRP  28           HD1      TRP  28  47.214   2.569  -6.730
  187    HE1  TRP  28           HE1      TRP  28  45.754   4.392  -5.694
  188    HE3  TRP  28           HE3      TRP  28  45.578   0.103  -2.575
  189    HZ2  TRP  28           HZ2      TRP  28  44.135   4.781  -3.448
  190    HZ3  TRP  28           HZ3      TRP  28  44.073   1.272  -1.020
  191    HH2  TRP  28           HH2      TRP  28  43.359   3.569  -1.451
  192    HB2  TRP  28           HB2      TRP  28  47.665  -0.214  -4.281
  193    HB3  TRP  28           HB3      TRP  28  48.083   0.287  -5.923
  194    H    LEU  29           H        LEU  29  44.163   0.164  -4.979
  195    HA   LEU  29           HA       LEU  29  43.768  -0.653  -2.477
  196    HG   LEU  29           HG       LEU  29  42.330   1.626  -2.889
  197    HB2  LEU  29           HB2      LEU  29  41.980   0.016  -4.657
  198    HB3  LEU  29           HB3      LEU  29  41.234  -1.108  -3.540
  199   HD11  LEU  29          HD11      LEU  29  40.248   2.364  -3.088
  200   HD12  LEU  29          HD12      LEU  29  39.619   1.044  -2.101
  201   HD13  LEU  29          HD13      LEU  29  39.845   0.820  -3.837
  202   HD21  LEU  29          HD21      LEU  29  40.938  -0.175  -0.939
  203   HD22  LEU  29          HD22      LEU  29  41.896   1.270  -0.626
  204   HD23  LEU  29          HD23      LEU  29  42.688  -0.219  -1.125
  205    H    THR  30           H        THR  30  42.518  -2.647  -5.178
  206    HA   THR  30           HA       THR  30  41.782  -4.864  -3.708
  207    HB   THR  30           HB       THR  30  41.928  -6.137  -5.744
  208    HG1  THR  30           HG1      THR  30  43.576  -5.841  -6.978
  209   HG21  THR  30          HG21      THR  30  40.463  -3.883  -5.608
  210   HG22  THR  30          HG22      THR  30  40.426  -5.011  -6.963
  211   HG23  THR  30          HG23      THR  30  41.425  -3.560  -7.050
  212    H    ARG  31           H        ARG  31  44.957  -3.861  -4.758
  213    HA   ARG  31           HA       ARG  31  46.222  -6.302  -3.821
  214    HE   ARG  31           HE       ARG  31  49.770  -1.630  -4.320
  215    HB2  ARG  31           HB2      ARG  31  47.993  -5.689  -5.073
  216    HB3  ARG  31           HB3      ARG  31  46.895  -4.519  -5.781
  217    HG2  ARG  31           HG2      ARG  31  47.694  -2.846  -4.137
  218    HG3  ARG  31           HG3      ARG  31  48.865  -4.030  -3.557
  219    HD2  ARG  31           HD2      ARG  31  50.010  -4.045  -5.623
  220    HD3  ARG  31           HD3      ARG  31  48.704  -3.183  -6.435
  221   HH11  ARG  31          HH11      ARG  31  50.468  -2.716  -7.553
  222   HH12  ARG  31          HH12      ARG  31  51.449  -1.342  -7.940
  223   HH21  ARG  31          HH21      ARG  31  51.057   0.185  -4.822
  224   HH22  ARG  31          HH22      ARG  31  51.784   0.306  -6.390
  225    H    LEU  32           H        LEU  32  46.277  -2.830  -2.993
  226    HA   LEU  32           HA       LEU  32  47.875  -2.949  -0.719
  227    HG   LEU  32           HG       LEU  32  46.573   0.550  -0.003
  228    HB2  LEU  32           HB2      LEU  32  47.097  -0.897  -1.860
  229    HB3  LEU  32           HB3      LEU  32  45.469  -1.205  -1.279
  230   HD11  LEU  32          HD11      LEU  32  45.098  -1.500   0.976
  231   HD12  LEU  32          HD12      LEU  32  45.563  -0.066   1.883
  232   HD13  LEU  32          HD13      LEU  32  46.509  -1.545   2.033
  233   HD21  LEU  32          HD21      LEU  32  48.767   0.363   0.286
  234   HD22  LEU  32          HD22      LEU  32  48.738  -1.383   0.036
  235   HD23  LEU  32          HD23      LEU  32  48.384  -0.715   1.629
  236    H    LEU  33           H        LEU  33  44.341  -3.110  -0.997
  237    HA   LEU  33           HA       LEU  33  43.689  -3.538   1.657
  238    HG   LEU  33           HG       LEU  33  42.409  -1.995  -0.597
  239    HB2  LEU  33           HB2      LEU  33  42.360  -4.441  -0.895
  240    HB3  LEU  33           HB3      LEU  33  41.615  -4.608   0.685
  241   HD11  LEU  33          HD11      LEU  33  40.114  -3.651  -0.943
  242   HD12  LEU  33          HD12      LEU  33  40.466  -2.079  -1.659
  243   HD13  LEU  33          HD13      LEU  33  39.637  -2.175  -0.106
  244   HD21  LEU  33          HD21      LEU  33  42.555  -1.963   1.852
  245   HD22  LEU  33          HD22      LEU  33  40.894  -2.549   1.951
  246   HD23  LEU  33          HD23      LEU  33  41.229  -0.962   1.260
  247    H    GLN  34           H        GLN  34  43.663  -6.052  -0.841
  248    HA   GLN  34           HA       GLN  34  43.304  -8.320   0.491
  249    HB2  GLN  34           HB2      GLN  34  44.819  -7.567  -1.872
  250    HB3  GLN  34           HB3      GLN  34  45.414  -9.049  -1.135
  251    HG2  GLN  34           HG2      GLN  34  43.833  -9.745  -2.708
  252    HG3  GLN  34           HG3      GLN  34  43.002  -9.845  -1.156
  253   HE21  GLN  34          HE21      GLN  34  41.793  -7.797  -0.562
  254   HE22  GLN  34          HE22      GLN  34  40.880  -7.051  -1.824
  255    H    THR  35           H        THR  35  46.225  -6.410   0.769
  256    HA   THR  35           HA       THR  35  47.636  -8.532   2.165
  257    HB   THR  35           HB       THR  35  48.508  -5.665   1.807
  258    HG1  THR  35           HG1      THR  35  49.769  -6.814   0.050
  259   HG21  THR  35          HG21      THR  35  49.911  -6.743   3.385
  260   HG22  THR  35          HG22      THR  35  50.780  -6.706   1.851
  261   HG23  THR  35          HG23      THR  35  50.012  -8.198   2.394
  262    H    LYS  36           H        LYS  36  46.871  -5.162   3.001
  263    HA   LYS  36           HA       LYS  36  47.215  -5.654   5.805
  264    HB2  LYS  36           HB2      LYS  36  46.586  -3.306   4.098
  265    HB3  LYS  36           HB3      LYS  36  46.126  -3.225   5.794
  266    HG2  LYS  36           HG2      LYS  36  48.245  -3.006   6.488
  267    HG3  LYS  36           HG3      LYS  36  48.855  -4.174   5.313
  268    HD2  LYS  36           HD2      LYS  36  48.917  -2.544   3.592
  269    HD3  LYS  36           HD3      LYS  36  47.984  -1.395   4.554
  270    HE2  LYS  36           HE2      LYS  36  50.859  -2.107   4.691
  271    HE3  LYS  36           HE3      LYS  36  50.070  -0.544   4.892
  272    HZ1  LYS  36           HZ1      LYS  36  49.298  -1.276   7.076
  273    HZ2  LYS  36           HZ2      LYS  36  50.986  -1.302   6.975
  274    HZ3  LYS  36           HZ3      LYS  36  50.111  -2.748   6.882
  275    H    ASN  37           H        ASN  37  45.222  -7.368   4.842
  276    HA   ASN  37           HA       ASN  37  43.056  -8.030   5.150
  277    HB2  ASN  37           HB2      ASN  37  43.779  -8.087   7.457
  278    HB3  ASN  37           HB3      ASN  37  43.506  -6.352   7.629
  279   HD21  ASN  37          HD21      ASN  37  41.540  -5.641   8.186
  280   HD22  ASN  37          HD22      ASN  37  40.155  -6.649   8.414
  281    H    TYR  38           H        TYR  38  43.333  -5.841   3.450
  282    HA   TYR  38           HA       TYR  38  42.027  -4.387   2.332
  283    HD1  TYR  38           HD2      TYR  38  41.507  -7.348   3.112
  284    HD2  TYR  38           HD1      TYR  38  38.350  -5.080   1.386
  285    HE1  TYR  38           HE2      TYR  38  41.068  -9.178   1.528
  286    HE2  TYR  38           HE1      TYR  38  37.900  -6.902  -0.204
  287    HH   TYR  38           HH       TYR  38  39.590  -8.953  -1.178
  288    HB2  TYR  38           HB2      TYR  38  39.961  -5.300   4.316
  289    HB3  TYR  38           HB3      TYR  38  39.615  -4.127   3.053
  290    H    ASP  39           H        ASP  39  43.799  -3.137   3.606
  291    HA   ASP  39           HA       ASP  39  43.077  -1.516   5.752
  292    HB2  ASP  39           HB2      ASP  39  45.358  -1.914   4.136
  293    HB3  ASP  39           HB3      ASP  39  45.028  -0.184   4.145
  294    H    ILE  40           H        ILE  40  41.946   0.171   5.949
  295    HA   ILE  40           HA       ILE  40  40.948   1.657   3.630
  296    HB   ILE  40           HB       ILE  40  40.043   2.721   6.161
  297   HG12  ILE  40          HG12      ILE  40  40.438   0.415   6.976
  298   HG13  ILE  40          HG13      ILE  40  38.731   0.842   6.971
  299   HG21  ILE  40          HG21      ILE  40  37.821   1.792   4.999
  300   HG22  ILE  40          HG22      ILE  40  38.908   1.760   3.611
  301   HG23  ILE  40          HG23      ILE  40  38.636   3.268   4.482
  302   HD11  ILE  40          HD11      ILE  40  38.223  -0.792   5.555
  303   HD12  ILE  40          HD12      ILE  40  39.820  -1.438   5.931
  304   HD13  ILE  40          HD13      ILE  40  39.591  -0.430   4.502
  305    H    GLY  41           H        GLY  41  42.570   1.971   6.707
  306    HA2  GLY  41           HA2      GLY  41  43.177   4.623   6.792
  307    HA3  GLY  41           HA3      GLY  41  44.210   3.375   7.440
  308    H    ALA  42           H        ALA  42  44.921   2.102   5.125
  309    HA   ALA  42           HA       ALA  42  46.966   3.861   4.164
  310    HB1  ALA  42           HB1      ALA  42  47.306   1.410   4.465
  311    HB2  ALA  42           HB2      ALA  42  47.746   1.993   2.860
  312    HB3  ALA  42           HB3      ALA  42  46.222   1.141   3.104
  313    H    ALA  43           H        ALA  43  44.092   2.371   2.905
  314    HA   ALA  43           HA       ALA  43  44.010   3.041   0.295
  315    HB1  ALA  43           HB1      ALA  43  42.152   2.054   1.799
  316    HB2  ALA  43           HB2      ALA  43  41.694   2.971   0.364
  317    HB3  ALA  43           HB3      ALA  43  41.614   3.727   1.955
  318    H    LEU  44           H        LEU  44  43.565   5.258   2.993
  319    HA   LEU  44           HA       LEU  44  42.856   7.561   1.551
  320    HG   LEU  44           HG       LEU  44  41.629   8.622   3.538
  321    HB2  LEU  44           HB2      LEU  44  44.129   7.068   4.213
  322    HB3  LEU  44           HB3      LEU  44  44.035   8.708   3.584
  323   HD11  LEU  44          HD11      LEU  44  41.712   5.836   4.656
  324   HD12  LEU  44          HD12      LEU  44  41.595   6.150   2.924
  325   HD13  LEU  44          HD13      LEU  44  40.332   6.726   4.013
  326   HD21  LEU  44          HD21      LEU  44  41.152   8.257   5.943
  327   HD22  LEU  44          HD22      LEU  44  42.578   9.253   5.653
  328   HD23  LEU  44          HD23      LEU  44  42.765   7.564   6.121
  329    H    ASP  45           H        ASP  45  45.943   6.382   2.677
  330    HA   ASP  45           HA       ASP  45  47.738   8.242   1.978
  331    HB2  ASP  45           HB2      ASP  45  48.301   6.034   2.938
  332    HB3  ASP  45           HB3      ASP  45  48.076   5.307   1.351
  333    H    THR  46           H        THR  46  46.659   5.743  -0.364
  334    HA   THR  46           HA       THR  46  47.809   7.365  -2.489
  335    HB   THR  46           HB       THR  46  46.967   5.145  -3.773
  336    HG1  THR  46           HG1      THR  46  46.172   4.191  -1.887
  337   HG21  THR  46          HG21      THR  46  49.393   6.195  -3.095
  338   HG22  THR  46          HG22      THR  46  49.134   4.739  -4.056
  339   HG23  THR  46          HG23      THR  46  49.432   4.610  -2.322
  340    H    ILE  47           H        ILE  47  44.598   6.596  -1.335
  341    HA   ILE  47           HA       ILE  47  43.252   6.801  -3.801
  342    HB   ILE  47           HB       ILE  47  41.234   7.478  -2.469
  343   HG12  ILE  47          HG12      ILE  47  41.973   6.777   0.101
  344   HG13  ILE  47          HG13      ILE  47  43.299   7.799  -0.447
  345   HG21  ILE  47          HG21      ILE  47  40.838   5.301  -2.372
  346   HG22  ILE  47          HG22      ILE  47  41.920   5.127  -0.994
  347   HG23  ILE  47          HG23      ILE  47  42.552   4.998  -2.628
  348   HD11  ILE  47          HD11      ILE  47  41.018   8.706   0.675
  349   HD12  ILE  47          HD12      ILE  47  40.625   8.832  -1.040
  350   HD13  ILE  47          HD13      ILE  47  42.050   9.651  -0.400
  351    H    GLN  48           H        GLN  48  43.847   9.350  -1.345
  352    HA   GLN  48           HA       GLN  48  44.112  11.329  -3.376
  353    HB2  GLN  48           HB2      GLN  48  41.469  10.929  -2.132
  354    HB3  GLN  48           HB3      GLN  48  42.030  12.594  -2.200
  355    HG2  GLN  48           HG2      GLN  48  41.588  12.740  -4.364
  356    HG3  GLN  48           HG3      GLN  48  42.456  11.247  -4.712
  357   HE21  GLN  48          HE21      GLN  48  41.312   9.240  -4.440
  358   HE22  GLN  48          HE22      GLN  48  39.593   9.195  -4.663
  359    H    TYR  49           H        TYR  49  45.346  10.343  -0.803
  360    HA   TYR  49           HA       TYR  49  46.061  12.945   0.193
  361    HD1  TYR  49           HD1      TYR  49  42.526  11.302   0.728
  362    HD2  TYR  49           HD2      TYR  49  44.634  14.575   2.444
  363    HE1  TYR  49           HE1      TYR  49  40.521  12.708   0.496
  364    HE2  TYR  49           HE2      TYR  49  42.637  15.989   2.218
  365    HH   TYR  49           HH       TYR  49  39.984  15.424   2.086
  366    HB2  TYR  49           HB2      TYR  49  44.618  10.965   1.969
  367    HB3  TYR  49           HB3      TYR  49  45.529  12.346   2.575
  368    H    SER  50           H        SER  50  48.233  12.834   0.435
  369    HA   SER  50           HA       SER  50  49.381  10.231   1.191
  370    HG   SER  50           HG       SER  50  50.429  10.212  -1.854
  371    HB2  SER  50           HB2      SER  50  50.016  12.069  -0.976
  372    HB3  SER  50           HB3      SER  50  51.427  11.719   0.021
  373    H    LYS  51           H        LYS  51  48.727  11.388   3.354
  374    HA   LYS  51           HA       LYS  51  51.015  11.913   4.799
  375    HB2  LYS  51           HB2      LYS  51  50.528  14.093   3.208
  376    HB3  LYS  51           HB3      LYS  51  49.719  14.551   4.701
  377    HG2  LYS  51           HG2      LYS  51  51.672  15.185   5.515
  378    HG3  LYS  51           HG3      LYS  51  52.215  13.508   5.450
  379    HD2  LYS  51           HD2      LYS  51  52.299  14.901   2.873
  380    HD3  LYS  51           HD3      LYS  51  53.363  15.587   4.101
  381    HE2  LYS  51           HE2      LYS  51  54.491  13.519   4.400
  382    HE3  LYS  51           HE3      LYS  51  53.283  12.649   3.454
  383    HZ1  LYS  51           HZ1      LYS  51  54.898  14.807   2.247
  384    HZ2  LYS  51           HZ2      LYS  51  54.076  13.543   1.479
  385    HZ3  LYS  51           HZ3      LYS  51  55.492  13.227   2.347
  386    H    HIS  52           H        HIS  52  50.132  13.691   6.742
  387    HA   HIS  52           HA       HIS  52  47.597  12.475   7.613
  388    HD1  HIS  52           HD1      HIS  52  47.838  10.501  10.595
  389    HD2  HIS  52           HD2      HIS  52  48.214  14.623  10.950
  390    HE1  HIS  52           HE1      HIS  52  46.549  11.156  12.670
  391    HB2  HIS  52           HB2      HIS  52  49.396  11.474   8.889
  392    HB3  HIS  52           HB3      HIS  52  50.052  13.059   9.280
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1  26.381 -15.870   3.310
    2    H2   GLY   1           2H       GLY   1  26.277 -17.421   2.646
    3    H3   GLY   1           3H       GLY   1  25.668 -16.095   1.792
    4    HA2  GLY   1           HA2      GLY   1  28.522 -16.598   2.438
    5    HA3  GLY   1           HA3      GLY   1  27.777 -16.799   0.860
    6    H    SER   2           H        SER   2  29.926 -14.973   2.095
    7    HA   SER   2           HA       SER   2  28.810 -12.343   1.558
    8    HG   SER   2           HG       SER   2  29.796 -10.895   3.006
    9    HB2  SER   2           HB2      SER   2  30.570 -13.040   3.405
   10    HB3  SER   2           HB3      SER   2  31.720 -12.777   2.094
   11    HA   PRO   3           HA       PRO   3  30.302 -12.824  -2.664
   12    HB2  PRO   3           HB2      PRO   3  28.732 -10.952  -3.757
   13    HB3  PRO   3           HB3      PRO   3  28.083 -12.516  -3.248
   14    HG2  PRO   3           HG2      PRO   3  27.951  -9.869  -1.860
   15    HG3  PRO   3           HG3      PRO   3  26.694 -11.107  -2.031
   16    HD2  PRO   3           HD2      PRO   3  28.262 -10.771   0.213
   17    HD3  PRO   3           HD3      PRO   3  27.455 -12.288  -0.231
   18    HA   PRO   4           HA       PRO   4  33.275  -9.564  -2.981
   19    HB2  PRO   4           HB2      PRO   4  33.536  -9.310  -5.665
   20    HB3  PRO   4           HB3      PRO   4  34.147 -10.714  -4.780
   21    HG2  PRO   4           HG2      PRO   4  31.581 -10.411  -6.303
   22    HG3  PRO   4           HG3      PRO   4  32.748 -11.748  -6.346
   23    HD2  PRO   4           HD2      PRO   4  30.484 -11.887  -4.893
   24    HD3  PRO   4           HD3      PRO   4  32.000 -12.629  -4.335
   25    H    GLU   5           H        GLU   5  31.046  -8.378  -2.221
   26    HA   GLU   5           HA       GLU   5  31.154  -5.791  -3.170
   27    HB2  GLU   5           HB2      GLU   5  29.709  -7.493  -4.952
   28    HB3  GLU   5           HB3      GLU   5  28.570  -6.384  -4.203
   29    HG2  GLU   5           HG2      GLU   5  29.372  -4.609  -5.307
   30    HG3  GLU   5           HG3      GLU   5  31.047  -5.140  -5.154
   31    H    ALA   6           H        ALA   6  31.054  -5.816  -0.834
   32    HA   ALA   6           HA       ALA   6  29.552  -4.695   0.714
   33    HB1  ALA   6           HB1      ALA   6  27.608  -6.863  -0.063
   34    HB2  ALA   6           HB2      ALA   6  27.508  -5.165  -0.527
   35    HB3  ALA   6           HB3      ALA   6  27.348  -5.627   1.167
   36    H    ASP   7           H        ASP   7  31.695  -6.531   0.838
   37    HA   ASP   7           HA       ASP   7  30.964  -8.485   2.868
   38    HB2  ASP   7           HB2      ASP   7  33.698  -7.834   1.735
   39    HB3  ASP   7           HB3      ASP   7  33.279  -9.231   2.721
   40    HA   PRO   8           HA       PRO   8  31.743  -6.330   6.621
   41    HB2  PRO   8           HB2      PRO   8  34.262  -7.959   6.732
   42    HB3  PRO   8           HB3      PRO   8  33.103  -7.603   8.019
   43    HG2  PRO   8           HG2      PRO   8  33.104  -9.950   6.651
   44    HG3  PRO   8           HG3      PRO   8  31.638  -9.231   7.335
   45    HD2  PRO   8           HD2      PRO   8  32.384  -9.565   4.538
   46    HD3  PRO   8           HD3      PRO   8  30.824  -9.075   5.225
   47    H    ARG   9           H        ARG   9  34.835  -7.028   5.001
   48    HA   ARG   9           HA       ARG   9  36.084  -4.609   5.702
   49    HE   ARG   9           HE       ARG   9  37.181  -8.923   6.945
   50    HB2  ARG   9           HB2      ARG   9  36.695  -6.457   3.396
   51    HB3  ARG   9           HB3      ARG   9  37.791  -5.271   4.101
   52    HG2  ARG   9           HG2      ARG   9  38.550  -6.974   5.332
   53    HG3  ARG   9           HG3      ARG   9  37.081  -6.756   6.281
   54    HD2  ARG   9           HD2      ARG   9  36.063  -8.320   4.411
   55    HD3  ARG   9           HD3      ARG   9  37.743  -8.826   4.247
   56   HH11  ARG   9          HH11      ARG   9  35.961 -10.417   4.046
   57   HH12  ARG   9          HH12      ARG   9  35.478 -11.876   4.844
   58   HH21  ARG   9          HH21      ARG   9  36.551 -10.845   8.008
   59   HH22  ARG   9          HH22      ARG   9  35.818 -12.122   7.094
   60    H    LEU  10           H        LEU  10  34.147  -5.470   2.932
   61    HA   LEU  10           HA       LEU  10  34.838  -3.031   1.550
   62    HG   LEU  10           HG       LEU  10  34.677  -5.840  -0.871
   63    HB2  LEU  10           HB2      LEU  10  33.113  -5.374   0.829
   64    HB3  LEU  10           HB3      LEU  10  33.150  -3.920  -0.153
   65   HD11  LEU  10          HD11      LEU  10  35.366  -4.066  -2.051
   66   HD12  LEU  10          HD12      LEU  10  36.683  -3.978  -0.880
   67   HD13  LEU  10          HD13      LEU  10  35.243  -2.981  -0.667
   68   HD21  LEU  10          HD21      LEU  10  36.266  -4.843   1.498
   69   HD22  LEU  10          HD22      LEU  10  36.845  -5.966   0.268
   70   HD23  LEU  10          HD23      LEU  10  35.525  -6.437   1.341
   71    H    ILE  11           H        ILE  11  32.245  -4.316   3.468
   72    HA   ILE  11           HA       ILE  11  30.479  -2.091   2.908
   73    HB   ILE  11           HB       ILE  11  29.712  -4.446   3.609
   74   HG12  ILE  11          HG12      ILE  11  28.440  -2.584   5.515
   75   HG13  ILE  11          HG13      ILE  11  28.528  -2.006   3.853
   76   HG21  ILE  11          HG21      ILE  11  31.188  -4.849   5.441
   77   HG22  ILE  11          HG22      ILE  11  29.547  -4.758   6.081
   78   HG23  ILE  11          HG23      ILE  11  30.645  -3.390   6.271
   79   HD11  ILE  11          HD11      ILE  11  26.731  -3.202   3.390
   80   HD12  ILE  11          HD12      ILE  11  26.730  -3.886   5.017
   81   HD13  ILE  11          HD13      ILE  11  27.645  -4.672   3.731
   82    H    GLU  12           H        GLU  12  33.027  -2.988   4.968
   83    HA   GLU  12           HA       GLU  12  32.581  -0.755   6.816
   84    HB2  GLU  12           HB2      GLU  12  34.579  -3.020   6.896
   85    HB3  GLU  12           HB3      GLU  12  34.525  -1.712   8.067
   86    HG2  GLU  12           HG2      GLU  12  32.364  -2.375   8.825
   87    HG3  GLU  12           HG3      GLU  12  32.215  -3.560   7.530
   88    H    SER  13           H        SER  13  35.347  -2.104   4.989
   89    HA   SER  13           HA       SER  13  36.787   0.357   5.123
   90    HG   SER  13           HG       SER  13  39.500  -1.293   4.769
   91    HB2  SER  13           HB2      SER  13  37.581  -2.193   4.780
   92    HB3  SER  13           HB3      SER  13  37.613  -1.643   3.105
   93    H    LEU  14           H        LEU  14  34.942  -1.257   2.476
   94    HA   LEU  14           HA       LEU  14  35.682   0.747   0.578
   95    HG   LEU  14           HG       LEU  14  35.596  -1.031  -1.440
   96    HB2  LEU  14           HB2      LEU  14  34.314  -1.662   0.436
   97    HB3  LEU  14           HB3      LEU  14  33.076  -0.471   0.094
   98   HD11  LEU  14          HD11      LEU  14  32.800  -0.688  -2.469
   99   HD12  LEU  14          HD12      LEU  14  33.386  -2.234  -1.854
  100   HD13  LEU  14          HD13      LEU  14  34.174  -1.482  -3.239
  101   HD21  LEU  14          HD21      LEU  14  34.115   1.504  -1.174
  102   HD22  LEU  14          HD22      LEU  14  34.506   0.998  -2.818
  103   HD23  LEU  14          HD23      LEU  14  35.793   1.208  -1.630
  104    H    SER  15           H        SER  15  32.590   0.112   2.240
  105    HA   SER  15           HA       SER  15  31.251   2.436   1.669
  106    HG   SER  15           HG       SER  15  29.436   2.589   2.616
  107    HB2  SER  15           HB2      SER  15  30.561   0.333   3.059
  108    HB3  SER  15           HB3      SER  15  31.069   1.306   4.439
  109    H    GLN  16           H        GLN  16  34.123   2.314   3.291
  110    HA   GLN  16           HA       GLN  16  33.670   4.809   4.774
  111    HB2  GLN  16           HB2      GLN  16  35.309   4.237   6.217
  112    HB3  GLN  16           HB3      GLN  16  35.126   2.623   5.558
  113    HG2  GLN  16           HG2      GLN  16  37.443   3.138   5.620
  114    HG3  GLN  16           HG3      GLN  16  36.932   3.146   3.937
  115   HE21  GLN  16          HE21      GLN  16  37.979   4.627   2.857
  116   HE22  GLN  16          HE22      GLN  16  38.337   6.230   3.390
  117    H    MET  17           H        MET  17  35.483   3.329   2.195
  118    HA   MET  17           HA       MET  17  36.785   5.823   1.489
  119    HB2  MET  17           HB2      MET  17  37.471   3.133   1.229
  120    HB3  MET  17           HB3      MET  17  37.134   3.663  -0.414
  121    HG2  MET  17           HG2      MET  17  38.660   5.710   0.594
  122    HG3  MET  17           HG3      MET  17  39.376   4.276   1.329
  123    HE1  MET  17           HE1      MET  17  38.454   2.259  -0.615
  124    HE2  MET  17           HE2      MET  17  40.175   1.967  -0.865
  125    HE3  MET  17           HE3      MET  17  39.127   2.295  -2.245
  126    H    LEU  18           H        LEU  18  33.798   4.398   0.840
  127    HA   LEU  18           HA       LEU  18  33.680   5.334  -1.914
  128    HG   LEU  18           HG       LEU  18  32.399   4.304  -3.213
  129    HB2  LEU  18           HB2      LEU  18  32.381   3.328  -0.566
  130    HB3  LEU  18           HB3      LEU  18  31.157   4.585  -0.634
  131   HD11  LEU  18          HD11      LEU  18  32.934   2.074  -2.835
  132   HD12  LEU  18          HD12      LEU  18  31.350   1.993  -3.608
  133   HD13  LEU  18          HD13      LEU  18  31.490   1.791  -1.861
  134   HD21  LEU  18          HD21      LEU  18  30.326   4.836  -3.793
  135   HD22  LEU  18          HD22      LEU  18  29.886   4.816  -2.085
  136   HD23  LEU  18          HD23      LEU  18  29.693   3.362  -3.063
  137    H    SER  19           H        SER  19  31.573   5.919   0.922
  138    HA   SER  19           HA       SER  19  30.498   8.308  -0.096
  139    HG   SER  19           HG       SER  19  28.924   9.279   1.998
  140    HB2  SER  19           HB2      SER  19  29.214   7.176   1.527
  141    HB3  SER  19           HB3      SER  19  30.564   7.094   2.658
  142    H    MET  20           H        MET  20  33.607   7.910   0.730
  143    HA   MET  20           HA       MET  20  33.914  10.488   2.075
  144    HB2  MET  20           HB2      MET  20  35.290   8.064   2.307
  145    HB3  MET  20           HB3      MET  20  36.395   9.119   1.439
  146    HG2  MET  20           HG2      MET  20  35.800  10.825   3.313
  147    HG3  MET  20           HG3      MET  20  35.296   9.384   4.195
  148    HE1  MET  20           HE1      MET  20  37.222  11.428   5.087
  149    HE2  MET  20           HE2      MET  20  38.892  10.891   5.275
  150    HE3  MET  20           HE3      MET  20  37.599  10.073   6.152
  151    H    GLY  21           H        GLY  21  34.371   8.842  -0.928
  152    HA2  GLY  21           HA2      GLY  21  34.338  10.143  -2.972
  153    HA3  GLY  21           HA3      GLY  21  35.289  11.369  -2.138
  154    H    PHE  22           H        PHE  22  35.830   7.879  -2.031
  155    HA   PHE  22           HA       PHE  22  38.188   8.220  -3.713
  156    HD1  PHE  22           HD2      PHE  22  37.316   9.210  -0.214
  157    HD2  PHE  22           HD1      PHE  22  41.095   8.648  -2.089
  158    HE1  PHE  22           HE2      PHE  22  38.079  11.366   0.690
  159    HE2  PHE  22           HE1      PHE  22  41.865  10.805  -1.188
  160    HZ   PHE  22           HZ       PHE  22  40.355  12.164   0.198
  161    HB2  PHE  22           HB2      PHE  22  38.193   6.929  -0.976
  162    HB3  PHE  22           HB3      PHE  22  39.548   6.922  -2.108
  163    H    SER  23           H        SER  23  39.167   6.038  -4.144
  164    HA   SER  23           HA       SER  23  37.471   3.772  -3.946
  165    HG   SER  23           HG       SER  23  35.620   4.882  -4.970
  166    HB2  SER  23           HB2      SER  23  37.852   4.963  -6.708
  167    HB3  SER  23           HB3      SER  23  36.999   3.468  -6.326
  168    H    ASP  24           H        ASP  24  38.811   2.969  -6.719
  169    HA   ASP  24           HA       ASP  24  41.413   2.316  -5.500
  170    HB2  ASP  24           HB2      ASP  24  41.461   0.388  -7.032
  171    HB3  ASP  24           HB3      ASP  24  40.010   0.362  -6.026
  172    H    GLU  25           H        GLU  25  43.000   3.606  -6.250
  173    HA   GLU  25           HA       GLU  25  42.896   5.296  -8.396
  174    HB2  GLU  25           HB2      GLU  25  44.701   5.298  -6.710
  175    HB3  GLU  25           HB3      GLU  25  45.382   3.865  -7.470
  176    HG2  GLU  25           HG2      GLU  25  46.011   5.041  -9.388
  177    HG3  GLU  25           HG3      GLU  25  44.967   6.407  -8.997
  178    H    GLY  26           H        GLY  26  44.712   2.290  -8.508
  179    HA2  GLY  26           HA2      GLY  26  43.944   2.027 -11.346
  180    HA3  GLY  26           HA3      GLY  26  45.569   1.671 -10.766
  181    H    GLY  27           H        GLY  27  42.617   0.862  -9.049
  182    HA2  GLY  27           HA2      GLY  27  41.568  -1.185  -8.728
  183    HA3  GLY  27           HA3      GLY  27  42.618  -1.883  -9.952
  184    H    TRP  28           H        TRP  28  43.634  -0.130  -7.102
  185    HA   TRP  28           HA       TRP  28  45.094  -2.517  -6.255
  186    HD1  TRP  28           HD1      TRP  28  46.068   1.948  -6.917
  187    HE1  TRP  28           HE1      TRP  28  45.097   3.897  -5.554
  188    HE3  TRP  28           HE3      TRP  28  44.451  -0.616  -2.808
  189    HZ2  TRP  28           HZ2      TRP  28  43.816   4.306  -3.101
  190    HZ3  TRP  28           HZ3      TRP  28  43.353   0.635  -1.000
  191    HH2  TRP  28           HH2      TRP  28  43.043   3.050  -1.148
  192    HB2  TRP  28           HB2      TRP  28  46.422  -1.034  -4.816
  193    HB3  TRP  28           HB3      TRP  28  46.470  -0.535  -6.505
  194    H    LEU  29           H        LEU  29  42.653  -0.233  -5.083
  195    HA   LEU  29           HA       LEU  29  42.544  -0.847  -2.429
  196    HG   LEU  29           HG       LEU  29  39.472  -2.056  -3.316
  197    HB2  LEU  29           HB2      LEU  29  40.793   0.488  -2.632
  198    HB3  LEU  29           HB3      LEU  29  40.682   0.180  -4.350
  199   HD11  LEU  29          HD11      LEU  29  38.181   0.003  -1.677
  200   HD12  LEU  29          HD12      LEU  29  39.753  -0.548  -1.096
  201   HD13  LEU  29          HD13      LEU  29  38.451  -1.710  -1.351
  202   HD21  LEU  29          HD21      LEU  29  38.646  -0.639  -5.133
  203   HD22  LEU  29          HD22      LEU  29  38.165   0.582  -3.953
  204   HD23  LEU  29          HD23      LEU  29  37.382  -0.999  -3.958
  205    H    THR  30           H        THR  30  40.804  -2.728  -4.917
  206    HA   THR  30           HA       THR  30  39.979  -4.802  -3.296
  207    HB   THR  30           HB       THR  30  39.193  -4.763  -5.533
  208    HG1  THR  30           HG1      THR  30  40.998  -6.932  -5.267
  209   HG21  THR  30          HG21      THR  30  41.851  -5.399  -6.711
  210   HG22  THR  30          HG22      THR  30  41.405  -3.720  -6.406
  211   HG23  THR  30          HG23      THR  30  40.414  -4.717  -7.472
  212    H    ARG  31           H        ARG  31  43.171  -4.120  -4.540
  213    HA   ARG  31           HA       ARG  31  44.195  -6.694  -3.616
  214    HE   ARG  31           HE       ARG  31  46.726  -3.943  -6.970
  215    HB2  ARG  31           HB2      ARG  31  46.004  -4.639  -4.769
  216    HB3  ARG  31           HB3      ARG  31  45.994  -6.383  -4.990
  217    HG2  ARG  31           HG2      ARG  31  43.821  -5.991  -6.309
  218    HG3  ARG  31           HG3      ARG  31  44.341  -4.306  -6.367
  219    HD2  ARG  31           HD2      ARG  31  45.920  -6.683  -7.343
  220    HD3  ARG  31           HD3      ARG  31  45.054  -5.533  -8.359
  221   HH11  ARG  31          HH11      ARG  31  47.227  -6.870  -8.793
  222   HH12  ARG  31          HH12      ARG  31  48.849  -6.461  -9.248
  223   HH21  ARG  31          HH21      ARG  31  48.863  -3.400  -7.565
  224   HH22  ARG  31          HH22      ARG  31  49.779  -4.492  -8.548
  225    H    LEU  32           H        LEU  32  45.427  -3.328  -3.319
  226    HA   LEU  32           HA       LEU  32  47.182  -3.762  -1.290
  227    HG   LEU  32           HG       LEU  32  44.689  -0.737  -0.933
  228    HB2  LEU  32           HB2      LEU  32  47.531  -1.589  -1.465
  229    HB3  LEU  32           HB3      LEU  32  46.209  -1.543  -2.608
  230   HD11  LEU  32          HD11      LEU  32  46.727  -1.706   0.933
  231   HD12  LEU  32          HD12      LEU  32  44.980  -1.570   1.125
  232   HD13  LEU  32          HD13      LEU  32  46.006  -0.150   1.342
  233   HD21  LEU  32          HD21      LEU  32  45.601   1.391  -0.569
  234   HD22  LEU  32          HD22      LEU  32  46.441   0.796  -2.000
  235   HD23  LEU  32          HD23      LEU  32  47.240   0.761  -0.431
  236    H    LEU  33           H        LEU  33  43.732  -2.877  -0.771
  237    HA   LEU  33           HA       LEU  33  43.651  -2.864   1.962
  238    HG   LEU  33           HG       LEU  33  41.234  -2.153   2.419
  239    HB2  LEU  33           HB2      LEU  33  41.759  -3.646  -0.148
  240    HB3  LEU  33           HB3      LEU  33  41.416  -4.336   1.422
  241   HD11  LEU  33          HD11      LEU  33  42.815  -1.366   0.181
  242   HD12  LEU  33          HD12      LEU  33  42.395  -0.442   1.623
  243   HD13  LEU  33          HD13      LEU  33  41.340  -0.402   0.211
  244   HD21  LEU  33          HD21      LEU  33  39.431  -1.151   0.892
  245   HD22  LEU  33          HD22      LEU  33  39.176  -2.779   1.518
  246   HD23  LEU  33          HD23      LEU  33  39.726  -2.551  -0.141
  247    H    GLN  34           H        GLN  34  43.062  -5.745   0.025
  248    HA   GLN  34           HA       GLN  34  43.121  -7.708   1.923
  249    HB2  GLN  34           HB2      GLN  34  42.733  -7.980  -0.528
  250    HB3  GLN  34           HB3      GLN  34  44.472  -7.941  -0.768
  251    HG2  GLN  34           HG2      GLN  34  44.271 -10.170  -0.658
  252    HG3  GLN  34           HG3      GLN  34  44.303  -9.886   1.082
  253   HE21  GLN  34          HE21      GLN  34  41.651  -8.673   1.086
  254   HE22  GLN  34          HE22      GLN  34  40.528  -9.972   0.903
  255    H    THR  35           H        THR  35  45.962  -6.386   0.226
  256    HA   THR  35           HA       THR  35  47.859  -7.829   1.821
  257    HB   THR  35           HB       THR  35  48.870  -5.426   0.499
  258    HG1  THR  35           HG1      THR  35  48.164  -7.173  -1.452
  259   HG21  THR  35          HG21      THR  35  49.551  -8.268   0.704
  260   HG22  THR  35          HG22      THR  35  50.592  -6.845   0.663
  261   HG23  THR  35          HG23      THR  35  49.946  -7.510  -0.837
  262    H    LYS  36           H        LYS  36  45.856  -5.521   2.653
  263    HA   LYS  36           HA       LYS  36  47.620  -4.435   4.723
  264    HB2  LYS  36           HB2      LYS  36  45.826  -2.891   2.890
  265    HB3  LYS  36           HB3      LYS  36  46.110  -2.307   4.525
  266    HG2  LYS  36           HG2      LYS  36  48.641  -2.845   3.694
  267    HG3  LYS  36           HG3      LYS  36  47.879  -2.307   2.199
  268    HD2  LYS  36           HD2      LYS  36  47.865  -0.184   2.888
  269    HD3  LYS  36           HD3      LYS  36  47.127  -0.634   4.428
  270    HE2  LYS  36           HE2      LYS  36  50.056  -0.996   3.843
  271    HE3  LYS  36           HE3      LYS  36  49.394   0.471   4.566
  272    HZ1  LYS  36           HZ1      LYS  36  49.588  -0.549   6.510
  273    HZ2  LYS  36           HZ2      LYS  36  49.967  -2.030   5.788
  274    HZ3  LYS  36           HZ3      LYS  36  48.351  -1.602   6.037
  275    H    ASN  37           H        ASN  37  45.678  -6.621   4.626
  276    HA   ASN  37           HA       ASN  37  43.992  -7.526   5.846
  277    HB2  ASN  37           HB2      ASN  37  43.946  -7.037   8.151
  278    HB3  ASN  37           HB3      ASN  37  45.606  -6.702   7.658
  279   HD21  ASN  37          HD21      ASN  37  46.416  -4.714   7.935
  280   HD22  ASN  37          HD22      ASN  37  45.532  -3.372   8.571
  281    H    TYR  38           H        TYR  38  43.292  -5.534   3.904
  282    HA   TYR  38           HA       TYR  38  41.493  -4.354   3.202
  283    HD1  TYR  38           HD2      TYR  38  39.631  -4.509   2.035
  284    HD2  TYR  38           HD1      TYR  38  39.774  -8.123   4.272
  285    HE1  TYR  38           HE2      TYR  38  38.887  -5.755   0.052
  286    HE2  TYR  38           HE1      TYR  38  39.032  -9.383   2.295
  287    HH   TYR  38           HH       TYR  38  38.195  -9.218   0.212
  288    HB2  TYR  38           HB2      TYR  38  40.431  -6.159   5.292
  289    HB3  TYR  38           HB3      TYR  38  39.396  -4.814   4.826
  290    H    ASP  39           H        ASP  39  43.080  -2.643   4.245
  291    HA   ASP  39           HA       ASP  39  41.479  -1.111   6.189
  292    HB2  ASP  39           HB2      ASP  39  43.335  -0.499   7.379
  293    HB3  ASP  39           HB3      ASP  39  43.851  -2.086   6.813
  294    H    ILE  40           H        ILE  40  41.113   1.004   5.889
  295    HA   ILE  40           HA       ILE  40  41.619   2.031   3.222
  296    HB   ILE  40           HB       ILE  40  40.109   3.865   3.847
  297   HG12  ILE  40          HG12      ILE  40  40.803   3.641   6.347
  298   HG13  ILE  40          HG13      ILE  40  39.161   4.136   5.960
  299   HG21  ILE  40          HG21      ILE  40  38.326   1.801   4.690
  300   HG22  ILE  40          HG22      ILE  40  39.455   1.150   3.505
  301   HG23  ILE  40          HG23      ILE  40  38.480   2.563   3.107
  302   HD11  ILE  40          HD11      ILE  40  38.954   1.403   6.118
  303   HD12  ILE  40          HD12      ILE  40  38.537   2.553   7.387
  304   HD13  ILE  40          HD13      ILE  40  40.128   1.792   7.374
  305    H    GLY  41           H        GLY  41  42.457   2.525   6.553
  306    HA2  GLY  41           HA2      GLY  41  43.505   4.956   6.757
  307    HA3  GLY  41           HA3      GLY  41  44.358   3.569   7.396
  308    H    ALA  42           H        ALA  42  44.957   2.338   4.984
  309    HA   ALA  42           HA       ALA  42  47.083   4.091   4.010
  310    HB1  ALA  42           HB1      ALA  42  46.722   1.127   4.092
  311    HB2  ALA  42           HB2      ALA  42  48.058   2.106   4.697
  312    HB3  ALA  42           HB3      ALA  42  47.869   1.847   2.963
  313    H    ALA  43           H        ALA  43  44.108   2.739   3.064
  314    HA   ALA  43           HA       ALA  43  44.359   2.462   0.312
  315    HB1  ALA  43           HB1      ALA  43  42.036   3.354   2.009
  316    HB2  ALA  43           HB2      ALA  43  42.344   1.748   1.347
  317    HB3  ALA  43           HB3      ALA  43  41.903   3.076   0.275
  318    H    LEU  44           H        LEU  44  43.481   5.337   2.210
  319    HA   LEU  44           HA       LEU  44  43.288   7.117   0.021
  320    HG   LEU  44           HG       LEU  44  41.459   8.613   1.205
  321    HB2  LEU  44           HB2      LEU  44  43.577   7.430   2.986
  322    HB3  LEU  44           HB3      LEU  44  43.701   8.837   1.946
  323   HD11  LEU  44          HD11      LEU  44  41.431   6.196   0.888
  324   HD12  LEU  44          HD12      LEU  44  40.031   6.733   1.816
  325   HD13  LEU  44          HD13      LEU  44  41.388   5.960   2.636
  326   HD21  LEU  44          HD21      LEU  44  41.578   9.656   3.338
  327   HD22  LEU  44          HD22      LEU  44  41.712   8.101   4.160
  328   HD23  LEU  44          HD23      LEU  44  40.199   8.558   3.376
  329    H    ASP  45           H        ASP  45  45.861   6.787   2.481
  330    HA   ASP  45           HA       ASP  45  47.693   8.575   1.711
  331    HB2  ASP  45           HB2      ASP  45  48.019   6.851   3.486
  332    HB3  ASP  45           HB3      ASP  45  48.413   5.685   2.228
  333    H    THR  46           H        THR  46  46.760   5.787  -0.153
  334    HA   THR  46           HA       THR  46  48.885   6.265  -2.088
  335    HB   THR  46           HB       THR  46  48.307   4.152  -3.054
  336    HG1  THR  46           HG1      THR  46  46.242   3.748  -3.033
  337   HG21  THR  46          HG21      THR  46  48.734   2.646  -1.309
  338   HG22  THR  46          HG22      THR  46  48.005   3.709  -0.105
  339   HG23  THR  46          HG23      THR  46  49.542   4.146  -0.852
  340    H    ILE  47           H        ILE  47  45.460   6.835  -1.729
  341    HA   ILE  47           HA       ILE  47  45.397   7.590  -4.577
  342    HB   ILE  47           HB       ILE  47  43.958   5.716  -4.269
  343   HG12  ILE  47          HG12      ILE  47  42.602   8.368  -4.641
  344   HG13  ILE  47          HG13      ILE  47  43.038   7.169  -5.855
  345   HG21  ILE  47          HG21      ILE  47  42.433   5.406  -2.590
  346   HG22  ILE  47          HG22      ILE  47  42.167   7.137  -2.368
  347   HG23  ILE  47          HG23      ILE  47  43.631   6.387  -1.738
  348   HD11  ILE  47          HD11      ILE  47  40.911   6.549  -5.787
  349   HD12  ILE  47          HD12      ILE  47  40.614   7.450  -4.299
  350   HD13  ILE  47          HD13      ILE  47  41.284   5.820  -4.224
  351    H    GLN  48           H        GLN  48  46.116   9.701  -3.987
  352    HA   GLN  48           HA       GLN  48  45.559  11.933  -4.022
  353    HB2  GLN  48           HB2      GLN  48  42.857  11.305  -2.865
  354    HB3  GLN  48           HB3      GLN  48  43.343  12.693  -3.826
  355    HG2  GLN  48           HG2      GLN  48  43.007  11.631  -5.773
  356    HG3  GLN  48           HG3      GLN  48  43.610  10.091  -5.165
  357   HE21  GLN  48          HE21      GLN  48  41.660   9.495  -6.555
  358   HE22  GLN  48          HE22      GLN  48  40.148   9.352  -5.720
  359    H    TYR  49           H        TYR  49  46.026  10.003  -1.482
  360    HA   TYR  49           HA       TYR  49  46.019  12.292   0.355
  361    HD1  TYR  49           HD2      TYR  49  43.249  11.990  -0.316
  362    HD2  TYR  49           HD1      TYR  49  44.511  11.387   3.698
  363    HE1  TYR  49           HE2      TYR  49  41.576  13.612   0.444
  364    HE2  TYR  49           HE1      TYR  49  42.840  13.010   4.473
  365    HH   TYR  49           HH       TYR  49  41.506  14.792   3.704
  366    HB2  TYR  49           HB2      TYR  49  44.516   9.810   0.609
  367    HB3  TYR  49           HB3      TYR  49  45.511  10.159   2.026
  368    H    SER  50           H        SER  50  47.449  12.161   2.114
  369    HA   SER  50           HA       SER  50  49.597  10.171   1.840
  370    HG   SER  50           HG       SER  50  48.893  13.522   2.098
  371    HB2  SER  50           HB2      SER  50  51.244  12.013   2.355
  372    HB3  SER  50           HB3      SER  50  50.467  12.149   0.778
  373    H    LYS  51           H        LYS  51  47.271  10.670   3.702
  374    HA   LYS  51           HA       LYS  51  48.386   9.738   6.057
  375    HB2  LYS  51           HB2      LYS  51  48.949  12.452   5.762
  376    HB3  LYS  51           HB3      LYS  51  47.585  12.410   6.871
  377    HG2  LYS  51           HG2      LYS  51  48.793  11.493   8.535
  378    HG3  LYS  51           HG3      LYS  51  49.756  10.501   7.437
  379    HD2  LYS  51           HD2      LYS  51  51.099  12.409   6.821
  380    HD3  LYS  51           HD3      LYS  51  50.079  13.479   7.784
  381    HE2  LYS  51           HE2      LYS  51  51.320  11.162   9.158
  382    HE3  LYS  51           HE3      LYS  51  52.377  12.494   8.691
  383    HZ1  LYS  51           HZ1      LYS  51  51.594  13.740  10.333
  384    HZ2  LYS  51           HZ2      LYS  51  50.822  12.362  10.938
  385    HZ3  LYS  51           HZ3      LYS  51  49.983  13.424   9.927
  386    H    HIS  52           H        HIS  52  46.756  10.582   8.019
  387    HA   HIS  52           HA       HIS  52  44.077  10.089   6.906
  388    HD1  HIS  52           HD1      HIS  52  47.283   9.399   9.440
  389    HD2  HIS  52           HD2      HIS  52  43.732   9.544  11.595
  390    HE1  HIS  52           HE1      HIS  52  47.930   9.814  11.851
  391    HB2  HIS  52           HB2      HIS  52  43.506   8.985   8.995
  392    HB3  HIS  52           HB3      HIS  52  44.958   8.255   8.319
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1  31.351 -18.311   3.368
    2    H2   GLY   1           2H       GLY   1  30.630 -17.687   1.971
    3    H3   GLY   1           3H       GLY   1  30.248 -17.032   3.483
    4    HA2  GLY   1           HA2      GLY   1  32.740 -16.509   3.654
    5    HA3  GLY   1           HA3      GLY   1  32.726 -16.746   1.914
    6    H    SER   2           H        SER   2  33.502 -14.408   2.268
    7    HA   SER   2           HA       SER   2  31.144 -12.644   2.184
    8    HG   SER   2           HG       SER   2  32.440 -13.268   4.495
    9    HB2  SER   2           HB2      SER   2  33.786 -11.453   2.824
   10    HB3  SER   2           HB3      SER   2  32.187 -11.054   3.449
   11    HA   PRO   3           HA       PRO   3  33.014 -12.036  -1.889
   12    HB2  PRO   3           HB2      PRO   3  30.684 -12.081  -3.261
   13    HB3  PRO   3           HB3      PRO   3  31.509 -13.551  -2.737
   14    HG2  PRO   3           HG2      PRO   3  29.023 -12.357  -1.740
   15    HG3  PRO   3           HG3      PRO   3  29.632 -14.008  -1.547
   16    HD2  PRO   3           HD2      PRO   3  29.744 -11.807   0.328
   17    HD3  PRO   3           HD3      PRO   3  30.239 -13.492   0.569
   18    HA   PRO   4           HA       PRO   4  32.487  -7.677  -2.328
   19    HB2  PRO   4           HB2      PRO   4  32.533  -7.412  -5.062
   20    HB3  PRO   4           HB3      PRO   4  33.973  -7.643  -4.065
   21    HG2  PRO   4           HG2      PRO   4  32.413  -9.655  -5.638
   22    HG3  PRO   4           HG3      PRO   4  34.170  -9.479  -5.477
   23    HD2  PRO   4           HD2      PRO   4  32.811 -11.344  -4.103
   24    HD3  PRO   4           HD3      PRO   4  34.206 -10.502  -3.396
   25    H    GLU   5           H        GLU   5  30.153  -8.336  -1.568
   26    HA   GLU   5           HA       GLU   5  28.317  -7.139  -3.513
   27    HB2  GLU   5           HB2      GLU   5  28.098  -9.847  -2.293
   28    HB3  GLU   5           HB3      GLU   5  26.620  -8.908  -2.460
   29    HG2  GLU   5           HG2      GLU   5  27.262  -8.606  -4.894
   30    HG3  GLU   5           HG3      GLU   5  28.474  -9.855  -4.620
   31    H    ALA   6           H        ALA   6  29.669  -6.197  -1.095
   32    HA   ALA   6           HA       ALA   6  28.986  -4.573   0.418
   33    HB1  ALA   6           HB1      ALA   6  26.743  -4.205   1.008
   34    HB2  ALA   6           HB2      ALA   6  26.264  -5.838   0.542
   35    HB3  ALA   6           HB3      ALA   6  26.703  -4.660  -0.695
   36    H    ASP   7           H        ASP   7  30.552  -6.290   1.271
   37    HA   ASP   7           HA       ASP   7  29.364  -7.744   3.528
   38    HB2  ASP   7           HB2      ASP   7  31.889  -8.136   1.938
   39    HB3  ASP   7           HB3      ASP   7  31.722  -8.828   3.550
   40    HA   PRO   8           HA       PRO   8  30.861  -5.295   6.848
   41    HB2  PRO   8           HB2      PRO   8  32.917  -7.475   7.113
   42    HB3  PRO   8           HB3      PRO   8  32.021  -6.630   8.382
   43    HG2  PRO   8           HG2      PRO   8  31.266  -9.062   7.482
   44    HG3  PRO   8           HG3      PRO   8  30.096  -7.849   8.028
   45    HD2  PRO   8           HD2      PRO   8  30.583  -8.860   5.325
   46    HD3  PRO   8           HD3      PRO   8  29.224  -7.891   5.925
   47    H    ARG   9           H        ARG   9  33.580  -6.939   5.243
   48    HA   ARG   9           HA       ARG   9  35.462  -4.922   5.482
   49    HE   ARG   9           HE       ARG   9  37.961  -8.521   6.299
   50    HB2  ARG   9           HB2      ARG   9  35.234  -6.851   3.170
   51    HB3  ARG   9           HB3      ARG   9  36.700  -6.106   3.796
   52    HG2  ARG   9           HG2      ARG   9  35.045  -8.288   5.003
   53    HG3  ARG   9           HG3      ARG   9  36.762  -8.294   4.597
   54    HD2  ARG   9           HD2      ARG   9  36.398  -6.191   6.419
   55    HD3  ARG   9           HD3      ARG   9  35.466  -7.548   7.051
   56   HH11  ARG   9          HH11      ARG   9  36.618  -6.289   8.610
   57   HH12  ARG   9          HH12      ARG   9  37.869  -6.546   9.781
   58   HH21  ARG   9          HH21      ARG   9  39.613  -8.867   7.828
   59   HH22  ARG   9          HH22      ARG   9  39.576  -8.010   9.333
   60    H    LEU  10           H        LEU  10  33.273  -5.577   2.762
   61    HA   LEU  10           HA       LEU  10  34.192  -3.266   1.331
   62    HG   LEU  10           HG       LEU  10  33.420  -6.225  -0.828
   63    HB2  LEU  10           HB2      LEU  10  32.036  -5.281   0.770
   64    HB3  LEU  10           HB3      LEU  10  32.358  -3.919  -0.286
   65   HD11  LEU  10          HD11      LEU  10  35.600  -4.295  -0.911
   66   HD12  LEU  10          HD12      LEU  10  34.061  -3.635  -1.472
   67   HD13  LEU  10          HD13      LEU  10  34.729  -5.082  -2.227
   68   HD21  LEU  10          HD21      LEU  10  35.321  -5.203   1.283
   69   HD22  LEU  10          HD22      LEU  10  35.630  -6.549   0.187
   70   HD23  LEU  10          HD23      LEU  10  34.339  -6.664   1.382
   71    H    ILE  11           H        ILE  11  31.725  -3.877   3.625
   72    HA   ILE  11           HA       ILE  11  30.250  -1.482   2.822
   73    HB   ILE  11           HB       ILE  11  28.662  -2.017   4.601
   74   HG12  ILE  11          HG12      ILE  11  30.482  -4.354   5.185
   75   HG13  ILE  11          HG13      ILE  11  30.259  -2.949   6.219
   76   HG21  ILE  11          HG21      ILE  11  28.123  -3.047   2.558
   77   HG22  ILE  11          HG22      ILE  11  27.958  -4.316   3.771
   78   HG23  ILE  11          HG23      ILE  11  29.389  -4.261   2.741
   79   HD11  ILE  11          HD11      ILE  11  28.972  -4.707   7.134
   80   HD12  ILE  11          HD12      ILE  11  28.261  -5.093   5.565
   81   HD13  ILE  11          HD13      ILE  11  27.839  -3.586   6.379
   82    H    GLU  12           H        GLU  12  32.612  -2.632   4.942
   83    HA   GLU  12           HA       GLU  12  32.527  -0.259   6.655
   84    HB2  GLU  12           HB2      GLU  12  32.802  -2.506   7.700
   85    HB3  GLU  12           HB3      GLU  12  34.331  -2.677   6.849
   86    HG2  GLU  12           HG2      GLU  12  35.386  -1.090   8.147
   87    HG3  GLU  12           HG3      GLU  12  33.872  -0.321   8.621
   88    H    SER  13           H        SER  13  35.010  -2.131   4.911
   89    HA   SER  13           HA       SER  13  36.798   0.103   4.829
   90    HG   SER  13           HG       SER  13  37.959  -3.326   5.199
   91    HB2  SER  13           HB2      SER  13  37.347  -2.240   3.112
   92    HB3  SER  13           HB3      SER  13  38.394  -1.404   4.258
   93    H    LEU  14           H        LEU  14  34.832  -1.579   2.329
   94    HA   LEU  14           HA       LEU  14  35.921   0.094   0.265
   95    HG   LEU  14           HG       LEU  14  33.976   0.239  -1.640
   96    HB2  LEU  14           HB2      LEU  14  35.209  -1.989  -0.519
   97    HB3  LEU  14           HB3      LEU  14  33.679  -1.886   0.312
   98   HD11  LEU  14          HD11      LEU  14  34.991  -2.295  -2.414
   99   HD12  LEU  14          HD12      LEU  14  34.747  -0.856  -3.404
  100   HD13  LEU  14          HD13      LEU  14  33.453  -2.044  -3.239
  101   HD21  LEU  14          HD21      LEU  14  31.837  -1.257  -2.378
  102   HD22  LEU  14          HD22      LEU  14  31.799   0.004  -1.147
  103   HD23  LEU  14          HD23      LEU  14  31.982  -1.684  -0.674
  104    H    SER  15           H        SER  15  32.537  -0.162   1.459
  105    HA   SER  15           HA       SER  15  31.480   2.064   0.345
  106    HG   SER  15           HG       SER  15  29.632   2.312   3.653
  107    HB2  SER  15           HB2      SER  15  29.867   1.196   1.685
  108    HB3  SER  15           HB3      SER  15  31.036   0.639   2.883
  109    H    GLN  16           H        GLN  16  33.070   2.120   3.524
  110    HA   GLN  16           HA       GLN  16  33.206   4.720   4.115
  111    HB2  GLN  16           HB2      GLN  16  34.335   3.393   5.636
  112    HB3  GLN  16           HB3      GLN  16  35.231   2.541   4.388
  113    HG2  GLN  16           HG2      GLN  16  35.744   5.415   5.063
  114    HG3  GLN  16           HG3      GLN  16  36.549   4.086   5.891
  115   HE21  GLN  16          HE21      GLN  16  37.822   6.117   4.376
  116   HE22  GLN  16          HE22      GLN  16  38.602   5.361   3.031
  117    H    MET  17           H        MET  17  34.945   3.163   1.502
  118    HA   MET  17           HA       MET  17  36.397   5.615   0.876
  119    HB2  MET  17           HB2      MET  17  37.562   3.431   0.818
  120    HB3  MET  17           HB3      MET  17  36.492   2.917  -0.480
  121    HG2  MET  17           HG2      MET  17  37.347   4.892  -1.796
  122    HG3  MET  17           HG3      MET  17  38.577   5.074  -0.546
  123    HE1  MET  17           HE1      MET  17  40.610   3.381  -0.188
  124    HE2  MET  17           HE2      MET  17  40.567   1.738  -0.826
  125    HE3  MET  17           HE3      MET  17  39.334   2.273   0.315
  126    H    LEU  18           H        LEU  18  33.552   3.949  -0.127
  127    HA   LEU  18           HA       LEU  18  33.499   5.102  -2.776
  128    HG   LEU  18           HG       LEU  18  30.168   4.719  -2.899
  129    HB2  LEU  18           HB2      LEU  18  32.511   2.909  -2.368
  130    HB3  LEU  18           HB3      LEU  18  31.393   3.610  -1.213
  131   HD11  LEU  18          HD11      LEU  18  31.365   5.706  -4.503
  132   HD12  LEU  18          HD12      LEU  18  31.259   4.166  -5.357
  133   HD13  LEU  18          HD13      LEU  18  32.674   4.532  -4.371
  134   HD21  LEU  18          HD21      LEU  18  30.793   2.247  -4.422
  135   HD22  LEU  18          HD22      LEU  18  29.233   2.936  -3.969
  136   HD23  LEU  18          HD23      LEU  18  30.199   2.075  -2.771
  137    H    SER  19           H        SER  19  31.086   5.307  -0.137
  138    HA   SER  19           HA       SER  19  29.963   7.702  -1.119
  139    HG   SER  19           HG       SER  19  28.085   7.025  -0.865
  140    HB2  SER  19           HB2      SER  19  29.575   5.952   1.240
  141    HB3  SER  19           HB3      SER  19  29.007   7.615   1.391
  142    H    MET  20           H        MET  20  32.928   7.606  -0.015
  143    HA   MET  20           HA       MET  20  32.679  10.036   1.626
  144    HB2  MET  20           HB2      MET  20  33.948   7.846   2.421
  145    HB3  MET  20           HB3      MET  20  35.256   8.539   1.471
  146    HG2  MET  20           HG2      MET  20  33.824  10.173   3.526
  147    HG3  MET  20           HG3      MET  20  35.112   9.063   3.987
  148    HE1  MET  20           HE1      MET  20  34.541  12.222   4.152
  149    HE2  MET  20           HE2      MET  20  35.956  13.129   3.616
  150    HE3  MET  20           HE3      MET  20  36.113  11.923   4.893
  151    H    GLY  21           H        GLY  21  33.829   8.668  -1.291
  152    HA2  GLY  21           HA2      GLY  21  34.232  10.100  -3.184
  153    HA3  GLY  21           HA3      GLY  21  34.918  11.289  -2.077
  154    H    PHE  22           H        PHE  22  35.506   7.796  -2.335
  155    HA   PHE  22           HA       PHE  22  38.240   8.355  -3.196
  156    HD1  PHE  22           HD1      PHE  22  39.734   9.324  -2.012
  157    HD2  PHE  22           HD2      PHE  22  37.506   7.661   1.209
  158    HE1  PHE  22           HE1      PHE  22  40.416  11.201  -0.577
  159    HE2  PHE  22           HE2      PHE  22  38.182   9.536   2.650
  160    HZ   PHE  22           HZ       PHE  22  39.636  11.309   1.758
  161    HB2  PHE  22           HB2      PHE  22  37.427   6.640  -0.838
  162    HB3  PHE  22           HB3      PHE  22  39.034   6.611  -1.565
  163    H    SER  23           H        SER  23  39.179   6.668  -4.358
  164    HA   SER  23           HA       SER  23  37.558   4.313  -4.835
  165    HG   SER  23           HG       SER  23  36.936   7.147  -6.042
  166    HB2  SER  23           HB2      SER  23  38.505   5.943  -7.196
  167    HB3  SER  23           HB3      SER  23  37.374   4.588  -7.193
  168    H    ASP  24           H        ASP  24  39.149   3.738  -7.283
  169    HA   ASP  24           HA       ASP  24  41.619   2.968  -5.901
  170    HB2  ASP  24           HB2      ASP  24  41.561   1.718  -8.414
  171    HB3  ASP  24           HB3      ASP  24  41.219   0.975  -6.852
  172    H    GLU  25           H        GLU  25  43.291   4.271  -6.230
  173    HA   GLU  25           HA       GLU  25  43.365   6.009  -8.548
  174    HB2  GLU  25           HB2      GLU  25  44.148   6.439  -6.032
  175    HB3  GLU  25           HB3      GLU  25  45.675   5.853  -6.679
  176    HG2  GLU  25           HG2      GLU  25  44.681   7.719  -8.532
  177    HG3  GLU  25           HG3      GLU  25  44.477   8.429  -6.932
  178    H    GLY  26           H        GLY  26  43.468   3.436  -9.391
  179    HA2  GLY  26           HA2      GLY  26  45.165   3.119 -11.316
  180    HA3  GLY  26           HA3      GLY  26  46.291   2.881  -9.987
  181    H    GLY  27           H        GLY  27  43.256   1.689  -9.149
  182    HA2  GLY  27           HA2      GLY  27  42.277  -0.412  -9.292
  183    HA3  GLY  27           HA3      GLY  27  43.559  -0.903 -10.393
  184    H    TRP  28           H        TRP  28  44.114   0.576  -7.265
  185    HA   TRP  28           HA       TRP  28  45.548  -1.828  -6.465
  186    HD1  TRP  28           HD1      TRP  28  46.341   2.633  -6.718
  187    HE1  TRP  28           HE1      TRP  28  45.037   4.492  -5.516
  188    HE3  TRP  28           HE3      TRP  28  44.169  -0.144  -3.038
  189    HZ2  TRP  28           HZ2      TRP  28  43.300   4.745  -3.311
  190    HZ3  TRP  28           HZ3      TRP  28  42.700   0.974  -1.420
  191    HH2  TRP  28           HH2      TRP  28  42.268   3.369  -1.555
  192    HB2  TRP  28           HB2      TRP  28  46.480  -0.395  -4.654
  193    HB3  TRP  28           HB3      TRP  28  46.836   0.181  -6.282
  194    H    LEU  29           H        LEU  29  42.750   0.118  -5.496
  195    HA   LEU  29           HA       LEU  29  42.309  -0.599  -2.934
  196    HG   LEU  29           HG       LEU  29  39.547  -2.099  -3.643
  197    HB2  LEU  29           HB2      LEU  29  40.605   0.680  -3.733
  198    HB3  LEU  29           HB3      LEU  29  40.516  -0.180  -5.258
  199   HD11  LEU  29          HD11      LEU  29  39.773  -0.812  -1.607
  200   HD12  LEU  29          HD12      LEU  29  38.066  -1.057  -1.979
  201   HD13  LEU  29          HD13      LEU  29  38.825   0.502  -2.304
  202   HD21  LEU  29          HD21      LEU  29  37.490  -0.116  -4.217
  203   HD22  LEU  29          HD22      LEU  29  37.682  -1.762  -4.823
  204   HD23  LEU  29          HD23      LEU  29  38.558  -0.434  -5.585
  205    H    THR  30           H        THR  30  40.931  -2.571  -5.550
  206    HA   THR  30           HA       THR  30  40.207  -4.783  -4.181
  207    HB   THR  30           HB       THR  30  41.518  -4.549  -6.879
  208    HG1  THR  30           HG1      THR  30  38.946  -4.695  -5.853
  209   HG21  THR  30          HG21      THR  30  41.813  -6.883  -5.698
  210   HG22  THR  30          HG22      THR  30  41.343  -6.758  -7.391
  211   HG23  THR  30          HG23      THR  30  40.121  -7.065  -6.158
  212    H    ARG  31           H        ARG  31  43.458  -3.716  -4.816
  213    HA   ARG  31           HA       ARG  31  44.628  -6.156  -3.741
  214    HE   ARG  31           HE       ARG  31  47.247  -2.650  -5.958
  215    HB2  ARG  31           HB2      ARG  31  46.364  -3.845  -4.354
  216    HB3  ARG  31           HB3      ARG  31  46.551  -5.539  -4.782
  217    HG2  ARG  31           HG2      ARG  31  44.762  -5.209  -6.505
  218    HG3  ARG  31           HG3      ARG  31  44.845  -3.484  -6.157
  219    HD2  ARG  31           HD2      ARG  31  47.199  -5.158  -7.016
  220    HD3  ARG  31           HD3      ARG  31  46.207  -4.207  -8.120
  221   HH11  ARG  31          HH11      ARG  31  47.996  -4.010  -9.075
  222   HH12  ARG  31          HH12      ARG  31  49.205  -2.826  -9.445
  223   HH21  ARG  31          HH21      ARG  31  48.839  -1.086  -6.436
  224   HH22  ARG  31          HH22      ARG  31  49.682  -1.164  -7.947
  225    H    LEU  32           H        LEU  32  45.140  -2.666  -3.115
  226    HA   LEU  32           HA       LEU  32  46.497  -2.676  -0.808
  227    HG   LEU  32           HG       LEU  32  45.536   0.830  -0.258
  228    HB2  LEU  32           HB2      LEU  32  45.534  -0.701  -2.030
  229    HB3  LEU  32           HB3      LEU  32  44.028  -0.978  -1.168
  230   HD11  LEU  32          HD11      LEU  32  44.847  -1.427   1.612
  231   HD12  LEU  32          HD12      LEU  32  43.724  -0.196   1.030
  232   HD13  LEU  32          HD13      LEU  32  45.089   0.265   2.048
  233   HD21  LEU  32          HD21      LEU  32  47.399   0.073   1.169
  234   HD22  LEU  32          HD22      LEU  32  47.667  -0.254  -0.543
  235   HD23  LEU  32          HD23      LEU  32  47.187  -1.561   0.540
  236    H    LEU  33           H        LEU  33  42.911  -2.642  -0.707
  237    HA   LEU  33           HA       LEU  33  42.460  -3.180   1.922
  238    HG   LEU  33           HG       LEU  33  41.073  -2.187  -0.814
  239    HB2  LEU  33           HB2      LEU  33  41.031  -4.607  -0.326
  240    HB3  LEU  33           HB3      LEU  33  40.396  -4.261   1.273
  241   HD11  LEU  33          HD11      LEU  33  39.144  -2.915  -1.703
  242   HD12  LEU  33          HD12      LEU  33  38.411  -1.996  -0.387
  243   HD13  LEU  33          HD13      LEU  33  38.649  -3.737  -0.223
  244   HD21  LEU  33          HD21      LEU  33  39.498  -1.746   1.698
  245   HD22  LEU  33          HD22      LEU  33  40.290  -0.562   0.658
  246   HD23  LEU  33          HD23      LEU  33  41.257  -1.616   1.690
  247    H    GLN  34           H        GLN  34  42.519  -5.719  -0.483
  248    HA   GLN  34           HA       GLN  34  42.652  -8.003   0.921
  249    HB2  GLN  34           HB2      GLN  34  44.279  -7.211  -1.462
  250    HB3  GLN  34           HB3      GLN  34  44.285  -8.858  -0.849
  251    HG2  GLN  34           HG2      GLN  34  41.846  -7.360  -1.783
  252    HG3  GLN  34           HG3      GLN  34  42.749  -8.532  -2.743
  253   HE21  GLN  34          HE21      GLN  34  40.094  -8.138  -0.887
  254   HE22  GLN  34          HE22      GLN  34  39.840  -9.768  -0.380
  255    H    THR  35           H        THR  35  45.511  -5.987   0.264
  256    HA   THR  35           HA       THR  35  47.266  -7.591   1.889
  257    HB   THR  35           HB       THR  35  47.572  -4.991   0.411
  258    HG1  THR  35           HG1      THR  35  48.287  -6.298  -1.041
  259   HG21  THR  35          HG21      THR  35  49.040  -4.492   2.104
  260   HG22  THR  35          HG22      THR  35  50.076  -5.362   0.973
  261   HG23  THR  35          HG23      THR  35  49.442  -6.183   2.399
  262    H    LYS  36           H        LYS  36  44.898  -5.656   2.692
  263    HA   LYS  36           HA       LYS  36  46.134  -4.788   5.216
  264    HB2  LYS  36           HB2      LYS  36  44.801  -3.182   3.208
  265    HB3  LYS  36           HB3      LYS  36  43.968  -3.072   4.749
  266    HG2  LYS  36           HG2      LYS  36  45.590  -1.307   4.580
  267    HG3  LYS  36           HG3      LYS  36  46.103  -2.455   5.821
  268    HD2  LYS  36           HD2      LYS  36  47.339  -3.524   3.698
  269    HD3  LYS  36           HD3      LYS  36  47.301  -1.836   3.188
  270    HE2  LYS  36           HE2      LYS  36  49.187  -1.646   4.386
  271    HE3  LYS  36           HE3      LYS  36  48.108  -1.613   5.780
  272    HZ1  LYS  36           HZ1      LYS  36  49.912  -3.698   4.882
  273    HZ2  LYS  36           HZ2      LYS  36  48.402  -4.237   5.423
  274    HZ3  LYS  36           HZ3      LYS  36  49.387  -3.317   6.445
  275    H    ASN  37           H        ASN  37  44.582  -7.185   4.360
  276    HA   ASN  37           HA       ASN  37  42.796  -8.457   5.015
  277    HB2  ASN  37           HB2      ASN  37  42.420  -8.538   7.389
  278    HB3  ASN  37           HB3      ASN  37  44.138  -8.213   7.143
  279   HD21  ASN  37          HD21      ASN  37  44.976  -6.618   8.270
  280   HD22  ASN  37          HD22      ASN  37  44.103  -5.320   9.004
  281    H    TYR  38           H        TYR  38  42.259  -5.973   3.691
  282    HA   TYR  38           HA       TYR  38  40.413  -4.816   3.011
  283    HD1  TYR  38           HD2      TYR  38  38.022  -5.730   1.691
  284    HD2  TYR  38           HD1      TYR  38  39.565  -8.572   4.454
  285    HE1  TYR  38           HE2      TYR  38  37.663  -7.518   0.042
  286    HE2  TYR  38           HE1      TYR  38  39.212 -10.368   2.812
  287    HH   TYR  38           HH       TYR  38  37.611 -10.704   0.766
  288    HB2  TYR  38           HB2      TYR  38  39.007  -6.375   5.184
  289    HB3  TYR  38           HB3      TYR  38  38.210  -5.233   4.117
  290    H    ASP  39           H        ASP  39  42.183  -3.453   4.365
  291    HA   ASP  39           HA       ASP  39  40.576  -1.907   6.306
  292    HB2  ASP  39           HB2      ASP  39  43.423  -2.784   6.455
  293    HB3  ASP  39           HB3      ASP  39  42.973  -1.242   7.181
  294    H    ILE  40           H        ILE  40  40.338   0.198   5.986
  295    HA   ILE  40           HA       ILE  40  41.473   1.317   3.586
  296    HB   ILE  40           HB       ILE  40  40.015   3.223   3.985
  297   HG12  ILE  40          HG12      ILE  40  40.284   2.846   6.589
  298   HG13  ILE  40          HG13      ILE  40  38.848   3.624   5.932
  299   HG21  ILE  40          HG21      ILE  40  39.054   0.467   3.849
  300   HG22  ILE  40          HG22      ILE  40  38.662   1.859   2.838
  301   HG23  ILE  40          HG23      ILE  40  37.834   1.625   4.378
  302   HD11  ILE  40          HD11      ILE  40  38.913   1.462   7.637
  303   HD12  ILE  40          HD12      ILE  40  38.560   0.747   6.064
  304   HD13  ILE  40          HD13      ILE  40  37.524   2.022   6.705
  305    H    GLY  41           H        GLY  41  42.030   1.278   6.946
  306    HA2  GLY  41           HA2      GLY  41  43.093   3.642   7.620
  307    HA3  GLY  41           HA3      GLY  41  43.844   2.132   8.101
  308    H    ALA  42           H        ALA  42  44.542   1.253   5.567
  309    HA   ALA  42           HA       ALA  42  46.790   3.026   4.986
  310    HB1  ALA  42           HB1      ALA  42  46.867   0.481   3.615
  311    HB2  ALA  42           HB2      ALA  42  46.667   0.278   5.355
  312    HB3  ALA  42           HB3      ALA  42  48.035   1.195   4.726
  313    H    ALA  43           H        ALA  43  43.894   1.736   3.642
  314    HA   ALA  43           HA       ALA  43  44.355   2.027   0.904
  315    HB1  ALA  43           HB1      ALA  43  42.280   1.066   1.900
  316    HB2  ALA  43           HB2      ALA  43  41.966   2.255   0.638
  317    HB3  ALA  43           HB3      ALA  43  41.775   2.700   2.332
  318    H    LEU  44           H        LEU  44  43.391   4.360   3.347
  319    HA   LEU  44           HA       LEU  44  42.927   6.614   1.827
  320    HG   LEU  44           HG       LEU  44  41.713   7.945   3.628
  321    HB2  LEU  44           HB2      LEU  44  43.915   6.111   4.585
  322    HB3  LEU  44           HB3      LEU  44  44.105   7.737   3.947
  323   HD11  LEU  44          HD11      LEU  44  40.311   6.226   3.476
  324   HD12  LEU  44          HD12      LEU  44  40.873   5.542   5.001
  325   HD13  LEU  44          HD13      LEU  44  41.725   5.175   3.503
  326   HD21  LEU  44          HD21      LEU  44  41.282   8.413   5.788
  327   HD22  LEU  44          HD22      LEU  44  42.973   7.968   6.020
  328   HD23  LEU  44          HD23      LEU  44  41.700   6.789   6.333
  329    H    ASP  45           H        ASP  45  45.982   5.938   3.503
  330    HA   ASP  45           HA       ASP  45  47.611   7.818   2.477
  331    HB2  ASP  45           HB2      ASP  45  48.531   6.363   4.072
  332    HB3  ASP  45           HB3      ASP  45  48.174   4.935   3.107
  333    H    THR  46           H        THR  46  46.308   5.151   0.653
  334    HA   THR  46           HA       THR  46  48.158   5.676  -1.545
  335    HB   THR  46           HB       THR  46  47.284   3.663  -2.570
  336    HG1  THR  46           HG1      THR  46  45.370   3.018  -2.091
  337   HG21  THR  46          HG21      THR  46  48.796   2.669  -1.293
  338   HG22  THR  46          HG22      THR  46  47.452   2.208  -0.248
  339   HG23  THR  46          HG23      THR  46  48.390   3.660   0.106
  340    H    ILE  47           H        ILE  47  44.700   5.893  -0.843
  341    HA   ILE  47           HA       ILE  47  43.904   6.469  -3.492
  342    HB   ILE  47           HB       ILE  47  42.124   7.845  -1.741
  343   HG12  ILE  47          HG12      ILE  47  42.685   5.017  -0.847
  344   HG13  ILE  47          HG13      ILE  47  43.205   6.447   0.035
  345   HG21  ILE  47          HG21      ILE  47  41.866   6.439  -3.951
  346   HG22  ILE  47          HG22      ILE  47  40.534   6.587  -2.805
  347   HG23  ILE  47          HG23      ILE  47  41.530   5.130  -2.816
  348   HD11  ILE  47          HD11      ILE  47  41.289   6.009   1.148
  349   HD12  ILE  47          HD12      ILE  47  40.514   5.265  -0.251
  350   HD13  ILE  47          HD13      ILE  47  40.628   7.021  -0.137
  351    H    GLN  48           H        GLN  48  45.102   8.541  -0.920
  352    HA   GLN  48           HA       GLN  48  45.855  10.546  -2.747
  353    HB2  GLN  48           HB2      GLN  48  43.161  10.784  -1.576
  354    HB3  GLN  48           HB3      GLN  48  44.154  12.226  -1.443
  355    HG2  GLN  48           HG2      GLN  48  43.764  12.746  -3.549
  356    HG3  GLN  48           HG3      GLN  48  44.403  11.195  -4.085
  357   HE21  GLN  48          HE21      GLN  48  42.341   9.641  -2.720
  358   HE22  GLN  48          HE22      GLN  48  40.897   9.841  -3.650
  359    H    TYR  49           H        TYR  49  44.698  10.232   0.610
  360    HA   TYR  49           HA       TYR  49  46.404  12.167   1.706
  361    HD1  TYR  49           HD1      TYR  49  43.122  10.834   1.493
  362    HD2  TYR  49           HD2      TYR  49  44.982  12.825   4.759
  363    HE1  TYR  49           HE1      TYR  49  41.183  12.327   1.676
  364    HE2  TYR  49           HE2      TYR  49  43.044  14.326   4.954
  365    HH   TYR  49           HH       TYR  49  41.213  15.168   3.478
  366    HB2  TYR  49           HB2      TYR  49  45.009   9.792   2.923
  367    HB3  TYR  49           HB3      TYR  49  45.974  10.911   3.884
  368    H    SER  50           H        SER  50  48.249  10.985   0.132
  369    HA   SER  50           HA       SER  50  49.740   9.068   1.726
  370    HG   SER  50           HG       SER  50  49.305   8.857  -1.955
  371    HB2  SER  50           HB2      SER  50  51.086   9.991  -0.668
  372    HB3  SER  50           HB3      SER  50  50.537   8.367  -0.254
  373    H    LYS  51           H        LYS  51  49.467  11.689   2.823
  374    HA   LYS  51           HA       LYS  51  52.145  12.219   3.509
  375    HB2  LYS  51           HB2      LYS  51  51.062  13.691   1.215
  376    HB3  LYS  51           HB3      LYS  51  51.730  14.726   2.470
  377    HG2  LYS  51           HG2      LYS  51  53.596  12.678   2.129
  378    HG3  LYS  51           HG3      LYS  51  53.081  13.130   0.503
  379    HD2  LYS  51           HD2      LYS  51  53.600  15.458   0.960
  380    HD3  LYS  51           HD3      LYS  51  54.041  15.053   2.620
  381    HE2  LYS  51           HE2      LYS  51  56.082  15.211   1.474
  382    HE3  LYS  51           HE3      LYS  51  55.767  13.483   1.610
  383    HZ1  LYS  51           HZ1      LYS  51  56.194  13.499  -0.574
  384    HZ2  LYS  51           HZ2      LYS  51  55.899  15.155  -0.743
  385    HZ3  LYS  51           HZ3      LYS  51  54.606  14.065  -0.733
  386    H    HIS  52           H        HIS  52  49.938  11.750   5.021
  387    HA   HIS  52           HA       HIS  52  49.239  14.380   6.146
  388    HD1  HIS  52           HD1      HIS  52  46.648  15.334   6.826
  389    HD2  HIS  52           HD2      HIS  52  46.865  11.775   8.957
  390    HE1  HIS  52           HE1      HIS  52  45.425  15.735   9.003
  391    HB2  HIS  52           HB2      HIS  52  47.294  13.079   5.424
  392    HB3  HIS  52           HB3      HIS  52  47.808  11.729   6.430
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1  32.768 -10.475  -9.191
    2    H2   GLY   1           2H       GLY   1  33.461 -11.981  -9.531
    3    H3   GLY   1           3H       GLY   1  34.446 -10.619  -9.345
    4    HA2  GLY   1           HA2      GLY   1  33.068 -12.213  -7.304
    5    HA3  GLY   1           HA3      GLY   1  34.720 -11.612  -7.314
    6    H    SER   2           H        SER   2  31.546 -11.088  -6.238
    7    HA   SER   2           HA       SER   2  32.239  -8.367  -5.349
    8    HG   SER   2           HG       SER   2  29.056 -10.100  -6.662
    9    HB2  SER   2           HB2      SER   2  29.456  -8.904  -4.990
   10    HB3  SER   2           HB3      SER   2  30.218  -7.720  -6.053
   11    HA   PRO   3           HA       PRO   3  32.181  -9.748  -1.155
   12    HB2  PRO   3           HB2      PRO   3  31.581  -7.447   0.109
   13    HB3  PRO   3           HB3      PRO   3  33.130  -7.687  -0.708
   14    HG2  PRO   3           HG2      PRO   3  30.676  -6.269  -1.687
   15    HG3  PRO   3           HG3      PRO   3  32.368  -5.743  -1.762
   16    HD2  PRO   3           HD2      PRO   3  31.100  -6.866  -3.875
   17    HD3  PRO   3           HD3      PRO   3  32.837  -7.089  -3.579
   18    HA   PRO   4           HA       PRO   4  28.223 -10.666   0.572
   19    HB2  PRO   4           HB2      PRO   4  28.685  -8.835   2.868
   20    HB3  PRO   4           HB3      PRO   4  28.265 -10.551   2.864
   21    HG2  PRO   4           HG2      PRO   4  30.740  -9.755   3.448
   22    HG3  PRO   4           HG3      PRO   4  30.453 -11.221   2.492
   23    HD2  PRO   4           HD2      PRO   4  31.355  -8.520   1.598
   24    HD3  PRO   4           HD3      PRO   4  31.834 -10.123   1.005
   25    H    GLU   5           H        GLU   5  26.684  -8.899   2.350
   26    HA   GLU   5           HA       GLU   5  25.733  -7.023   0.300
   27    HB2  GLU   5           HB2      GLU   5  24.084  -7.664   2.692
   28    HB3  GLU   5           HB3      GLU   5  23.585  -7.352   1.036
   29    HG2  GLU   5           HG2      GLU   5  23.109  -9.593   1.314
   30    HG3  GLU   5           HG3      GLU   5  24.675  -9.619   0.505
   31    H    ALA   6           H        ALA   6  27.971  -6.546   2.073
   32    HA   ALA   6           HA       ALA   6  28.645  -4.377   2.776
   33    HB1  ALA   6           HB1      ALA   6  26.373  -3.434   2.550
   34    HB2  ALA   6           HB2      ALA   6  27.189  -2.919   4.022
   35    HB3  ALA   6           HB3      ALA   6  25.947  -4.162   4.098
   36    H    ASP   7           H        ASP   7  29.777  -6.354   3.713
   37    HA   ASP   7           HA       ASP   7  29.172  -6.799   6.531
   38    HB2  ASP   7           HB2      ASP   7  29.664  -8.839   5.521
   39    HB3  ASP   7           HB3      ASP   7  30.901  -8.143   4.480
   40    HA   PRO   8           HA       PRO   8  32.102  -4.035   8.311
   41    HB2  PRO   8           HB2      PRO   8  33.197  -6.413   9.739
   42    HB3  PRO   8           HB3      PRO   8  32.676  -4.852  10.384
   43    HG2  PRO   8           HG2      PRO   8  31.130  -6.992  10.653
   44    HG3  PRO   8           HG3      PRO   8  30.423  -5.411  10.274
   45    HD2  PRO   8           HD2      PRO   8  30.876  -7.762   8.493
   46    HD3  PRO   8           HD3      PRO   8  29.541  -6.595   8.502
   47    H    ARG   9           H        ARG   9  33.075  -6.469   6.232
   48    HA   ARG   9           HA       ARG   9  35.924  -5.972   6.502
   49    HE   ARG   9           HE       ARG   9  35.560 -11.235   4.946
   50    HB2  ARG   9           HB2      ARG   9  34.266  -7.906   4.909
   51    HB3  ARG   9           HB3      ARG   9  35.950  -7.608   4.478
   52    HG2  ARG   9           HG2      ARG   9  36.178  -8.063   7.138
   53    HG3  ARG   9           HG3      ARG   9  34.811  -9.101   6.732
   54    HD2  ARG   9           HD2      ARG   9  36.880  -9.338   4.749
   55    HD3  ARG   9           HD3      ARG   9  37.536  -9.637   6.358
   56   HH11  ARG   9          HH11      ARG   9  37.228 -10.577   7.936
   57   HH12  ARG   9          HH12      ARG   9  36.874 -12.128   8.621
   58   HH21  ARG   9          HH21      ARG   9  35.084 -13.270   5.845
   59   HH22  ARG   9          HH22      ARG   9  35.656 -13.659   7.433
   60    H    LEU  10           H        LEU  10  33.503  -5.862   3.861
   61    HA   LEU  10           HA       LEU  10  35.181  -3.888   2.508
   62    HG   LEU  10           HG       LEU  10  34.746  -7.062   1.361
   63    HB2  LEU  10           HB2      LEU  10  32.952  -5.635   1.474
   64    HB3  LEU  10           HB3      LEU  10  33.743  -4.396   0.519
   65   HD11  LEU  10          HD11      LEU  10  35.141  -7.341  -0.821
   66   HD12  LEU  10          HD12      LEU  10  35.807  -5.722  -1.013
   67   HD13  LEU  10          HD13      LEU  10  34.061  -5.964  -1.021
   68   HD21  LEU  10          HD21      LEU  10  37.098  -6.121   0.809
   69   HD22  LEU  10          HD22      LEU  10  36.449  -5.939   2.437
   70   HD23  LEU  10          HD23      LEU  10  36.408  -4.581   1.314
   71    H    ILE  11           H        ILE  11  32.480  -4.082   4.456
   72    HA   ILE  11           HA       ILE  11  31.065  -1.825   3.285
   73    HB   ILE  11           HB       ILE  11  29.965  -3.690   4.721
   74   HG12  ILE  11          HG12      ILE  11  29.473  -0.730   5.006
   75   HG13  ILE  11          HG13      ILE  11  28.654  -1.873   3.951
   76   HG21  ILE  11          HG21      ILE  11  29.962  -3.454   7.060
   77   HG22  ILE  11          HG22      ILE  11  30.710  -1.859   6.984
   78   HG23  ILE  11          HG23      ILE  11  31.657  -3.294   6.598
   79   HD11  ILE  11          HD11      ILE  11  27.081  -1.546   5.578
   80   HD12  ILE  11          HD12      ILE  11  28.282  -1.368   6.856
   81   HD13  ILE  11          HD13      ILE  11  27.917  -2.967   6.207
   82    H    GLU  12           H        GLU  12  33.333  -2.561   5.727
   83    HA   GLU  12           HA       GLU  12  33.436   0.134   6.810
   84    HB2  GLU  12           HB2      GLU  12  33.821  -1.868   8.252
   85    HB3  GLU  12           HB3      GLU  12  35.283  -2.205   7.336
   86    HG2  GLU  12           HG2      GLU  12  36.096  -1.117   9.195
   87    HG3  GLU  12           HG3      GLU  12  35.983   0.185   8.013
   88    H    SER  13           H        SER  13  35.820  -2.047   5.313
   89    HA   SER  13           HA       SER  13  37.588   0.083   4.652
   90    HG   SER  13           HG       SER  13  37.040  -3.386   3.365
   91    HB2  SER  13           HB2      SER  13  39.074  -1.554   4.033
   92    HB3  SER  13           HB3      SER  13  38.019  -2.481   5.102
   93    H    LEU  14           H        LEU  14  35.525  -2.051   2.601
   94    HA   LEU  14           HA       LEU  14  36.365  -0.752   0.220
   95    HG   LEU  14           HG       LEU  14  35.300  -1.566  -1.843
   96    HB2  LEU  14           HB2      LEU  14  34.976  -3.043   0.757
   97    HB3  LEU  14           HB3      LEU  14  33.716  -1.997   0.124
   98   HD11  LEU  14          HD11      LEU  14  36.565  -4.063  -0.727
   99   HD12  LEU  14          HD12      LEU  14  37.314  -2.471  -0.810
  100   HD13  LEU  14          HD13      LEU  14  36.916  -3.337  -2.294
  101   HD21  LEU  14          HD21      LEU  14  33.900  -4.160  -1.302
  102   HD22  LEU  14          HD22      LEU  14  34.659  -3.825  -2.856
  103   HD23  LEU  14          HD23      LEU  14  33.355  -2.792  -2.269
  104    H    SER  15           H        SER  15  33.127  -0.706   1.754
  105    HA   SER  15           HA       SER  15  31.939   1.281   0.372
  106    HG   SER  15           HG       SER  15  29.973   1.155   1.119
  107    HB2  SER  15           HB2      SER  15  31.379   0.033   2.731
  108    HB3  SER  15           HB3      SER  15  31.699   1.675   3.293
  109    H    GLN  16           H        GLN  16  33.701   2.018   3.382
  110    HA   GLN  16           HA       GLN  16  33.879   4.717   3.225
  111    HB2  GLN  16           HB2      GLN  16  34.855   3.798   5.128
  112    HB3  GLN  16           HB3      GLN  16  35.806   2.647   4.204
  113    HG2  GLN  16           HG2      GLN  16  37.001   4.596   5.362
  114    HG3  GLN  16           HG3      GLN  16  37.447   4.188   3.708
  115   HE21  GLN  16          HE21      GLN  16  37.984   6.006   2.753
  116   HE22  GLN  16          HE22      GLN  16  37.065   7.467   2.756
  117    H    MET  17           H        MET  17  35.710   2.373   1.347
  118    HA   MET  17           HA       MET  17  37.462   4.291   0.170
  119    HB2  MET  17           HB2      MET  17  37.639   1.659   0.376
  120    HB3  MET  17           HB3      MET  17  36.841   1.708  -1.189
  121    HG2  MET  17           HG2      MET  17  39.314   1.579  -1.303
  122    HG3  MET  17           HG3      MET  17  38.622   2.964  -2.142
  123    HE1  MET  17           HE1      MET  17  39.757   4.682  -2.347
  124    HE2  MET  17           HE2      MET  17  41.420   4.451  -1.807
  125    HE3  MET  17           HE3      MET  17  40.442   5.748  -1.119
  126    H    LEU  18           H        LEU  18  34.365   2.842  -0.743
  127    HA   LEU  18           HA       LEU  18  34.347   4.416  -3.214
  128    HG   LEU  18           HG       LEU  18  31.192   3.832  -3.348
  129    HB2  LEU  18           HB2      LEU  18  33.703   2.190  -3.628
  130    HB3  LEU  18           HB3      LEU  18  32.689   2.127  -2.199
  131   HD11  LEU  18          HD11      LEU  18  31.501   3.443  -5.960
  132   HD12  LEU  18          HD12      LEU  18  33.191   3.312  -5.472
  133   HD13  LEU  18          HD13      LEU  18  32.276   4.775  -5.105
  134   HD21  LEU  18          HD21      LEU  18  30.902   1.631  -5.148
  135   HD22  LEU  18          HD22      LEU  18  29.932   2.047  -3.736
  136   HD23  LEU  18          HD23      LEU  18  31.359   1.027  -3.555
  137    H    SER  19           H        SER  19  31.829   3.547  -0.860
  138    HA   SER  19           HA       SER  19  30.110   5.617  -1.260
  139    HG   SER  19           HG       SER  19  28.804   6.078   0.554
  140    HB2  SER  19           HB2      SER  19  29.690   3.594   0.119
  141    HB3  SER  19           HB3      SER  19  30.634   4.327   1.417
  142    H    MET  20           H        MET  20  33.204   6.171  -0.188
  143    HA   MET  20           HA       MET  20  32.436   8.484   1.433
  144    HB2  MET  20           HB2      MET  20  34.240   6.891   2.238
  145    HB3  MET  20           HB3      MET  20  35.239   7.481   0.915
  146    HG2  MET  20           HG2      MET  20  35.626   8.540   3.165
  147    HG3  MET  20           HG3      MET  20  35.343   9.643   1.820
  148    HE1  MET  20           HE1      MET  20  35.374  11.136   3.709
  149    HE2  MET  20           HE2      MET  20  34.458  10.880   5.195
  150    HE3  MET  20           HE3      MET  20  33.828  11.952   3.944
  151    H    GLY  21           H        GLY  21  33.742   7.478  -1.589
  152    HA2  GLY  21           HA2      GLY  21  33.383   8.995  -3.482
  153    HA3  GLY  21           HA3      GLY  21  33.929  10.300  -2.434
  154    H    PHE  22           H        PHE  22  35.494   7.140  -2.542
  155    HA   PHE  22           HA       PHE  22  37.677   8.285  -4.112
  156    HD1  PHE  22           HD1      PHE  22  36.632   9.404  -1.126
  157    HD2  PHE  22           HD2      PHE  22  40.696   8.826  -2.246
  158    HE1  PHE  22           HE1      PHE  22  37.159  11.688  -0.380
  159    HE2  PHE  22           HE2      PHE  22  41.225  11.106  -1.504
  160    HZ   PHE  22           HZ       PHE  22  39.463  12.543  -0.568
  161    HB2  PHE  22           HB2      PHE  22  37.846   7.050  -1.369
  162    HB3  PHE  22           HB3      PHE  22  39.235   7.083  -2.454
  163    H    SER  23           H        SER  23  39.377   6.327  -4.289
  164    HA   SER  23           HA       SER  23  38.081   3.768  -4.559
  165    HG   SER  23           HG       SER  23  37.014   5.868  -7.298
  166    HB2  SER  23           HB2      SER  23  38.975   5.143  -7.098
  167    HB3  SER  23           HB3      SER  23  38.178   3.577  -6.963
  168    H    ASP  24           H        ASP  24  39.917   3.043  -6.805
  169    HA   ASP  24           HA       ASP  24  42.408   2.798  -5.254
  170    HB2  ASP  24           HB2      ASP  24  42.331   0.848  -7.325
  171    HB3  ASP  24           HB3      ASP  24  42.281   0.587  -5.584
  172    H    GLU  25           H        GLU  25  44.166   3.738  -6.108
  173    HA   GLU  25           HA       GLU  25  44.251   5.458  -8.159
  174    HB2  GLU  25           HB2      GLU  25  46.192   4.921  -6.679
  175    HB3  GLU  25           HB3      GLU  25  46.510   3.518  -7.690
  176    HG2  GLU  25           HG2      GLU  25  46.852   4.986  -9.615
  177    HG3  GLU  25           HG3      GLU  25  46.546   6.389  -8.590
  178    H    GLY  26           H        GLY  26  44.683   2.004  -8.498
  179    HA2  GLY  26           HA2      GLY  26  43.806   2.202 -11.281
  180    HA3  GLY  26           HA3      GLY  26  45.380   1.476 -10.983
  181    H    GLY  27           H        GLY  27  45.004  -0.091  -8.817
  182    HA2  GLY  27           HA2      GLY  27  42.646  -1.605  -8.717
  183    HA3  GLY  27           HA3      GLY  27  43.724  -2.357  -9.886
  184    H    TRP  28           H        TRP  28  44.543  -0.659  -6.956
  185    HA   TRP  28           HA       TRP  28  45.940  -3.060  -6.012
  186    HD1  TRP  28           HD1      TRP  28  47.105   1.271  -6.762
  187    HE1  TRP  28           HE1      TRP  28  45.974   3.330  -5.729
  188    HE3  TRP  28           HE3      TRP  28  44.882  -0.922  -2.723
  189    HZ2  TRP  28           HZ2      TRP  28  44.359   3.953  -3.525
  190    HZ3  TRP  28           HZ3      TRP  28  43.556   0.480  -1.201
  191    HH2  TRP  28           HH2      TRP  28  43.301   2.874  -1.600
  192    HB2  TRP  28           HB2      TRP  28  47.073  -1.531  -4.385
  193    HB3  TRP  28           HB3      TRP  28  47.403  -1.168  -6.079
  194    H    LEU  29           H        LEU  29  43.437  -0.774  -5.089
  195    HA   LEU  29           HA       LEU  29  43.059  -1.270  -2.455
  196    HG   LEU  29           HG       LEU  29  40.187  -2.443  -2.696
  197    HB2  LEU  29           HB2      LEU  29  41.393   0.094  -3.052
  198    HB3  LEU  29           HB3      LEU  29  41.243  -0.600  -4.650
  199   HD11  LEU  29          HD11      LEU  29  38.601  -1.233  -1.563
  200   HD12  LEU  29          HD12      LEU  29  38.679   0.124  -2.687
  201   HD13  LEU  29          HD13      LEU  29  39.982  -0.138  -1.527
  202   HD21  LEU  29          HD21      LEU  29  38.910  -0.830  -4.896
  203   HD22  LEU  29          HD22      LEU  29  38.157  -2.180  -4.049
  204   HD23  LEU  29          HD23      LEU  29  39.586  -2.452  -5.045
  205    H    THR  30           H        THR  30  41.496  -3.313  -4.938
  206    HA   THR  30           HA       THR  30  40.626  -5.305  -3.235
  207    HB   THR  30           HB       THR  30  39.859  -5.451  -5.440
  208    HG1  THR  30           HG1      THR  30  41.857  -7.448  -5.195
  209   HG21  THR  30          HG21      THR  30  41.394  -4.220  -6.710
  210   HG22  THR  30          HG22      THR  30  41.443  -5.856  -7.368
  211   HG23  THR  30          HG23      THR  30  42.727  -5.299  -6.295
  212    H    ARG  31           H        ARG  31  43.856  -4.624  -4.362
  213    HA   ARG  31           HA       ARG  31  44.858  -7.167  -3.342
  214    HE   ARG  31           HE       ARG  31  44.927  -6.976  -8.249
  215    HB2  ARG  31           HB2      ARG  31  46.713  -5.121  -4.429
  216    HB3  ARG  31           HB3      ARG  31  46.714  -6.867  -4.637
  217    HG2  ARG  31           HG2      ARG  31  44.636  -6.515  -6.084
  218    HG3  ARG  31           HG3      ARG  31  45.093  -4.809  -6.093
  219    HD2  ARG  31           HD2      ARG  31  47.006  -5.189  -7.317
  220    HD3  ARG  31           HD3      ARG  31  47.145  -6.860  -6.777
  221   HH11  ARG  31          HH11      ARG  31  48.022  -5.510  -8.889
  222   HH12  ARG  31          HH12      ARG  31  47.911  -5.717 -10.605
  223   HH21  ARG  31          HH21      ARG  31  44.769  -7.251 -10.506
  224   HH22  ARG  31          HH22      ARG  31  46.058  -6.704 -11.526
  225    H    LEU  32           H        LEU  32  46.035  -3.772  -3.035
  226    HA   LEU  32           HA       LEU  32  47.609  -4.200  -0.811
  227    HG   LEU  32           HG       LEU  32  45.157  -1.195  -0.877
  228    HB2  LEU  32           HB2      LEU  32  48.060  -2.032  -1.022
  229    HB3  LEU  32           HB3      LEU  32  46.922  -2.023  -2.353
  230   HD11  LEU  32          HD11      LEU  32  45.270  -1.602   1.298
  231   HD12  LEU  32          HD12      LEU  32  46.493  -0.335   1.392
  232   HD13  LEU  32          HD13      LEU  32  46.980  -2.022   1.201
  233   HD21  LEU  32          HD21      LEU  32  47.584   0.482  -0.357
  234   HD22  LEU  32          HD22      LEU  32  45.931   0.996  -0.691
  235   HD23  LEU  32          HD23      LEU  32  46.917   0.304  -1.979
  236    H    LEU  33           H        LEU  33  44.275  -2.893  -0.726
  237    HA   LEU  33           HA       LEU  33  43.878  -2.839   1.991
  238    HG   LEU  33           HG       LEU  33  41.758  -2.315   2.641
  239    HB2  LEU  33           HB2      LEU  33  42.241  -2.718  -0.254
  240    HB3  LEU  33           HB3      LEU  33  41.620  -4.101   0.632
  241   HD11  LEU  33          HD11      LEU  33  41.719  -0.160   2.036
  242   HD12  LEU  33          HD12      LEU  33  40.660  -0.471   0.661
  243   HD13  LEU  33          HD13      LEU  33  42.398  -0.724   0.509
  244   HD21  LEU  33          HD21      LEU  33  39.670  -3.147   0.730
  245   HD22  LEU  33          HD22      LEU  33  39.306  -1.725   1.706
  246   HD23  LEU  33          HD23      LEU  33  39.708  -3.253   2.489
  247    H    GLN  34           H        GLN  34  42.974  -5.563  -0.074
  248    HA   GLN  34           HA       GLN  34  42.356  -7.552   1.579
  249    HB2  GLN  34           HB2      GLN  34  43.771  -7.393  -0.968
  250    HB3  GLN  34           HB3      GLN  34  44.098  -8.879  -0.084
  251    HG2  GLN  34           HG2      GLN  34  41.295  -7.934  -0.498
  252    HG3  GLN  34           HG3      GLN  34  42.145  -8.810  -1.767
  253   HE21  GLN  34          HE21      GLN  34  40.571  -9.002   1.278
  254   HE22  GLN  34          HE22      GLN  34  40.659 -10.717   1.464
  255    H    THR  35           H        THR  35  45.564  -6.214   1.241
  256    HA   THR  35           HA       THR  35  46.867  -8.279   2.775
  257    HB   THR  35           HB       THR  35  47.901  -5.491   2.226
  258    HG1  THR  35           HG1      THR  35  47.221  -7.175   0.412
  259   HG21  THR  35          HG21      THR  35  49.548  -6.296   3.522
  260   HG22  THR  35          HG22      THR  35  50.034  -7.094   2.026
  261   HG23  THR  35          HG23      THR  35  49.104  -7.978   3.236
  262    H    LYS  36           H        LYS  36  46.421  -4.837   3.373
  263    HA   LYS  36           HA       LYS  36  46.840  -5.017   6.170
  264    HB2  LYS  36           HB2      LYS  36  45.726  -2.858   4.402
  265    HB3  LYS  36           HB3      LYS  36  45.819  -2.666   6.148
  266    HG2  LYS  36           HG2      LYS  36  48.033  -2.344   6.126
  267    HG3  LYS  36           HG3      LYS  36  48.304  -3.571   4.889
  268    HD2  LYS  36           HD2      LYS  36  48.169  -2.081   3.194
  269    HD3  LYS  36           HD3      LYS  36  46.923  -1.122   3.995
  270    HE2  LYS  36           HE2      LYS  36  49.108   0.053   3.726
  271    HE3  LYS  36           HE3      LYS  36  48.541  -0.056   5.392
  272    HZ1  LYS  36           HZ1      LYS  36  50.024  -2.276   5.175
  273    HZ2  LYS  36           HZ2      LYS  36  50.604  -0.803   5.771
  274    HZ3  LYS  36           HZ3      LYS  36  50.878  -1.227   4.157
  275    H    ASN  37           H        ASN  37  44.812  -6.903   5.483
  276    HA   ASN  37           HA       ASN  37  42.737  -7.622   6.022
  277    HB2  ASN  37           HB2      ASN  37  41.971  -6.828   8.331
  278    HB3  ASN  37           HB3      ASN  37  43.526  -7.658   8.241
  279   HD21  ASN  37          HD21      ASN  37  41.890  -4.884   9.230
  280   HD22  ASN  37          HD22      ASN  37  43.261  -3.930   9.673
  281    H    TYR  38           H        TYR  38  42.636  -5.583   4.157
  282    HA   TYR  38           HA       TYR  38  41.139  -4.172   3.175
  283    HD1  TYR  38           HD2      TYR  38  40.537  -5.261   1.849
  284    HD2  TYR  38           HD1      TYR  38  37.709  -6.937   4.552
  285    HE1  TYR  38           HE2      TYR  38  39.931  -6.942   0.167
  286    HE2  TYR  38           HE1      TYR  38  37.096  -8.625   2.872
  287    HH   TYR  38           HH       TYR  38  38.734  -8.760  -0.278
  288    HB2  TYR  38           HB2      TYR  38  39.448  -5.408   5.334
  289    HB3  TYR  38           HB3      TYR  38  38.798  -4.144   4.306
  290    H    ASP  39           H        ASP  39  42.874  -2.690   4.326
  291    HA   ASP  39           HA       ASP  39  41.435  -0.886   6.166
  292    HB2  ASP  39           HB2      ASP  39  44.354  -1.555   5.904
  293    HB3  ASP  39           HB3      ASP  39  43.819  -0.085   6.720
  294    H    ILE  40           H        ILE  40  40.733   0.932   5.277
  295    HA   ILE  40           HA       ILE  40  41.715   1.853   2.768
  296    HB   ILE  40           HB       ILE  40  40.102   3.605   2.930
  297   HG12  ILE  40          HG12      ILE  40  40.707   3.979   5.455
  298   HG13  ILE  40          HG13      ILE  40  39.104   4.396   4.868
  299   HG21  ILE  40          HG21      ILE  40  38.693   1.978   2.376
  300   HG22  ILE  40          HG22      ILE  40  38.151   2.028   4.053
  301   HG23  ILE  40          HG23      ILE  40  39.380   0.864   3.558
  302   HD11  ILE  40          HD11      ILE  40  38.188   3.053   6.356
  303   HD12  ILE  40          HD12      ILE  40  39.794   2.687   6.988
  304   HD13  ILE  40          HD13      ILE  40  39.093   1.679   5.723
  305    H    GLY  41           H        GLY  41  42.457   2.275   6.053
  306    HA2  GLY  41           HA2      GLY  41  43.357   4.739   6.432
  307    HA3  GLY  41           HA3      GLY  41  44.272   3.346   6.969
  308    H    ALA  42           H        ALA  42  45.090   2.266   4.691
  309    HA   ALA  42           HA       ALA  42  47.066   4.164   3.749
  310    HB1  ALA  42           HB1      ALA  42  47.264   1.500   2.628
  311    HB2  ALA  42           HB2      ALA  42  47.187   1.477   4.390
  312    HB3  ALA  42           HB3      ALA  42  48.439   2.415   3.573
  313    H    ALA  43           H        ALA  43  44.315   2.374   2.633
  314    HA   ALA  43           HA       ALA  43  44.623   2.452  -0.100
  315    HB1  ALA  43           HB1      ALA  43  41.978   2.982   1.228
  316    HB2  ALA  43           HB2      ALA  43  42.746   1.395   1.267
  317    HB3  ALA  43           HB3      ALA  43  42.296   2.118  -0.275
  318    H    LEU  44           H        LEU  44  43.695   5.012   2.107
  319    HA   LEU  44           HA       LEU  44  43.079   6.852  -0.049
  320    HG   LEU  44           HG       LEU  44  40.909   7.479   0.892
  321    HB2  LEU  44           HB2      LEU  44  43.087   7.063   2.946
  322    HB3  LEU  44           HB3      LEU  44  42.933   8.495   1.939
  323   HD11  LEU  44          HD11      LEU  44  39.849   5.588   2.089
  324   HD12  LEU  44          HD12      LEU  44  41.336   5.387   3.017
  325   HD13  LEU  44          HD13      LEU  44  41.346   5.147   1.270
  326   HD21  LEU  44          HD21      LEU  44  41.120   8.880   3.191
  327   HD22  LEU  44          HD22      LEU  44  40.262   7.448   3.761
  328   HD23  LEU  44          HD23      LEU  44  39.586   8.419   2.453
  329    H    ASP  45           H        ASP  45  45.507   6.683   2.566
  330    HA   ASP  45           HA       ASP  45  47.042   8.865   2.045
  331    HB2  ASP  45           HB2      ASP  45  47.353   6.512   3.500
  332    HB3  ASP  45           HB3      ASP  45  48.726   6.510   2.398
  333    H    THR  46           H        THR  46  46.691   6.027   0.126
  334    HA   THR  46           HA       THR  46  48.904   6.704  -1.621
  335    HB   THR  46           HB       THR  46  48.329   4.602  -2.773
  336    HG1  THR  46           HG1      THR  46  46.356   3.951  -2.584
  337   HG21  THR  46          HG21      THR  46  48.313   3.152  -0.508
  338   HG22  THR  46          HG22      THR  46  48.902   4.697   0.104
  339   HG23  THR  46          HG23      THR  46  49.757   3.882  -1.206
  340    H    ILE  47           H        ILE  47  45.360   6.371  -1.858
  341    HA   ILE  47           HA       ILE  47  45.512   7.672  -4.486
  342    HB   ILE  47           HB       ILE  47  44.421   5.493  -4.447
  343   HG12  ILE  47          HG12      ILE  47  42.856   7.947  -5.144
  344   HG13  ILE  47          HG13      ILE  47  43.646   6.787  -6.210
  345   HG21  ILE  47          HG21      ILE  47  43.302   6.361  -2.062
  346   HG22  ILE  47          HG22      ILE  47  42.910   4.865  -2.921
  347   HG23  ILE  47          HG23      ILE  47  41.947   6.318  -3.185
  348   HD11  ILE  47          HD11      ILE  47  41.160   6.699  -6.229
  349   HD12  ILE  47          HD12      ILE  47  41.224   6.151  -4.553
  350   HD13  ILE  47          HD13      ILE  47  41.948   5.172  -5.831
  351    H    GLN  48           H        GLN  48  45.637   9.815  -3.838
  352    HA   GLN  48           HA       GLN  48  44.723  11.885  -3.552
  353    HB2  GLN  48           HB2      GLN  48  42.093  10.463  -3.129
  354    HB3  GLN  48           HB3      GLN  48  42.320  12.163  -3.513
  355    HG2  GLN  48           HG2      GLN  48  42.712  11.762  -5.706
  356    HG3  GLN  48           HG3      GLN  48  43.476  10.204  -5.399
  357   HE21  GLN  48          HE21      GLN  48  41.606   8.826  -4.056
  358   HE22  GLN  48          HE22      GLN  48  40.186   8.611  -5.028
  359    H    TYR  49           H        TYR  49  45.982  10.739  -1.457
  360    HA   TYR  49           HA       TYR  49  45.012  12.278   0.718
  361    HD1  TYR  49           HD2      TYR  49  44.148  12.339   3.012
  362    HD2  TYR  49           HD1      TYR  49  41.775   9.784   0.577
  363    HE1  TYR  49           HE2      TYR  49  42.110  13.428   3.862
  364    HE2  TYR  49           HE1      TYR  49  39.736  10.861   1.414
  365    HH   TYR  49           HH       TYR  49  39.633  12.767   4.120
  366    HB2  TYR  49           HB2      TYR  49  44.033   9.554   0.512
  367    HB3  TYR  49           HB3      TYR  49  44.854   9.845   2.043
  368    H    SER  50           H        SER  50  46.344  12.303   2.520
  369    HA   SER  50           HA       SER  50  48.683  10.600   2.623
  370    HG   SER  50           HG       SER  50  49.297  14.185   0.966
  371    HB2  SER  50           HB2      SER  50  49.927  13.064   2.815
  372    HB3  SER  50           HB3      SER  50  49.982  11.991   1.416
  373    H    LYS  51           H        LYS  51  46.319  11.463   4.240
  374    HA   LYS  51           HA       LYS  51  47.767  12.350   6.650
  375    HB2  LYS  51           HB2      LYS  51  45.037  13.017   5.621
  376    HB3  LYS  51           HB3      LYS  51  45.310  12.989   7.356
  377    HG2  LYS  51           HG2      LYS  51  45.801  15.156   7.016
  378    HG3  LYS  51           HG3      LYS  51  47.390  14.505   6.606
  379    HD2  LYS  51           HD2      LYS  51  46.542  14.373   4.210
  380    HD3  LYS  51           HD3      LYS  51  45.191  15.374   4.748
  381    HE2  LYS  51           HE2      LYS  51  46.584  17.039   4.096
  382    HE3  LYS  51           HE3      LYS  51  47.197  16.825   5.735
  383    HZ1  LYS  51           HZ1      LYS  51  49.147  16.121   4.969
  384    HZ2  LYS  51           HZ2      LYS  51  48.667  16.684   3.448
  385    HZ3  LYS  51           HZ3      LYS  51  48.441  15.058   3.858
  386    H    HIS  52           H        HIS  52  48.088   9.835   6.403
  387    HA   HIS  52           HA       HIS  52  46.116   7.989   6.919
  388    HD1  HIS  52           HD1      HIS  52  49.378  10.002   7.992
  389    HD2  HIS  52           HD2      HIS  52  49.833   6.132   9.434
  390    HE1  HIS  52           HE1      HIS  52  51.219  10.101   9.724
  391    HB2  HIS  52           HB2      HIS  52  47.837   6.520   7.683
  392    HB3  HIS  52           HB3      HIS  52  48.546   7.537   6.432
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1  24.010 -16.259   1.904
    2    H2   GLY   1           2H       GLY   1  24.356 -15.132   3.116
    3    H3   GLY   1           3H       GLY   1  24.482 -16.789   3.440
    4    HA2  GLY   1           HA2      GLY   1  26.673 -16.304   3.127
    5    HA3  GLY   1           HA3      GLY   1  26.189 -16.757   1.499
    6    H    SER   2           H        SER   2  28.055 -14.671   3.017
    7    HA   SER   2           HA       SER   2  27.293 -12.145   1.996
    8    HG   SER   2           HG       SER   2  27.941 -11.074   3.461
    9    HB2  SER   2           HB2      SER   2  29.563 -13.271   3.441
   10    HB3  SER   2           HB3      SER   2  30.053 -12.041   2.277
   11    HA   PRO   3           HA       PRO   3  28.632 -12.963  -2.191
   12    HB2  PRO   3           HB2      PRO   3  27.408 -10.876  -3.331
   13    HB3  PRO   3           HB3      PRO   3  26.490 -12.256  -2.716
   14    HG2  PRO   3           HG2      PRO   3  26.857  -9.545  -1.539
   15    HG3  PRO   3           HG3      PRO   3  25.443 -10.611  -1.492
   16    HD2  PRO   3           HD2      PRO   3  27.341 -10.284   0.548
   17    HD3  PRO   3           HD3      PRO   3  26.137 -11.579   0.437
   18    HA   PRO   4           HA       PRO   4  32.186 -10.414  -2.771
   19    HB2  PRO   4           HB2      PRO   4  32.251 -10.196  -5.499
   20    HB3  PRO   4           HB3      PRO   4  32.754 -11.642  -4.617
   21    HG2  PRO   4           HG2      PRO   4  30.167 -11.071  -6.002
   22    HG3  PRO   4           HG3      PRO   4  31.114 -12.570  -5.970
   23    HD2  PRO   4           HD2      PRO   4  28.915 -12.217  -4.442
   24    HD3  PRO   4           HD3      PRO   4  30.300 -13.188  -3.900
   25    H    GLU   5           H        GLU   5  30.725  -8.688  -1.777
   26    HA   GLU   5           HA       GLU   5  31.175  -6.227  -2.659
   27    HB2  GLU   5           HB2      GLU   5  29.145  -7.456  -4.398
   28    HB3  GLU   5           HB3      GLU   5  28.712  -5.866  -3.784
   29    HG2  GLU   5           HG2      GLU   5  30.440  -4.819  -4.881
   30    HG3  GLU   5           HG3      GLU   5  31.405  -6.290  -4.986
   31    H    ALA   6           H        ALA   6  31.007  -5.902  -0.474
   32    HA   ALA   6           HA       ALA   6  29.698  -4.600   1.056
   33    HB1  ALA   6           HB1      ALA   6  27.384  -5.109   1.507
   34    HB2  ALA   6           HB2      ALA   6  27.442  -6.496   0.420
   35    HB3  ALA   6           HB3      ALA   6  27.605  -4.863  -0.225
   36    H    ASP   7           H        ASP   7  31.557  -6.693   1.248
   37    HA   ASP   7           HA       ASP   7  30.568  -8.468   3.333
   38    HB2  ASP   7           HB2      ASP   7  33.380  -8.273   2.238
   39    HB3  ASP   7           HB3      ASP   7  32.675  -9.609   3.145
   40    HA   PRO   8           HA       PRO   8  31.686  -6.409   7.050
   41    HB2  PRO   8           HB2      PRO   8  33.955  -8.376   7.088
   42    HB3  PRO   8           HB3      PRO   8  32.924  -7.836   8.419
   43    HG2  PRO   8           HG2      PRO   8  32.493 -10.165   7.103
   44    HG3  PRO   8           HG3      PRO   8  31.183  -9.205   7.806
   45    HD2  PRO   8           HD2      PRO   8  31.790  -9.702   4.997
   46    HD3  PRO   8           HD3      PRO   8  30.346  -8.956   5.711
   47    H    ARG   9           H        ARG   9  34.648  -7.478   5.361
   48    HA   ARG   9           HA       ARG   9  36.185  -5.237   6.078
   49    HE   ARG   9           HE       ARG   9  40.267  -7.567   4.845
   50    HB2  ARG   9           HB2      ARG   9  36.540  -7.092   3.721
   51    HB3  ARG   9           HB3      ARG   9  37.774  -6.028   4.393
   52    HG2  ARG   9           HG2      ARG   9  36.591  -7.821   6.367
   53    HG3  ARG   9           HG3      ARG   9  37.399  -8.660   5.040
   54    HD2  ARG   9           HD2      ARG   9  38.844  -6.358   6.189
   55    HD3  ARG   9           HD3      ARG   9  38.668  -7.761   7.242
   56   HH11  ARG   9          HH11      ARG   9  38.735  -9.682   7.149
   57   HH12  ARG   9          HH12      ARG   9  39.757 -11.032   6.783
   58   HH21  ARG   9          HH21      ARG   9  41.614  -9.341   4.354
   59   HH22  ARG   9          HH22      ARG   9  41.390 -10.839   5.193
   60    H    LEU  10           H        LEU  10  34.223  -5.878   3.198
   61    HA   LEU  10           HA       LEU  10  35.098  -3.442   1.936
   62    HG   LEU  10           HG       LEU  10  34.534  -6.876   0.880
   63    HB2  LEU  10           HB2      LEU  10  32.910  -5.289   1.019
   64    HB3  LEU  10           HB3      LEU  10  33.811  -4.134   0.055
   65   HD11  LEU  10          HD11      LEU  10  35.065  -5.070  -1.458
   66   HD12  LEU  10          HD12      LEU  10  34.114  -6.555  -1.405
   67   HD13  LEU  10          HD13      LEU  10  35.871  -6.627  -1.270
   68   HD21  LEU  10          HD21      LEU  10  37.015  -6.123   0.496
   69   HD22  LEU  10          HD22      LEU  10  36.290  -6.033   2.101
   70   HD23  LEU  10          HD23      LEU  10  36.426  -4.580   1.113
   71    H    ILE  11           H        ILE  11  32.380  -4.555   3.782
   72    HA   ILE  11           HA       ILE  11  30.797  -2.210   3.154
   73    HB   ILE  11           HB       ILE  11  29.735  -4.433   3.670
   74   HG12  ILE  11          HG12      ILE  11  29.025  -2.014   5.332
   75   HG13  ILE  11          HG13      ILE  11  28.338  -2.501   3.785
   76   HG21  ILE  11          HG21      ILE  11  29.489  -4.823   6.213
   77   HG22  ILE  11          HG22      ILE  11  30.960  -3.857   6.337
   78   HG23  ILE  11          HG23      ILE  11  30.964  -5.354   5.404
   79   HD11  ILE  11          HD11      ILE  11  27.650  -4.640   5.154
   80   HD12  ILE  11          HD12      ILE  11  26.682  -3.167   5.193
   81   HD13  ILE  11          HD13      ILE  11  27.795  -3.526   6.513
   82    H    GLU  12           H        GLU  12  33.158  -3.257   5.329
   83    HA   GLU  12           HA       GLU  12  32.681  -1.050   7.200
   84    HB2  GLU  12           HB2      GLU  12  33.159  -3.403   8.032
   85    HB3  GLU  12           HB3      GLU  12  34.798  -3.188   7.431
   86    HG2  GLU  12           HG2      GLU  12  35.310  -2.325   9.401
   87    HG3  GLU  12           HG3      GLU  12  34.321  -0.929   8.971
   88    H    SER  13           H        SER  13  35.376  -2.485   5.363
   89    HA   SER  13           HA       SER  13  36.861   0.000   5.589
   90    HG   SER  13           HG       SER  13  37.794  -3.727   5.373
   91    HB2  SER  13           HB2      SER  13  38.126  -2.135   4.057
   92    HB3  SER  13           HB3      SER  13  38.699  -1.270   5.483
   93    H    LEU  14           H        LEU  14  35.421  -1.952   2.935
   94    HA   LEU  14           HA       LEU  14  36.684  -0.355   0.935
   95    HG   LEU  14           HG       LEU  14  35.333  -0.347  -1.268
   96    HB2  LEU  14           HB2      LEU  14  35.983  -2.526   0.265
   97    HB3  LEU  14           HB3      LEU  14  34.333  -2.217   0.746
   98   HD11  LEU  14          HD11      LEU  14  34.787  -2.303  -2.984
   99   HD12  LEU  14          HD12      LEU  14  35.486  -3.270  -1.686
  100   HD13  LEU  14          HD13      LEU  14  36.422  -1.966  -2.416
  101   HD21  LEU  14          HD21      LEU  14  33.133  -1.081  -2.313
  102   HD22  LEU  14          HD22      LEU  14  33.042  -0.262  -0.754
  103   HD23  LEU  14          HD23      LEU  14  32.871  -2.015  -0.841
  104    H    SER  15           H        SER  15  33.253  -0.449   1.997
  105    HA   SER  15           HA       SER  15  32.203   1.578   0.569
  106    HG   SER  15           HG       SER  15  30.363   2.326   3.807
  107    HB2  SER  15           HB2      SER  15  30.608   0.877   2.031
  108    HB3  SER  15           HB3      SER  15  31.776   0.596   3.322
  109    H    GLN  16           H        GLN  16  33.760   2.152   3.726
  110    HA   GLN  16           HA       GLN  16  33.858   4.854   3.781
  111    HB2  GLN  16           HB2      GLN  16  35.187   4.532   5.559
  112    HB3  GLN  16           HB3      GLN  16  35.089   2.817   5.196
  113    HG2  GLN  16           HG2      GLN  16  37.374   3.349   5.505
  114    HG3  GLN  16           HG3      GLN  16  37.133   3.083   3.781
  115   HE21  GLN  16          HE21      GLN  16  38.241   4.445   2.594
  116   HE22  GLN  16          HE22      GLN  16  38.556   6.105   2.956
  117    H    MET  17           H        MET  17  35.573   2.815   1.572
  118    HA   MET  17           HA       MET  17  37.337   4.968   0.740
  119    HB2  MET  17           HB2      MET  17  37.564   2.189   0.782
  120    HB3  MET  17           HB3      MET  17  37.413   2.596  -0.922
  121    HG2  MET  17           HG2      MET  17  39.223   4.399  -0.321
  122    HG3  MET  17           HG3      MET  17  39.553   3.299   1.016
  123    HE1  MET  17           HE1      MET  17  38.744   2.880  -2.940
  124    HE2  MET  17           HE2      MET  17  40.427   2.660  -3.422
  125    HE3  MET  17           HE3      MET  17  39.929   4.146  -2.614
  126    H    LEU  18           H        LEU  18  34.443   3.290  -0.374
  127    HA   LEU  18           HA       LEU  18  34.615   4.614  -2.969
  128    HG   LEU  18           HG       LEU  18  34.748   2.005  -3.628
  129    HB2  LEU  18           HB2      LEU  18  33.115   2.369  -1.846
  130    HB3  LEU  18           HB3      LEU  18  32.162   3.389  -2.908
  131   HD11  LEU  18          HD11      LEU  18  32.197   0.963  -3.500
  132   HD12  LEU  18          HD12      LEU  18  33.544   0.319  -4.438
  133   HD13  LEU  18          HD13      LEU  18  32.382   1.407  -5.197
  134   HD21  LEU  18          HD21      LEU  18  33.482   2.906  -5.932
  135   HD22  LEU  18          HD22      LEU  18  34.952   3.556  -5.206
  136   HD23  LEU  18          HD23      LEU  18  33.385   4.262  -4.807
  137    H    SER  19           H        SER  19  31.790   4.281  -0.772
  138    HA   SER  19           HA       SER  19  30.614   6.656  -1.701
  139    HG   SER  19           HG       SER  19  28.522   5.938   1.353
  140    HB2  SER  19           HB2      SER  19  28.829   5.715  -0.758
  141    HB3  SER  19           HB3      SER  19  29.867   4.444  -0.114
  142    H    MET  20           H        MET  20  33.326   6.717  -0.093
  143    HA   MET  20           HA       MET  20  32.578   8.686   1.932
  144    HB2  MET  20           HB2      MET  20  34.245   7.151   2.691
  145    HB3  MET  20           HB3      MET  20  35.202   7.374   1.234
  146    HG2  MET  20           HG2      MET  20  35.759   9.621   1.881
  147    HG3  MET  20           HG3      MET  20  34.689   9.518   3.279
  148    HE1  MET  20           HE1      MET  20  36.365   8.349   5.979
  149    HE2  MET  20           HE2      MET  20  35.422   9.594   5.160
  150    HE3  MET  20           HE3      MET  20  37.154   9.821   5.411
  151    H    GLY  21           H        GLY  21  33.584   8.436  -1.299
  152    HA2  GLY  21           HA2      GLY  21  33.353  10.444  -2.646
  153    HA3  GLY  21           HA3      GLY  21  34.139  11.330  -1.344
  154    H    PHE  22           H        PHE  22  35.502   8.215  -2.017
  155    HA   PHE  22           HA       PHE  22  37.553   9.461  -3.700
  156    HD1  PHE  22           HD1      PHE  22  37.275  10.329  -0.408
  157    HD2  PHE  22           HD2      PHE  22  40.807   9.276  -2.532
  158    HE1  PHE  22           HE1      PHE  22  38.353  12.402   0.365
  159    HE2  PHE  22           HE2      PHE  22  41.890  11.344  -1.762
  160    HZ   PHE  22           HZ       PHE  22  40.667  12.911  -0.313
  161    HB2  PHE  22           HB2      PHE  22  37.840   7.934  -1.141
  162    HB3  PHE  22           HB3      PHE  22  39.079   7.747  -2.382
  163    H    SER  23           H        SER  23  39.059   7.437  -4.421
  164    HA   SER  23           HA       SER  23  37.378   5.141  -5.018
  165    HG   SER  23           HG       SER  23  36.338   5.843  -8.023
  166    HB2  SER  23           HB2      SER  23  38.140   7.216  -6.973
  167    HB3  SER  23           HB3      SER  23  38.398   5.563  -7.516
  168    H    ASP  24           H        ASP  24  38.985   3.962  -6.962
  169    HA   ASP  24           HA       ASP  24  41.290   3.185  -5.360
  170    HB2  ASP  24           HB2      ASP  24  41.569   1.393  -7.059
  171    HB3  ASP  24           HB3      ASP  24  39.960   1.393  -6.335
  172    H    GLU  25           H        GLU  25  43.181   4.208  -5.611
  173    HA   GLU  25           HA       GLU  25  43.763   6.165  -7.403
  174    HB2  GLU  25           HB2      GLU  25  45.186   5.676  -5.481
  175    HB3  GLU  25           HB3      GLU  25  45.741   4.207  -6.263
  176    HG2  GLU  25           HG2      GLU  25  46.385   5.955  -8.169
  177    HG3  GLU  25           HG3      GLU  25  46.489   7.015  -6.762
  178    H    GLY  26           H        GLY  26  45.125   2.937  -7.760
  179    HA2  GLY  26           HA2      GLY  26  44.735   3.182 -10.666
  180    HA3  GLY  26           HA3      GLY  26  46.325   2.791 -10.026
  181    H    GLY  27           H        GLY  27  43.169   1.593  -8.927
  182    HA2  GLY  27           HA2      GLY  27  42.238  -0.521  -9.098
  183    HA3  GLY  27           HA3      GLY  27  43.526  -0.960 -10.211
  184    H    TRP  28           H        TRP  28  44.045   0.354  -7.025
  185    HA   TRP  28           HA       TRP  28  45.420  -2.118  -6.297
  186    HD1  TRP  28           HD1      TRP  28  46.235   2.452  -6.018
  187    HE1  TRP  28           HE1      TRP  28  45.042   4.069  -4.413
  188    HE3  TRP  28           HE3      TRP  28  44.320  -0.946  -2.715
  189    HZ2  TRP  28           HZ2      TRP  28  43.488   3.917  -2.054
  190    HZ3  TRP  28           HZ3      TRP  28  42.988  -0.123  -0.824
  191    HH2  TRP  28           HH2      TRP  28  42.585   2.255  -0.501
  192    HB2  TRP  28           HB2      TRP  28  46.552  -0.864  -4.569
  193    HB3  TRP  28           HB3      TRP  28  46.696  -0.020  -6.107
  194    H    LEU  29           H        LEU  29  42.709  -0.093  -5.318
  195    HA   LEU  29           HA       LEU  29  42.097  -0.800  -2.816
  196    HG   LEU  29           HG       LEU  29  39.445  -2.142  -3.168
  197    HB2  LEU  29           HB2      LEU  29  40.514   0.499  -3.907
  198    HB3  LEU  29           HB3      LEU  29  40.371  -0.624  -5.248
  199   HD11  LEU  29          HD11      LEU  29  37.937  -0.792  -1.856
  200   HD12  LEU  29          HD12      LEU  29  38.472   0.668  -2.688
  201   HD13  LEU  29          HD13      LEU  29  39.589  -0.211  -1.644
  202   HD21  LEU  29          HD21      LEU  29  38.479  -1.740  -5.448
  203   HD22  LEU  29          HD22      LEU  29  37.732  -0.281  -4.797
  204   HD23  LEU  29          HD23      LEU  29  37.298  -1.861  -4.144
  205    H    THR  30           H        THR  30  40.883  -2.817  -5.464
  206    HA   THR  30           HA       THR  30  40.176  -4.985  -3.907
  207    HB   THR  30           HB       THR  30  39.878  -6.172  -5.882
  208    HG1  THR  30           HG1      THR  30  41.800  -6.367  -6.810
  209   HG21  THR  30          HG21      THR  30  38.769  -4.790  -7.295
  210   HG22  THR  30          HG22      THR  30  40.032  -3.559  -7.268
  211   HG23  THR  30          HG23      THR  30  38.924  -3.717  -5.904
  212    H    ARG  31           H        ARG  31  43.389  -4.088  -5.067
  213    HA   ARG  31           HA       ARG  31  44.456  -6.681  -4.280
  214    HE   ARG  31           HE       ARG  31  47.529  -5.856  -7.869
  215    HB2  ARG  31           HB2      ARG  31  46.263  -4.540  -5.223
  216    HB3  ARG  31           HB3      ARG  31  46.209  -6.239  -5.657
  217    HG2  ARG  31           HG2      ARG  31  43.863  -5.145  -6.705
  218    HG3  ARG  31           HG3      ARG  31  45.130  -3.964  -7.039
  219    HD2  ARG  31           HD2      ARG  31  45.441  -6.896  -7.628
  220    HD3  ARG  31           HD3      ARG  31  44.754  -5.763  -8.789
  221   HH11  ARG  31          HH11      ARG  31  45.098  -4.362  -9.886
  222   HH12  ARG  31          HH12      ARG  31  46.254  -3.571 -10.900
  223   HH21  ARG  31          HH21      ARG  31  49.044  -4.807  -9.203
  224   HH22  ARG  31          HH22      ARG  31  48.489  -3.819 -10.514
  225    H    LEU  32           H        LEU  32  45.606  -3.344  -3.786
  226    HA   LEU  32           HA       LEU  32  47.357  -3.800  -1.742
  227    HG   LEU  32           HG       LEU  32  45.090  -0.966  -0.760
  228    HB2  LEU  32           HB2      LEU  32  47.656  -1.654  -2.203
  229    HB3  LEU  32           HB3      LEU  32  46.064  -1.531  -2.924
  230   HD11  LEU  32          HD11      LEU  32  46.148  -1.877   0.993
  231   HD12  LEU  32          HD12      LEU  32  47.075  -0.376   0.955
  232   HD13  LEU  32          HD13      LEU  32  47.723  -1.834   0.202
  233   HD21  LEU  32          HD21      LEU  32  46.654   0.653  -2.292
  234   HD22  LEU  32          HD22      LEU  32  47.389   0.850  -0.701
  235   HD23  LEU  32          HD23      LEU  32  45.675   1.196  -0.929
  236    H    LEU  33           H        LEU  33  43.938  -2.854  -1.290
  237    HA   LEU  33           HA       LEU  33  43.952  -2.931   1.501
  238    HG   LEU  33           HG       LEU  33  41.286  -2.000   2.161
  239    HB2  LEU  33           HB2      LEU  33  41.984  -2.774  -0.617
  240    HB3  LEU  33           HB3      LEU  33  41.400  -3.761   0.713
  241   HD11  LEU  33          HD11      LEU  33  43.631  -0.973   0.659
  242   HD12  LEU  33          HD12      LEU  33  43.403  -1.202   2.389
  243   HD13  LEU  33          HD13      LEU  33  42.645   0.168   1.575
  244   HD21  LEU  33          HD21      LEU  33  40.241  -1.533  -0.340
  245   HD22  LEU  33          HD22      LEU  33  41.114  -0.043   0.017
  246   HD23  LEU  33          HD23      LEU  33  39.870  -0.623   1.125
  247    H    GLN  34           H        GLN  34  42.774  -5.415  -0.720
  248    HA   GLN  34           HA       GLN  34  42.044  -7.416   0.922
  249    HB2  GLN  34           HB2      GLN  34  42.251  -7.216  -1.663
  250    HB3  GLN  34           HB3      GLN  34  43.742  -8.116  -1.427
  251    HG2  GLN  34           HG2      GLN  34  42.512  -9.956  -1.525
  252    HG3  GLN  34           HG3      GLN  34  41.891  -9.519   0.066
  253   HE21  GLN  34          HE21      GLN  34  40.045  -7.886  -0.037
  254   HE22  GLN  34          HE22      GLN  34  38.826  -8.197  -1.221
  255    H    THR  35           H        THR  35  45.307  -6.319   0.601
  256    HA   THR  35           HA       THR  35  46.421  -8.788   1.684
  257    HB   THR  35           HB       THR  35  48.580  -7.528   1.671
  258    HG1  THR  35           HG1      THR  35  47.027  -5.469   0.495
  259   HG21  THR  35          HG21      THR  35  48.322  -8.692  -0.308
  260   HG22  THR  35          HG22      THR  35  48.583  -7.036  -0.853
  261   HG23  THR  35          HG23      THR  35  46.953  -7.707  -0.826
  262    H    LYS  36           H        LYS  36  46.730  -5.420   2.705
  263    HA   LYS  36           HA       LYS  36  47.199  -6.091   5.430
  264    HB2  LYS  36           HB2      LYS  36  46.567  -3.447   4.121
  265    HB3  LYS  36           HB3      LYS  36  47.057  -3.630   5.799
  266    HG2  LYS  36           HG2      LYS  36  49.198  -3.681   5.234
  267    HG3  LYS  36           HG3      LYS  36  48.914  -4.973   4.065
  268    HD2  LYS  36           HD2      LYS  36  49.232  -3.532   2.405
  269    HD3  LYS  36           HD3      LYS  36  47.862  -2.577   2.975
  270    HE2  LYS  36           HE2      LYS  36  50.777  -2.219   3.488
  271    HE3  LYS  36           HE3      LYS  36  49.560  -1.024   3.038
  272    HZ1  LYS  36           HZ1      LYS  36  49.803  -0.503   5.214
  273    HZ2  LYS  36           HZ2      LYS  36  50.257  -2.066   5.674
  274    HZ3  LYS  36           HZ3      LYS  36  48.628  -1.706   5.396
  275    H    ASN  37           H        ASN  37  44.727  -7.261   4.685
  276    HA   ASN  37           HA       ASN  37  42.549  -7.464   5.317
  277    HB2  ASN  37           HB2      ASN  37  43.634  -7.585   7.532
  278    HB3  ASN  37           HB3      ASN  37  43.514  -5.830   7.679
  279   HD21  ASN  37          HD21      ASN  37  41.717  -4.980   8.495
  280   HD22  ASN  37          HD22      ASN  37  40.272  -5.856   8.852
  281    H    TYR  38           H        TYR  38  42.804  -5.616   3.441
  282    HA   TYR  38           HA       TYR  38  41.941  -3.729   2.515
  283    HD1  TYR  38           HD1      TYR  38  40.090  -6.054   1.610
  284    HD2  TYR  38           HD2      TYR  38  38.766  -2.065   2.269
  285    HE1  TYR  38           HE1      TYR  38  39.151  -5.997  -0.662
  286    HE2  TYR  38           HE2      TYR  38  37.821  -1.998   0.000
  287    HH   TYR  38           HH       TYR  38  38.179  -4.742  -2.223
  288    HB2  TYR  38           HB2      TYR  38  39.857  -5.069   3.920
  289    HB3  TYR  38           HB3      TYR  38  39.601  -3.333   4.077
  290    H    ASP  39           H        ASP  39  43.863  -2.845   3.826
  291    HA   ASP  39           HA       ASP  39  43.293  -1.266   6.119
  292    HB2  ASP  39           HB2      ASP  39  45.583  -0.392   5.815
  293    HB3  ASP  39           HB3      ASP  39  45.515  -2.155   5.756
  294    H    ILE  40           H        ILE  40  42.318   0.594   6.216
  295    HA   ILE  40           HA       ILE  40  42.011   2.247   3.843
  296    HB   ILE  40           HB       ILE  40  41.000   2.956   6.586
  297   HG12  ILE  40          HG12      ILE  40  40.346   0.617   6.000
  298   HG13  ILE  40          HG13      ILE  40  38.979   1.716   6.178
  299   HG21  ILE  40          HG21      ILE  40  39.552   3.482   4.041
  300   HG22  ILE  40          HG22      ILE  40  40.980   4.447   4.414
  301   HG23  ILE  40          HG23      ILE  40  39.610   4.433   5.524
  302   HD11  ILE  40          HD11      ILE  40  40.209   0.915   3.552
  303   HD12  ILE  40          HD12      ILE  40  38.757   1.887   3.788
  304   HD13  ILE  40          HD13      ILE  40  38.767   0.188   4.257
  305    H    GLY  41           H        GLY  41  43.284   2.328   7.108
  306    HA2  GLY  41           HA2      GLY  41  44.281   4.799   7.344
  307    HA3  GLY  41           HA3      GLY  41  45.167   3.397   7.903
  308    H    ALA  42           H        ALA  42  45.389   2.319   5.232
  309    HA   ALA  42           HA       ALA  42  47.604   3.994   4.290
  310    HB1  ALA  42           HB1      ALA  42  47.576   1.329   4.820
  311    HB2  ALA  42           HB2      ALA  42  48.715   2.116   3.728
  312    HB3  ALA  42           HB3      ALA  42  47.269   1.340   3.083
  313    H    ALA  43           H        ALA  43  44.564   2.656   3.427
  314    HA   ALA  43           HA       ALA  43  44.488   2.789   0.689
  315    HB1  ALA  43           HB1      ALA  43  42.338   3.611   2.634
  316    HB2  ALA  43           HB2      ALA  43  42.594   2.003   1.954
  317    HB3  ALA  43           HB3      ALA  43  42.076   3.331   0.914
  318    H    LEU  44           H        LEU  44  43.902   5.444   2.957
  319    HA   LEU  44           HA       LEU  44  43.422   7.461   1.057
  320    HG   LEU  44           HG       LEU  44  41.957   8.644   2.450
  321    HB2  LEU  44           HB2      LEU  44  44.276   7.405   3.919
  322    HB3  LEU  44           HB3      LEU  44  44.423   8.916   3.038
  323   HD11  LEU  44          HD11      LEU  44  40.710   7.280   4.172
  324   HD12  LEU  44          HD12      LEU  44  42.251   6.508   4.542
  325   HD13  LEU  44          HD13      LEU  44  41.561   6.370   2.924
  326   HD21  LEU  44          HD21      LEU  44  41.283   9.778   4.386
  327   HD22  LEU  44          HD22      LEU  44  43.000  10.148   4.231
  328   HD23  LEU  44          HD23      LEU  44  42.460   8.938   5.396
  329    H    ASP  45           H        ASP  45  46.394   6.774   2.882
  330    HA   ASP  45           HA       ASP  45  48.161   8.506   1.865
  331    HB2  ASP  45           HB2      ASP  45  48.471   6.315   3.332
  332    HB3  ASP  45           HB3      ASP  45  49.044   5.657   1.803
  333    H    THR  46           H        THR  46  47.039   5.588   0.201
  334    HA   THR  46           HA       THR  46  48.609   6.145  -2.140
  335    HB   THR  46           HB       THR  46  47.627   4.111  -3.043
  336    HG1  THR  46           HG1      THR  46  45.542   4.232  -2.300
  337   HG21  THR  46          HG21      THR  46  49.395   3.474  -1.722
  338   HG22  THR  46          HG22      THR  46  48.065   2.555  -1.020
  339   HG23  THR  46          HG23      THR  46  48.625   4.031  -0.237
  340    H    ILE  47           H        ILE  47  45.096   6.294  -1.388
  341    HA   ILE  47           HA       ILE  47  44.548   7.117  -4.107
  342    HB   ILE  47           HB       ILE  47  42.181   7.487  -3.137
  343   HG12  ILE  47          HG12      ILE  47  42.698   5.457  -1.111
  344   HG13  ILE  47          HG13      ILE  47  43.501   6.983  -0.749
  345   HG21  ILE  47          HG21      ILE  47  42.374   5.723  -4.587
  346   HG22  ILE  47          HG22      ILE  47  41.923   4.884  -3.104
  347   HG23  ILE  47          HG23      ILE  47  43.608   4.920  -3.621
  348   HD11  ILE  47          HD11      ILE  47  40.874   7.594  -1.569
  349   HD12  ILE  47          HD12      ILE  47  41.593   7.769   0.031
  350   HD13  ILE  47          HD13      ILE  47  40.774   6.270  -0.409
  351    H    GLN  48           H        GLN  48  46.147   8.954  -3.587
  352    HA   GLN  48           HA       GLN  48  46.228  11.249  -3.885
  353    HB2  GLN  48           HB2      GLN  48  43.578  11.504  -2.482
  354    HB3  GLN  48           HB3      GLN  48  44.362  12.670  -3.535
  355    HG2  GLN  48           HG2      GLN  48  43.598  11.693  -5.415
  356    HG3  GLN  48           HG3      GLN  48  43.720  10.064  -4.755
  357   HE21  GLN  48          HE21      GLN  48  41.781   9.180  -4.921
  358   HE22  GLN  48          HE22      GLN  48  40.288   9.906  -4.412
  359    H    TYR  49           H        TYR  49  44.381  10.694  -0.888
  360    HA   TYR  49           HA       TYR  49  45.628  12.469   0.748
  361    HD1  TYR  49           HD2      TYR  49  44.586  13.231   2.698
  362    HD2  TYR  49           HD1      TYR  49  42.126  10.067   1.274
  363    HE1  TYR  49           HE2      TYR  49  42.584  14.557   3.228
  364    HE2  TYR  49           HE1      TYR  49  40.118  11.381   1.802
  365    HH   TYR  49           HH       TYR  49  39.321  13.271   2.634
  366    HB2  TYR  49           HB2      TYR  49  44.399   9.786   1.235
  367    HB3  TYR  49           HB3      TYR  49  45.264  10.570   2.556
  368    H    SER  50           H        SER  50  47.511  12.615   1.830
  369    HA   SER  50           HA       SER  50  49.421  10.388   1.590
  370    HG   SER  50           HG       SER  50  49.208  13.803   1.709
  371    HB2  SER  50           HB2      SER  50  51.230  12.000   1.178
  372    HB3  SER  50           HB3      SER  50  49.987  12.126  -0.066
  373    H    LYS  51           H        LYS  51  47.657  11.225   3.744
  374    HA   LYS  51           HA       LYS  51  48.229  10.729   6.040
  375    HB2  LYS  51           HB2      LYS  51  50.663  11.053   5.692
  376    HB3  LYS  51           HB3      LYS  51  50.406  12.793   5.657
  377    HG2  LYS  51           HG2      LYS  51  50.180  12.940   7.894
  378    HG3  LYS  51           HG3      LYS  51  49.351  11.387   8.022
  379    HD2  LYS  51           HD2      LYS  51  51.853  10.620   7.252
  380    HD3  LYS  51           HD3      LYS  51  52.203  12.030   8.253
  381    HE2  LYS  51           HE2      LYS  51  50.831  11.048  10.056
  382    HE3  LYS  51           HE3      LYS  51  50.581   9.617   9.056
  383    HZ1  LYS  51           HZ1      LYS  51  52.564   9.897  10.839
  384    HZ2  LYS  51           HZ2      LYS  51  53.348  10.370   9.417
  385    HZ3  LYS  51           HZ3      LYS  51  52.619   8.847   9.513
  386    H    HIS  52           H        HIS  52  46.402  11.518   6.813
  387    HA   HIS  52           HA       HIS  52  45.093  13.821   6.332
  388    HD1  HIS  52           HD1      HIS  52  44.078  15.605   8.047
  389    HD2  HIS  52           HD2      HIS  52  41.940  12.134   8.849
  390    HE1  HIS  52           HE1      HIS  52  41.685  16.321   8.445
  391    HB2  HIS  52           HB2      HIS  52  44.499  11.855   7.918
  392    HB3  HIS  52           HB3      HIS  52  45.249  12.840   9.167
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  28.529 -16.617   3.391
    2    H2   GLY   1           2H       GLY   1  27.111 -16.990   2.549
    3    H3   GLY   1           3H       GLY   1  27.341 -17.576   4.119
    4    HA2  GLY   1           HA2      GLY   1  25.796 -15.731   4.144
    5    HA3  GLY   1           HA3      GLY   1  27.275 -15.334   5.008
    6    H    SER   2           H        SER   2  28.779 -13.899   4.051
    7    HA   SER   2           HA       SER   2  27.524 -11.929   2.350
    8    HG   SER   2           HG       SER   2  29.778 -12.253   5.104
    9    HB2  SER   2           HB2      SER   2  30.397 -11.721   3.132
   10    HB3  SER   2           HB3      SER   2  29.157 -10.468   3.060
   11    HA   PRO   3           HA       PRO   3  29.464 -13.753  -1.252
   12    HB2  PRO   3           HB2      PRO   3  27.961 -12.529  -3.085
   13    HB3  PRO   3           HB3      PRO   3  27.282 -13.787  -2.044
   14    HG2  PRO   3           HG2      PRO   3  27.003 -10.820  -1.860
   15    HG3  PRO   3           HG3      PRO   3  25.797 -12.080  -1.557
   16    HD2  PRO   3           HD2      PRO   3  27.277 -10.757   0.397
   17    HD3  PRO   3           HD3      PRO   3  26.428 -12.297   0.617
   18    HA   PRO   4           HA       PRO   4  32.340 -10.799  -2.819
   19    HB2  PRO   4           HB2      PRO   4  31.639 -11.353  -5.619
   20    HB3  PRO   4           HB3      PRO   4  33.141 -11.687  -4.753
   21    HG2  PRO   4           HG2      PRO   4  31.452 -13.650  -5.497
   22    HG3  PRO   4           HG3      PRO   4  32.413 -13.742  -4.010
   23    HD2  PRO   4           HD2      PRO   4  29.521 -13.052  -4.361
   24    HD3  PRO   4           HD3      PRO   4  30.301 -14.040  -3.106
   25    H    GLU   5           H        GLU   5  30.716  -9.154  -2.017
   26    HA   GLU   5           HA       GLU   5  30.643  -6.902  -3.468
   27    HB2  GLU   5           HB2      GLU   5  28.245  -6.898  -4.404
   28    HB3  GLU   5           HB3      GLU   5  29.490  -7.741  -5.314
   29    HG2  GLU   5           HG2      GLU   5  28.585  -9.778  -4.941
   30    HG3  GLU   5           HG3      GLU   5  27.978  -9.340  -3.345
   31    H    ALA   6           H        ALA   6  30.822  -6.463  -1.184
   32    HA   ALA   6           HA       ALA   6  29.773  -5.016   0.361
   33    HB1  ALA   6           HB1      ALA   6  27.599  -5.225  -0.919
   34    HB2  ALA   6           HB2      ALA   6  27.470  -5.030   0.830
   35    HB3  ALA   6           HB3      ALA   6  27.249  -6.621   0.102
   36    H    ASP   7           H        ASP   7  31.498  -6.867   0.943
   37    HA   ASP   7           HA       ASP   7  30.361  -8.595   3.022
   38    HB2  ASP   7           HB2      ASP   7  33.232  -8.555   2.081
   39    HB3  ASP   7           HB3      ASP   7  32.397  -9.836   2.956
   40    HA   PRO   8           HA       PRO   8  31.459  -6.320   6.635
   41    HB2  PRO   8           HB2      PRO   8  33.729  -8.270   6.871
   42    HB3  PRO   8           HB3      PRO   8  32.635  -7.672   8.125
   43    HG2  PRO   8           HG2      PRO   8  32.319 -10.087   6.891
   44    HG3  PRO   8           HG3      PRO   8  30.978  -9.152   7.569
   45    HD2  PRO   8           HD2      PRO   8  31.553  -9.749   4.789
   46    HD3  PRO   8           HD3      PRO   8  30.125  -8.954   5.478
   47    H    ARG   9           H        ARG   9  34.418  -7.576   5.101
   48    HA   ARG   9           HA       ARG   9  36.047  -5.383   5.600
   49    HE   ARG   9           HE       ARG   9  38.194  -9.315   6.958
   50    HB2  ARG   9           HB2      ARG   9  36.181  -7.328   3.290
   51    HB3  ARG   9           HB3      ARG   9  37.503  -6.323   3.871
   52    HG2  ARG   9           HG2      ARG   9  36.167  -8.591   5.328
   53    HG3  ARG   9           HG3      ARG   9  37.812  -8.547   4.692
   54    HD2  ARG   9           HD2      ARG   9  38.300  -6.675   6.256
   55    HD3  ARG   9           HD3      ARG   9  36.693  -6.889   6.948
   56   HH11  ARG   9          HH11      ARG   9  37.743  -6.292   8.629
   57   HH12  ARG   9          HH12      ARG   9  38.287  -6.905  10.154
   58   HH21  ARG   9          HH21      ARG   9  38.910 -10.132   8.964
   59   HH22  ARG   9          HH22      ARG   9  38.951  -9.087  10.344
   60    H    LEU  10           H        LEU  10  34.366  -6.186   2.560
   61    HA   LEU  10           HA       LEU  10  35.106  -3.762   1.289
   62    HG   LEU  10           HG       LEU  10  34.598  -6.958  -0.605
   63    HB2  LEU  10           HB2      LEU  10  33.044  -5.838   0.576
   64    HB3  LEU  10           HB3      LEU  10  33.462  -4.484  -0.456
   65   HD11  LEU  10          HD11      LEU  10  34.678  -4.837  -2.101
   66   HD12  LEU  10          HD12      LEU  10  35.950  -6.052  -2.227
   67   HD13  LEU  10          HD13      LEU  10  36.235  -4.569  -1.315
   68   HD21  LEU  10          HD21      LEU  10  35.772  -6.782   1.497
   69   HD22  LEU  10          HD22      LEU  10  36.464  -5.229   1.023
   70   HD23  LEU  10          HD23      LEU  10  36.932  -6.702   0.173
   71    H    ILE  11           H        ILE  11  32.537  -4.606   3.396
   72    HA   ILE  11           HA       ILE  11  30.959  -2.274   2.619
   73    HB   ILE  11           HB       ILE  11  29.830  -4.424   3.318
   74   HG12  ILE  11          HG12      ILE  11  28.748  -2.619   5.310
   75   HG13  ILE  11          HG13      ILE  11  29.147  -1.757   3.828
   76   HG21  ILE  11          HG21      ILE  11  31.425  -3.929   5.694
   77   HG22  ILE  11          HG22      ILE  11  30.631  -5.407   5.149
   78   HG23  ILE  11          HG23      ILE  11  29.722  -4.200   6.060
   79   HD11  ILE  11          HD11      ILE  11  27.487  -4.259   3.874
   80   HD12  ILE  11          HD12      ILE  11  27.701  -3.120   2.545
   81   HD13  ILE  11          HD13      ILE  11  26.805  -2.638   3.985
   82    H    GLU  12           H        GLU  12  33.440  -3.207   4.645
   83    HA   GLU  12           HA       GLU  12  33.107  -0.975   6.513
   84    HB2  GLU  12           HB2      GLU  12  33.717  -3.263   7.366
   85    HB3  GLU  12           HB3      GLU  12  35.250  -3.104   6.519
   86    HG2  GLU  12           HG2      GLU  12  35.763  -2.490   8.692
   87    HG3  GLU  12           HG3      GLU  12  35.547  -0.946   7.868
   88    H    SER  13           H        SER  13  35.717  -2.402   4.561
   89    HA   SER  13           HA       SER  13  37.105   0.142   4.500
   90    HG   SER  13           HG       SER  13  37.885  -2.945   2.549
   91    HB2  SER  13           HB2      SER  13  38.974  -1.081   4.354
   92    HB3  SER  13           HB3      SER  13  37.947  -2.478   4.678
   93    H    LEU  14           H        LEU  14  35.512  -2.030   2.116
   94    HA   LEU  14           HA       LEU  14  36.535  -0.481  -0.073
   95    HG   LEU  14           HG       LEU  14  34.892  -0.676  -2.100
   96    HB2  LEU  14           HB2      LEU  14  35.964  -2.789  -0.491
   97    HB3  LEU  14           HB3      LEU  14  34.305  -2.508  -0.027
   98   HD11  LEU  14          HD11      LEU  14  35.733  -1.935  -3.865
   99   HD12  LEU  14          HD12      LEU  14  35.472  -3.463  -3.027
  100   HD13  LEU  14          HD13      LEU  14  36.767  -2.386  -2.511
  101   HD21  LEU  14          HD21      LEU  14  32.826  -2.248  -1.319
  102   HD22  LEU  14          HD22      LEU  14  33.364  -3.086  -2.774
  103   HD23  LEU  14          HD23      LEU  14  32.903  -1.386  -2.855
  104    H    SER  15           H        SER  15  33.111  -0.893   0.975
  105    HA   SER  15           HA       SER  15  31.982   1.173  -0.368
  106    HG   SER  15           HG       SER  15  30.310   2.255   0.781
  107    HB2  SER  15           HB2      SER  15  30.753  -0.292   1.228
  108    HB3  SER  15           HB3      SER  15  31.492   0.581   2.569
  109    H    GLN  16           H        GLN  16  33.344   1.491   2.885
  110    HA   GLN  16           HA       GLN  16  33.331   4.170   3.268
  111    HB2  GLN  16           HB2      GLN  16  34.310   2.352   4.774
  112    HB3  GLN  16           HB3      GLN  16  35.796   2.532   3.855
  113    HG2  GLN  16           HG2      GLN  16  34.442   4.582   5.581
  114    HG3  GLN  16           HG3      GLN  16  36.001   3.809   5.845
  115   HE21  GLN  16          HE21      GLN  16  37.189   4.033   3.399
  116   HE22  GLN  16          HE22      GLN  16  37.418   5.700   2.991
  117    H    MET  17           H        MET  17  35.483   2.371   1.143
  118    HA   MET  17           HA       MET  17  37.173   4.610   0.571
  119    HB2  MET  17           HB2      MET  17  36.891   1.843  -0.510
  120    HB3  MET  17           HB3      MET  17  37.738   3.036  -1.481
  121    HG2  MET  17           HG2      MET  17  38.428   2.314   1.356
  122    HG3  MET  17           HG3      MET  17  39.237   1.687  -0.079
  123    HE1  MET  17           HE1      MET  17  39.110   5.200  -1.577
  124    HE2  MET  17           HE2      MET  17  39.475   3.524  -1.984
  125    HE3  MET  17           HE3      MET  17  40.787   4.671  -1.717
  126    H    LEU  18           H        LEU  18  34.179   3.357  -0.689
  127    HA   LEU  18           HA       LEU  18  34.344   5.078  -3.050
  128    HG   LEU  18           HG       LEU  18  32.642   2.266  -4.576
  129    HB2  LEU  18           HB2      LEU  18  32.798   2.739  -2.251
  130    HB3  LEU  18           HB3      LEU  18  31.801   3.987  -2.974
  131   HD11  LEU  18          HD11      LEU  18  31.901   4.348  -5.461
  132   HD12  LEU  18          HD12      LEU  18  33.414   3.944  -6.272
  133   HD13  LEU  18          HD13      LEU  18  33.399   5.152  -4.988
  134   HD21  LEU  18          HD21      LEU  18  35.218   3.267  -3.530
  135   HD22  LEU  18          HD22      LEU  18  35.130   2.976  -5.266
  136   HD23  LEU  18          HD23      LEU  18  34.779   1.669  -4.134
  137    H    SER  19           H        SER  19  31.829   4.494  -0.588
  138    HA   SER  19           HA       SER  19  30.469   6.897  -1.014
  139    HG   SER  19           HG       SER  19  28.515   6.217  -0.578
  140    HB2  SER  19           HB2      SER  19  29.988   4.593   0.388
  141    HB3  SER  19           HB3      SER  19  30.170   5.784   1.676
  142    H    MET  20           H        MET  20  33.496   6.817   0.154
  143    HA   MET  20           HA       MET  20  33.105   8.772   2.286
  144    HB2  MET  20           HB2      MET  20  34.835   7.232   2.793
  145    HB3  MET  20           HB3      MET  20  35.537   7.366   1.189
  146    HG2  MET  20           HG2      MET  20  37.014   8.595   2.419
  147    HG3  MET  20           HG3      MET  20  35.910   9.855   1.875
  148    HE1  MET  20           HE1      MET  20  34.104  11.040   4.963
  149    HE2  MET  20           HE2      MET  20  33.528  10.175   3.538
  150    HE3  MET  20           HE3      MET  20  34.739  11.447   3.370
  151    H    GLY  21           H        GLY  21  33.908   8.486  -1.029
  152    HA2  GLY  21           HA2      GLY  21  33.476  10.467  -2.426
  153    HA3  GLY  21           HA3      GLY  21  34.321  11.406  -1.196
  154    H    PHE  22           H        PHE  22  35.677   8.333  -1.756
  155    HA   PHE  22           HA       PHE  22  37.646   9.453  -3.612
  156    HD1  PHE  22           HD2      PHE  22  38.421  10.985  -2.919
  157    HD2  PHE  22           HD1      PHE  22  39.458   8.830   0.604
  158    HE1  PHE  22           HE2      PHE  22  39.081  13.090  -1.831
  159    HE2  PHE  22           HE1      PHE  22  40.121  10.934   1.697
  160    HZ   PHE  22           HZ       PHE  22  39.932  13.065   0.479
  161    HB2  PHE  22           HB2      PHE  22  38.146   7.798  -1.132
  162    HB3  PHE  22           HB3      PHE  22  39.359   8.063  -2.384
  163    H    SER  23           H        SER  23  39.129   7.253  -4.155
  164    HA   SER  23           HA       SER  23  37.390   5.007  -4.574
  165    HG   SER  23           HG       SER  23  36.453   7.170  -7.301
  166    HB2  SER  23           HB2      SER  23  38.481   6.532  -6.957
  167    HB3  SER  23           HB3      SER  23  37.609   5.000  -7.031
  168    H    ASP  24           H        ASP  24  39.423   4.514  -6.995
  169    HA   ASP  24           HA       ASP  24  41.638   3.647  -5.262
  170    HB2  ASP  24           HB2      ASP  24  41.919   1.711  -6.757
  171    HB3  ASP  24           HB3      ASP  24  40.310   1.733  -6.035
  172    H    GLU  25           H        GLU  25  43.455   4.724  -5.706
  173    HA   GLU  25           HA       GLU  25  43.923   6.573  -7.601
  174    HB2  GLU  25           HB2      GLU  25  45.598   4.967  -5.902
  175    HB3  GLU  25           HB3      GLU  25  46.383   5.228  -7.450
  176    HG2  GLU  25           HG2      GLU  25  45.552   7.725  -6.936
  177    HG3  GLU  25           HG3      GLU  25  45.767   7.129  -5.291
  178    H    GLY  26           H        GLY  26  45.087   3.286  -7.953
  179    HA2  GLY  26           HA2      GLY  26  44.510   3.435 -10.834
  180    HA3  GLY  26           HA3      GLY  26  46.110   2.944 -10.283
  181    H    GLY  27           H        GLY  27  43.018   2.103  -8.807
  182    HA2  GLY  27           HA2      GLY  27  41.875   0.080  -8.795
  183    HA3  GLY  27           HA3      GLY  27  43.052  -0.561  -9.934
  184    H    TRP  28           H        TRP  28  43.605   0.932  -6.793
  185    HA   TRP  28           HA       TRP  28  45.041  -1.488  -6.021
  186    HD1  TRP  28           HD1      TRP  28  45.906   3.077  -5.832
  187    HE1  TRP  28           HE1      TRP  28  44.686   4.758  -4.321
  188    HE3  TRP  28           HE3      TRP  28  43.769  -0.180  -2.506
  189    HZ2  TRP  28           HZ2      TRP  28  43.036   4.717  -2.050
  190    HZ3  TRP  28           HZ3      TRP  28  42.383   0.732  -0.704
  191    HH2  TRP  28           HH2      TRP  28  42.023   3.134  -0.483
  192    HB2  TRP  28           HB2      TRP  28  46.113  -0.187  -4.274
  193    HB3  TRP  28           HB3      TRP  28  46.306   0.591  -5.839
  194    H    LEU  29           H        LEU  29  42.255   0.466  -5.051
  195    HA   LEU  29           HA       LEU  29  41.693  -0.296  -2.535
  196    HG   LEU  29           HG       LEU  29  39.043  -1.912  -3.413
  197    HB2  LEU  29           HB2      LEU  29  39.978   0.910  -3.424
  198    HB3  LEU  29           HB3      LEU  29  40.029   0.063  -4.958
  199   HD11  LEU  29          HD11      LEU  29  37.510   0.319  -2.247
  200   HD12  LEU  29          HD12      LEU  29  39.111   0.033  -1.563
  201   HD13  LEU  29          HD13      LEU  29  37.913  -1.260  -1.573
  202   HD21  LEU  29          HD21      LEU  29  37.543  -1.647  -5.025
  203   HD22  LEU  29          HD22      LEU  29  38.016   0.036  -5.255
  204   HD23  LEU  29          HD23      LEU  29  36.794  -0.381  -4.054
  205    H    THR  30           H        THR  30  40.638  -2.271  -5.271
  206    HA   THR  30           HA       THR  30  39.989  -4.543  -3.833
  207    HB   THR  30           HB       THR  30  39.223  -4.518  -6.028
  208    HG1  THR  30           HG1      THR  30  41.475  -6.239  -6.051
  209   HG21  THR  30          HG21      THR  30  40.260  -3.230  -7.502
  210   HG22  THR  30          HG22      THR  30  41.308  -4.614  -7.816
  211   HG23  THR  30          HG23      THR  30  41.806  -3.372  -6.666
  212    H    ARG  31           H        ARG  31  43.179  -3.459  -4.926
  213    HA   ARG  31           HA       ARG  31  44.375  -6.006  -4.142
  214    HE   ARG  31           HE       ARG  31  43.310  -6.371  -8.687
  215    HB2  ARG  31           HB2      ARG  31  45.358  -3.572  -5.594
  216    HB3  ARG  31           HB3      ARG  31  46.492  -4.746  -4.947
  217    HG2  ARG  31           HG2      ARG  31  45.552  -4.850  -7.427
  218    HG3  ARG  31           HG3      ARG  31  45.995  -6.294  -6.514
  219    HD2  ARG  31           HD2      ARG  31  43.657  -6.578  -5.843
  220    HD3  ARG  31           HD3      ARG  31  43.220  -5.134  -6.760
  221   HH11  ARG  31          HH11      ARG  31  44.840  -8.144  -6.109
  222   HH12  ARG  31          HH12      ARG  31  45.034  -9.590  -7.044
  223   HH21  ARG  31          HH21      ARG  31  43.567  -8.262  -9.931
  224   HH22  ARG  31          HH22      ARG  31  44.309  -9.658  -9.219
  225    H    LEU  32           H        LEU  32  45.354  -2.621  -3.638
  226    HA   LEU  32           HA       LEU  32  47.088  -2.921  -1.586
  227    HG   LEU  32           HG       LEU  32  44.642  -0.390  -0.376
  228    HB2  LEU  32           HB2      LEU  32  47.118  -0.751  -2.067
  229    HB3  LEU  32           HB3      LEU  32  45.460  -0.768  -2.629
  230   HD11  LEU  32          HD11      LEU  32  46.635   0.233   1.270
  231   HD12  LEU  32          HD12      LEU  32  47.444  -1.014   0.320
  232   HD13  LEU  32          HD13      LEU  32  45.948  -1.386   1.172
  233   HD21  LEU  32          HD21      LEU  32  44.986   1.802  -0.558
  234   HD22  LEU  32          HD22      LEU  32  46.068   1.426  -1.899
  235   HD23  LEU  32          HD23      LEU  32  46.717   1.630  -0.272
  236    H    LEU  33           H        LEU  33  43.583  -2.313  -1.085
  237    HA   LEU  33           HA       LEU  33  43.361  -2.399   1.612
  238    HG   LEU  33           HG       LEU  33  41.569  -1.369  -0.560
  239    HB2  LEU  33           HB2      LEU  33  41.673  -3.836  -0.435
  240    HB3  LEU  33           HB3      LEU  33  41.236  -3.754   1.263
  241   HD11  LEU  33          HD11      LEU  33  39.198  -2.972   0.300
  242   HD12  LEU  33          HD12      LEU  33  39.608  -2.342  -1.295
  243   HD13  LEU  33          HD13      LEU  33  39.029  -1.250  -0.037
  244   HD21  LEU  33          HD21      LEU  33  40.312  -1.392   2.163
  245   HD22  LEU  33          HD22      LEU  33  40.887  -0.018   1.218
  246   HD23  LEU  33          HD23      LEU  33  42.043  -1.129   1.952
  247    H    GLN  34           H        GLN  34  43.107  -5.287  -0.330
  248    HA   GLN  34           HA       GLN  34  43.250  -7.312   1.443
  249    HB2  GLN  34           HB2      GLN  34  44.837  -7.111  -1.104
  250    HB3  GLN  34           HB3      GLN  34  44.565  -8.614  -0.235
  251    HG2  GLN  34           HG2      GLN  34  42.104  -7.175  -0.808
  252    HG3  GLN  34           HG3      GLN  34  43.010  -7.587  -2.262
  253   HE21  GLN  34          HE21      GLN  34  41.885  -9.014   0.780
  254   HE22  GLN  34          HE22      GLN  34  41.523 -10.567   0.115
  255    H    THR  35           H        THR  35  46.074  -5.476   0.298
  256    HA   THR  35           HA       THR  35  48.002  -6.865   1.862
  257    HB   THR  35           HB       THR  35  48.303  -4.074   0.771
  258    HG1  THR  35           HG1      THR  35  48.353  -4.849  -1.177
  259   HG21  THR  35          HG21      THR  35  50.585  -5.481   0.228
  260   HG22  THR  35          HG22      THR  35  50.129  -6.074   1.825
  261   HG23  THR  35          HG23      THR  35  50.363  -4.346   1.558
  262    H    LYS  36           H        LYS  36  45.604  -5.007   2.894
  263    HA   LYS  36           HA       LYS  36  47.030  -4.190   5.323
  264    HB2  LYS  36           HB2      LYS  36  44.709  -2.547   4.403
  265    HB3  LYS  36           HB3      LYS  36  46.065  -2.090   5.423
  266    HG2  LYS  36           HG2      LYS  36  46.550  -2.730   2.555
  267    HG3  LYS  36           HG3      LYS  36  45.855  -1.169   3.000
  268    HD2  LYS  36           HD2      LYS  36  47.908  -0.441   3.427
  269    HD3  LYS  36           HD3      LYS  36  47.987  -1.587   4.766
  270    HE2  LYS  36           HE2      LYS  36  49.524  -2.786   3.701
  271    HE3  LYS  36           HE3      LYS  36  48.466  -2.959   2.302
  272    HZ1  LYS  36           HZ1      LYS  36  49.400  -1.152   1.259
  273    HZ2  LYS  36           HZ2      LYS  36  50.750  -1.798   2.047
  274    HZ3  LYS  36           HZ3      LYS  36  49.956  -0.452   2.696
  275    H    ASN  37           H        ASN  37  45.438  -6.514   4.488
  276    HA   ASN  37           HA       ASN  37  43.777  -7.867   5.234
  277    HB2  ASN  37           HB2      ASN  37  43.058  -6.896   7.753
  278    HB3  ASN  37           HB3      ASN  37  44.248  -8.151   7.411
  279   HD21  ASN  37          HD21      ASN  37  43.710  -5.005   8.580
  280   HD22  ASN  37          HD22      ASN  37  45.357  -4.583   8.883
  281    H    TYR  38           H        TYR  38  43.032  -5.667   3.640
  282    HA   TYR  38           HA       TYR  38  41.187  -4.585   2.907
  283    HD1  TYR  38           HD2      TYR  38  39.403  -4.951   1.459
  284    HD2  TYR  38           HD1      TYR  38  39.895  -8.598   3.594
  285    HE1  TYR  38           HE2      TYR  38  39.070  -6.210  -0.627
  286    HE2  TYR  38           HE1      TYR  38  39.566  -9.867   1.515
  287    HH   TYR  38           HH       TYR  38  39.908  -9.318  -1.053
  288    HB2  TYR  38           HB2      TYR  38  40.023  -6.619   4.756
  289    HB3  TYR  38           HB3      TYR  38  38.982  -5.338   4.150
  290    H    ASP  39           H        ASP  39  42.610  -3.000   4.338
  291    HA   ASP  39           HA       ASP  39  40.778  -1.775   6.307
  292    HB2  ASP  39           HB2      ASP  39  43.706  -2.206   6.351
  293    HB3  ASP  39           HB3      ASP  39  43.127  -0.668   6.995
  294    H    ILE  40           H        ILE  40  40.450   0.417   6.315
  295    HA   ILE  40           HA       ILE  40  41.003   1.752   3.793
  296    HB   ILE  40           HB       ILE  40  39.580   3.597   4.936
  297   HG12  ILE  40          HG12      ILE  40  39.831   2.184   7.162
  298   HG13  ILE  40          HG13      ILE  40  38.358   3.086   6.819
  299   HG21  ILE  40          HG21      ILE  40  38.482   2.666   3.188
  300   HG22  ILE  40          HG22      ILE  40  37.487   2.008   4.488
  301   HG23  ILE  40          HG23      ILE  40  38.748   1.016   3.755
  302   HD11  ILE  40          HD11      ILE  40  37.127   1.208   6.467
  303   HD12  ILE  40          HD12      ILE  40  38.304   0.579   7.622
  304   HD13  ILE  40          HD13      ILE  40  38.509   0.272   5.897
  305    H    GLY  41           H        GLY  41  41.863   1.796   7.135
  306    HA2  GLY  41           HA2      GLY  41  42.834   4.215   7.673
  307    HA3  GLY  41           HA3      GLY  41  43.707   2.774   8.136
  308    H    ALA  42           H        ALA  42  44.518   1.838   5.743
  309    HA   ALA  42           HA       ALA  42  46.475   3.859   4.939
  310    HB1  ALA  42           HB1      ALA  42  46.508   0.858   4.654
  311    HB2  ALA  42           HB2      ALA  42  47.479   1.835   5.754
  312    HB3  ALA  42           HB3      ALA  42  47.752   1.932   4.015
  313    H    ALA  43           H        ALA  43  43.685   2.300   3.859
  314    HA   ALA  43           HA       ALA  43  44.149   2.113   1.099
  315    HB1  ALA  43           HB1      ALA  43  41.485   2.828   2.288
  316    HB2  ALA  43           HB2      ALA  43  42.177   1.214   2.443
  317    HB3  ALA  43           HB3      ALA  43  41.827   1.873   0.847
  318    H    LEU  44           H        LEU  44  42.726   4.752   3.024
  319    HA   LEU  44           HA       LEU  44  42.349   6.545   0.909
  320    HG   LEU  44           HG       LEU  44  40.396   7.027   2.006
  321    HB2  LEU  44           HB2      LEU  44  42.727   6.894   3.862
  322    HB3  LEU  44           HB3      LEU  44  42.590   8.292   2.803
  323   HD11  LEU  44          HD11      LEU  44  39.455   6.198   4.361
  324   HD12  LEU  44          HD12      LEU  44  41.147   5.746   4.563
  325   HD13  LEU  44          HD13      LEU  44  40.223   5.111   3.202
  326   HD21  LEU  44          HD21      LEU  44  41.023   9.102   3.872
  327   HD22  LEU  44          HD22      LEU  44  39.603   8.219   4.430
  328   HD23  LEU  44          HD23      LEU  44  39.617   8.940   2.820
  329    H    ASP  45           H        ASP  45  44.950   6.363   3.284
  330    HA   ASP  45           HA       ASP  45  46.629   8.315   2.675
  331    HB2  ASP  45           HB2      ASP  45  46.880   5.998   4.058
  332    HB3  ASP  45           HB3      ASP  45  48.024   5.716   2.751
  333    H    THR  46           H        THR  46  45.952   5.666   0.477
  334    HA   THR  46           HA       THR  46  48.147   6.500  -1.251
  335    HB   THR  46           HB       THR  46  47.641   4.503  -2.569
  336    HG1  THR  46           HG1      THR  46  45.333   4.593  -2.029
  337   HG21  THR  46          HG21      THR  46  48.274   2.828  -1.027
  338   HG22  THR  46          HG22      THR  46  47.632   3.744   0.335
  339   HG23  THR  46          HG23      THR  46  49.063   4.320  -0.518
  340    H    ILE  47           H        ILE  47  44.719   6.946  -1.058
  341    HA   ILE  47           HA       ILE  47  44.496   7.524  -3.904
  342    HB   ILE  47           HB       ILE  47  42.112   8.312  -3.035
  343   HG12  ILE  47          HG12      ILE  47  42.943   6.245  -0.998
  344   HG13  ILE  47          HG13      ILE  47  42.762   7.962  -0.659
  345   HG21  ILE  47          HG21      ILE  47  41.765   5.571  -3.065
  346   HG22  ILE  47          HG22      ILE  47  43.223   5.834  -4.021
  347   HG23  ILE  47          HG23      ILE  47  41.725   6.653  -4.454
  348   HD11  ILE  47          HD11      ILE  47  40.442   6.609  -1.876
  349   HD12  ILE  47          HD12      ILE  47  40.512   7.857  -0.633
  350   HD13  ILE  47          HD13      ILE  47  40.842   6.178  -0.214
  351    H    GLN  48           H        GLN  48  44.507   9.297  -0.843
  352    HA   GLN  48           HA       GLN  48  45.231  11.716  -2.222
  353    HB2  GLN  48           HB2      GLN  48  42.580  11.612  -0.776
  354    HB3  GLN  48           HB3      GLN  48  43.351  13.075  -1.362
  355    HG2  GLN  48           HG2      GLN  48  41.887  12.704  -3.047
  356    HG3  GLN  48           HG3      GLN  48  43.264  11.795  -3.659
  357   HE21  GLN  48          HE21      GLN  48  41.372  10.833  -4.879
  358   HE22  GLN  48          HE22      GLN  48  40.608   9.454  -4.157
  359    H    TYR  49           H        TYR  49  46.402  10.069  -0.049
  360    HA   TYR  49           HA       TYR  49  46.971  12.223   1.738
  361    HD1  TYR  49           HD1      TYR  49  46.164  13.060   4.430
  362    HD2  TYR  49           HD2      TYR  49  43.189  11.289   1.953
  363    HE1  TYR  49           HE1      TYR  49  44.638  14.922   4.936
  364    HE2  TYR  49           HE2      TYR  49  41.660  13.148   2.448
  365    HH   TYR  49           HH       TYR  49  41.392  14.842   4.388
  366    HB2  TYR  49           HB2      TYR  49  45.116  10.038   2.576
  367    HB3  TYR  49           HB3      TYR  49  46.268  10.660   3.753
  368    H    SER  50           H        SER  50  48.618  10.615   0.066
  369    HA   SER  50           HA       SER  50  49.893   8.650   1.771
  370    HG   SER  50           HG       SER  50  52.448   8.962  -0.352
  371    HB2  SER  50           HB2      SER  50  49.791   8.096  -0.564
  372    HB3  SER  50           HB3      SER  50  50.504   9.641  -1.020
  373    H    LYS  51           H        LYS  51  49.908  11.294   2.817
  374    HA   LYS  51           HA       LYS  51  52.538  11.535   3.674
  375    HB2  LYS  51           HB2      LYS  51  52.915  12.243   1.307
  376    HB3  LYS  51           HB3      LYS  51  51.833  13.601   1.583
  377    HG2  LYS  51           HG2      LYS  51  53.949  14.513   1.843
  378    HG3  LYS  51           HG3      LYS  51  53.414  14.223   3.500
  379    HD2  LYS  51           HD2      LYS  51  54.669  12.096   3.498
  380    HD3  LYS  51           HD3      LYS  51  55.252  12.467   1.874
  381    HE2  LYS  51           HE2      LYS  51  56.942  13.580   2.785
  382    HE3  LYS  51           HE3      LYS  51  55.783  14.737   3.438
  383    HZ1  LYS  51           HZ1      LYS  51  57.420  13.027   4.857
  384    HZ2  LYS  51           HZ2      LYS  51  55.858  12.401   5.035
  385    HZ3  LYS  51           HZ3      LYS  51  56.182  14.002   5.474
  386    H    HIS  52           H        HIS  52  50.349  11.538   5.110
  387    HA   HIS  52           HA       HIS  52  48.914  13.841   5.579
  388    HD1  HIS  52           HD1      HIS  52  49.238  13.113   9.870
  389    HD2  HIS  52           HD2      HIS  52  46.388  13.568   6.882
  390    HE1  HIS  52           HE1      HIS  52  47.288  14.325  10.929
  391    HB2  HIS  52           HB2      HIS  52  48.558  11.595   6.652
  392    HB3  HIS  52           HB3      HIS  52  49.892  11.966   7.738
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  36.853 -15.634  -1.335
    2    H2   GLY   1           2H       GLY   1  36.524 -13.996  -1.598
    3    H3   GLY   1           3H       GLY   1  37.169 -14.940  -2.845
    4    HA2  GLY   1           HA2      GLY   1  35.203 -15.804  -3.430
    5    HA3  GLY   1           HA3      GLY   1  34.695 -15.952  -1.754
    6    H    SER   2           H        SER   2  32.618 -15.216  -2.566
    7    HA   SER   2           HA       SER   2  32.525 -12.298  -2.968
    8    HG   SER   2           HG       SER   2  29.415 -14.524  -3.885
    9    HB2  SER   2           HB2      SER   2  31.114 -12.635  -4.682
   10    HB3  SER   2           HB3      SER   2  31.400 -14.368  -4.520
   11    HA   PRO   3           HA       PRO   3  30.326 -12.595   0.940
   12    HB2  PRO   3           HB2      PRO   3  31.048 -10.196   1.873
   13    HB3  PRO   3           HB3      PRO   3  32.201 -11.531   1.794
   14    HG2  PRO   3           HG2      PRO   3  31.987  -9.117   0.098
   15    HG3  PRO   3           HG3      PRO   3  33.410 -10.091   0.495
   16    HD2  PRO   3           HD2      PRO   3  31.818 -10.204  -1.874
   17    HD3  PRO   3           HD3      PRO   3  33.190 -11.236  -1.440
   18    HA   PRO   4           HA       PRO   4  26.527 -10.385   0.570
   19    HB2  PRO   4           HB2      PRO   4  27.240  -8.610   2.848
   20    HB3  PRO   4           HB3      PRO   4  25.802  -9.609   2.607
   21    HG2  PRO   4           HG2      PRO   4  27.712 -10.355   4.311
   22    HG3  PRO   4           HG3      PRO   4  26.867 -11.546   3.305
   23    HD2  PRO   4           HD2      PRO   4  29.610 -10.418   3.013
   24    HD3  PRO   4           HD3      PRO   4  29.017 -12.052   2.655
   25    H    GLU   5           H        GLU   5  25.549  -8.311   0.042
   26    HA   GLU   5           HA       GLU   5  27.406  -6.606  -1.385
   27    HB2  GLU   5           HB2      GLU   5  24.695  -7.333  -1.702
   28    HB3  GLU   5           HB3      GLU   5  24.700  -5.608  -1.362
   29    HG2  GLU   5           HG2      GLU   5  26.729  -6.349  -3.292
   30    HG3  GLU   5           HG3      GLU   5  25.107  -6.805  -3.811
   31    H    ALA   6           H        ALA   6  28.545  -5.453   0.085
   32    HA   ALA   6           HA       ALA   6  28.890  -3.521   1.329
   33    HB1  ALA   6           HB1      ALA   6  26.560  -2.806   0.476
   34    HB2  ALA   6           HB2      ALA   6  27.152  -2.097   1.979
   35    HB3  ALA   6           HB3      ALA   6  25.972  -3.406   2.026
   36    H    ASP   7           H        ASP   7  29.435  -5.927   2.184
   37    HA   ASP   7           HA       ASP   7  28.208  -6.454   4.759
   38    HB2  ASP   7           HB2      ASP   7  29.032  -8.576   4.576
   39    HB3  ASP   7           HB3      ASP   7  29.050  -8.143   2.873
   40    HA   PRO   8           HA       PRO   8  30.990  -4.657   7.644
   41    HB2  PRO   8           HB2      PRO   8  31.736  -7.476   8.327
   42    HB3  PRO   8           HB3      PRO   8  31.340  -6.127   9.400
   43    HG2  PRO   8           HG2      PRO   8  29.537  -8.017   8.874
   44    HG3  PRO   8           HG3      PRO   8  29.060  -6.315   9.014
   45    HD2  PRO   8           HD2      PRO   8  29.271  -8.025   6.597
   46    HD3  PRO   8           HD3      PRO   8  28.233  -6.619   6.898
   47    H    ARG   9           H        ARG   9  32.132  -6.739   5.185
   48    HA   ARG   9           HA       ARG   9  34.949  -6.249   5.779
   49    HE   ARG   9           HE       ARG   9  36.151 -10.809   4.545
   50    HB2  ARG   9           HB2      ARG   9  33.543  -7.984   3.755
   51    HB3  ARG   9           HB3      ARG   9  35.270  -7.660   3.658
   52    HG2  ARG   9           HG2      ARG   9  35.757  -8.963   5.452
   53    HG3  ARG   9           HG3      ARG   9  34.211  -8.648   6.244
   54    HD2  ARG   9           HD2      ARG   9  33.541 -10.647   5.538
   55    HD3  ARG   9           HD3      ARG   9  33.555  -9.996   3.899
   56   HH11  ARG   9          HH11      ARG   9  33.002 -12.187   3.987
   57   HH12  ARG   9          HH12      ARG   9  33.622 -13.690   3.387
   58   HH21  ARG   9          HH21      ARG   9  36.980 -12.781   3.750
   59   HH22  ARG   9          HH22      ARG   9  35.885 -14.028   3.252
   60    H    LEU  10           H        LEU  10  32.675  -5.840   3.079
   61    HA   LEU  10           HA       LEU  10  34.407  -3.816   1.892
   62    HG   LEU  10           HG       LEU  10  33.465  -6.902   0.416
   63    HB2  LEU  10           HB2      LEU  10  31.980  -5.243   0.805
   64    HB3  LEU  10           HB3      LEU  10  32.919  -4.058  -0.080
   65   HD11  LEU  10          HD11      LEU  10  35.021  -5.569  -1.618
   66   HD12  LEU  10          HD12      LEU  10  33.305  -5.180  -1.750
   67   HD13  LEU  10          HD13      LEU  10  33.834  -6.863  -1.771
   68   HD21  LEU  10          HD21      LEU  10  35.952  -6.525   0.299
   69   HD22  LEU  10          HD22      LEU  10  35.200  -6.140   1.847
   70   HD23  LEU  10          HD23      LEU  10  35.642  -4.844   0.734
   71    H    ILE  11           H        ILE  11  31.807  -4.041   3.921
   72    HA   ILE  11           HA       ILE  11  30.401  -1.654   3.064
   73    HB   ILE  11           HB       ILE  11  29.440  -3.710   4.411
   74   HG12  ILE  11          HG12      ILE  11  28.449  -1.324   3.758
   75   HG13  ILE  11          HG13      ILE  11  27.563  -2.450   4.779
   76   HG21  ILE  11          HG21      ILE  11  31.103  -3.391   6.262
   77   HG22  ILE  11          HG22      ILE  11  29.418  -3.517   6.768
   78   HG23  ILE  11          HG23      ILE  11  30.206  -1.941   6.713
   79   HD11  ILE  11          HD11      ILE  11  29.354  -0.663   6.244
   80   HD12  ILE  11          HD12      ILE  11  27.674  -1.103   6.556
   81   HD13  ILE  11          HD13      ILE  11  28.054   0.152   5.375
   82    H    GLU  12           H        GLU  12  32.886  -2.654   5.165
   83    HA   GLU  12           HA       GLU  12  33.070  -0.064   6.511
   84    HB2  GLU  12           HB2      GLU  12  34.116  -2.781   6.995
   85    HB3  GLU  12           HB3      GLU  12  35.223  -1.477   7.401
   86    HG2  GLU  12           HG2      GLU  12  32.527  -1.014   8.382
   87    HG3  GLU  12           HG3      GLU  12  33.245  -2.496   9.011
   88    H    SER  13           H        SER  13  35.291  -2.242   4.770
   89    HA   SER  13           HA       SER  13  37.164  -0.140   4.276
   90    HG   SER  13           HG       SER  13  37.440  -2.809   5.486
   91    HB2  SER  13           HB2      SER  13  37.467  -2.558   2.661
   92    HB3  SER  13           HB3      SER  13  38.583  -1.813   3.806
   93    H    LEU  14           H        LEU  14  34.895  -1.949   2.194
   94    HA   LEU  14           HA       LEU  14  35.754  -0.601  -0.167
   95    HG   LEU  14           HG       LEU  14  34.685  -1.276  -2.217
   96    HB2  LEU  14           HB2      LEU  14  34.242  -2.834   0.309
   97    HB3  LEU  14           HB3      LEU  14  33.044  -1.689  -0.266
   98   HD11  LEU  14          HD11      LEU  14  36.154  -3.188  -0.737
   99   HD12  LEU  14          HD12      LEU  14  36.565  -2.441  -2.281
  100   HD13  LEU  14          HD13      LEU  14  35.650  -3.947  -2.246
  101   HD21  LEU  14          HD21      LEU  14  32.974  -2.303  -3.191
  102   HD22  LEU  14          HD22      LEU  14  32.657  -3.274  -1.753
  103   HD23  LEU  14          HD23      LEU  14  33.833  -3.822  -2.948
  104    H    SER  15           H        SER  15  32.558  -0.437   1.461
  105    HA   SER  15           HA       SER  15  31.522   1.722   0.169
  106    HG   SER  15           HG       SER  15  28.980   1.268   1.994
  107    HB2  SER  15           HB2      SER  15  30.821   0.350   2.440
  108    HB3  SER  15           HB3      SER  15  31.218   1.938   3.097
  109    H    GLN  16           H        GLN  16  33.400   1.957   3.181
  110    HA   GLN  16           HA       GLN  16  33.824   4.640   3.342
  111    HB2  GLN  16           HB2      GLN  16  34.688   2.832   4.883
  112    HB3  GLN  16           HB3      GLN  16  36.010   2.586   3.753
  113    HG2  GLN  16           HG2      GLN  16  35.451   4.881   5.558
  114    HG3  GLN  16           HG3      GLN  16  36.926   3.943   5.377
  115   HE21  GLN  16          HE21      GLN  16  37.713   4.082   2.933
  116   HE22  GLN  16          HE22      GLN  16  37.856   5.700   2.337
  117    H    MET  17           H        MET  17  35.368   2.324   1.192
  118    HA   MET  17           HA       MET  17  37.316   4.057   0.135
  119    HB2  MET  17           HB2      MET  17  37.911   2.299  -1.140
  120    HB3  MET  17           HB3      MET  17  36.787   1.407  -0.132
  121    HG2  MET  17           HG2      MET  17  35.872   0.750  -2.044
  122    HG3  MET  17           HG3      MET  17  35.158   2.353  -2.117
  123    HE1  MET  17           HE1      MET  17  35.975   2.320  -5.768
  124    HE2  MET  17           HE2      MET  17  35.301   3.483  -4.626
  125    HE3  MET  17           HE3      MET  17  34.819   1.787  -4.546
  126    H    LEU  18           H        LEU  18  33.969   3.371  -0.811
  127    HA   LEU  18           HA       LEU  18  34.160   5.400  -2.924
  128    HG   LEU  18           HG       LEU  18  30.774   5.247  -3.006
  129    HB2  LEU  18           HB2      LEU  18  33.081   3.408  -3.633
  130    HB3  LEU  18           HB3      LEU  18  32.053   3.374  -2.213
  131   HD11  LEU  18          HD11      LEU  18  31.772   6.804  -4.231
  132   HD12  LEU  18          HD12      LEU  18  31.663   5.711  -5.611
  133   HD13  LEU  18          HD13      LEU  18  33.116   5.725  -4.609
  134   HD21  LEU  18          HD21      LEU  18  29.636   3.653  -4.065
  135   HD22  LEU  18          HD22      LEU  18  31.111   2.823  -4.562
  136   HD23  LEU  18          HD23      LEU  18  30.481   4.158  -5.528
  137    H    SER  19           H        SER  19  31.850   4.609  -0.340
  138    HA   SER  19           HA       SER  19  30.330   6.853  -0.290
  139    HG   SER  19           HG       SER  19  29.280   4.399   0.715
  140    HB2  SER  19           HB2      SER  19  31.125   4.864   1.749
  141    HB3  SER  19           HB3      SER  19  30.425   6.365   2.359
  142    H    MET  20           H        MET  20  33.670   6.790   0.460
  143    HA   MET  20           HA       MET  20  33.546   9.186   2.100
  144    HB2  MET  20           HB2      MET  20  35.237   7.265   2.379
  145    HB3  MET  20           HB3      MET  20  36.075   7.976   1.009
  146    HG2  MET  20           HG2      MET  20  37.135   8.843   2.900
  147    HG3  MET  20           HG3      MET  20  36.076  10.137   2.342
  148    HE1  MET  20           HE1      MET  20  33.776  10.849   5.162
  149    HE2  MET  20           HE2      MET  20  33.552  10.475   3.454
  150    HE3  MET  20           HE3      MET  20  34.887  11.510   3.962
  151    H    GLY  21           H        GLY  21  34.020   8.237  -1.180
  152    HA2  GLY  21           HA2      GLY  21  33.488   9.945  -2.840
  153    HA3  GLY  21           HA3      GLY  21  34.419  11.078  -1.872
  154    H    PHE  22           H        PHE  22  35.884   7.939  -2.219
  155    HA   PHE  22           HA       PHE  22  37.373   8.860  -4.548
  156    HD1  PHE  22           HD2      PHE  22  39.064   6.159  -1.612
  157    HD2  PHE  22           HD1      PHE  22  38.090  10.240  -0.914
  158    HE1  PHE  22           HE2      PHE  22  38.926   5.708   0.801
  159    HE2  PHE  22           HE1      PHE  22  37.954   9.799   1.503
  160    HZ   PHE  22           HZ       PHE  22  38.369   7.529   2.364
  161    HB2  PHE  22           HB2      PHE  22  39.458   7.867  -3.299
  162    HB3  PHE  22           HB3      PHE  22  38.965   9.537  -3.026
  163    H    SER  23           H        SER  23  39.118   6.884  -4.925
  164    HA   SER  23           HA       SER  23  37.816   4.346  -4.462
  165    HG   SER  23           HG       SER  23  35.673   4.819  -6.491
  166    HB2  SER  23           HB2      SER  23  38.236   5.279  -7.306
  167    HB3  SER  23           HB3      SER  23  37.476   3.779  -6.781
  168    H    ASP  24           H        ASP  24  39.232   3.219  -6.840
  169    HA   ASP  24           HA       ASP  24  41.748   2.685  -5.531
  170    HB2  ASP  24           HB2      ASP  24  40.748   0.823  -6.646
  171    HB3  ASP  24           HB3      ASP  24  40.547   1.742  -8.140
  172    H    GLU  25           H        GLU  25  43.415   4.043  -5.677
  173    HA   GLU  25           HA       GLU  25  43.615   5.713  -8.094
  174    HB2  GLU  25           HB2      GLU  25  43.409   6.789  -5.828
  175    HB3  GLU  25           HB3      GLU  25  45.009   6.161  -5.459
  176    HG2  GLU  25           HG2      GLU  25  45.274   7.459  -7.914
  177    HG3  GLU  25           HG3      GLU  25  44.254   8.510  -6.932
  178    H    GLY  26           H        GLY  26  44.575   3.397  -8.859
  179    HA2  GLY  26           HA2      GLY  26  46.973   3.659  -9.896
  180    HA3  GLY  26           HA3      GLY  26  47.426   3.289  -8.237
  181    H    GLY  27           H        GLY  27  44.696   1.603  -8.516
  182    HA2  GLY  27           HA2      GLY  27  44.151  -0.554  -9.216
  183    HA3  GLY  27           HA3      GLY  27  45.662  -0.612 -10.120
  184    H    TRP  28           H        TRP  28  45.737   0.433  -6.888
  185    HA   TRP  28           HA       TRP  28  47.242  -1.925  -6.089
  186    HD1  TRP  28           HD1      TRP  28  47.612   2.542  -6.298
  187    HE1  TRP  28           HE1      TRP  28  45.920   4.230  -5.352
  188    HE3  TRP  28           HE3      TRP  28  45.409  -0.391  -2.782
  189    HZ2  TRP  28           HZ2      TRP  28  43.909   4.308  -3.364
  190    HZ3  TRP  28           HZ3      TRP  28  43.618   0.538  -1.390
  191    HH2  TRP  28           HH2      TRP  28  42.874   2.832  -1.676
  192    HB2  TRP  28           HB2      TRP  28  47.785  -0.454  -4.086
  193    HB3  TRP  28           HB3      TRP  28  48.357   0.148  -5.646
  194    H    LEU  29           H        LEU  29  44.286  -0.164  -5.377
  195    HA   LEU  29           HA       LEU  29  43.546  -1.027  -2.919
  196    HG   LEU  29           HG       LEU  29  41.109  -1.605  -2.618
  197    HB2  LEU  29           HB2      LEU  29  42.156   0.404  -4.352
  198    HB3  LEU  29           HB3      LEU  29  41.726  -0.986  -5.325
  199   HD11  LEU  29          HD11      LEU  29  39.284   0.530  -3.045
  200   HD12  LEU  29          HD12      LEU  29  40.923   1.176  -3.109
  201   HD13  LEU  29          HD13      LEU  29  40.386   0.273  -1.693
  202   HD21  LEU  29          HD21      LEU  29  40.074  -2.180  -4.993
  203   HD22  LEU  29          HD22      LEU  29  38.994  -0.855  -4.556
  204   HD23  LEU  29          HD23      LEU  29  39.125  -2.269  -3.509
  205    H    THR  30           H        THR  30  42.549  -2.874  -5.806
  206    HA   THR  30           HA       THR  30  41.682  -5.161  -4.671
  207    HB   THR  30           HB       THR  30  41.610  -5.341  -6.949
  208    HG1  THR  30           HG1      THR  30  44.126  -6.567  -6.782
  209   HG21  THR  30          HG21      THR  30  44.233  -3.958  -6.927
  210   HG22  THR  30          HG22      THR  30  42.778  -3.618  -7.862
  211   HG23  THR  30          HG23      THR  30  43.822  -4.963  -8.317
  212    H    ARG  31           H        ARG  31  44.954  -3.995  -4.713
  213    HA   ARG  31           HA       ARG  31  46.023  -6.463  -3.588
  214    HE   ARG  31           HE       ARG  31  48.775  -6.554  -5.799
  215    HB2  ARG  31           HB2      ARG  31  47.735  -4.065  -3.858
  216    HB3  ARG  31           HB3      ARG  31  48.070  -5.735  -4.276
  217    HG2  ARG  31           HG2      ARG  31  46.422  -5.366  -6.212
  218    HG3  ARG  31           HG3      ARG  31  46.650  -3.652  -5.877
  219    HD2  ARG  31           HD2      ARG  31  48.160  -4.476  -7.640
  220    HD3  ARG  31           HD3      ARG  31  49.033  -3.859  -6.238
  221   HH11  ARG  31          HH11      ARG  31  50.146  -4.549  -8.297
  222   HH12  ARG  31          HH12      ARG  31  51.367  -5.698  -8.729
  223   HH21  ARG  31          HH21      ARG  31  50.379  -8.072  -6.357
  224   HH22  ARG  31          HH22      ARG  31  51.500  -7.703  -7.625
  225    H    LEU  32           H        LEU  32  46.088  -2.980  -2.773
  226    HA   LEU  32           HA       LEU  32  47.179  -3.048  -0.274
  227    HG   LEU  32           HG       LEU  32  45.705   0.444   0.183
  228    HB2  LEU  32           HB2      LEU  32  46.580  -1.042  -1.548
  229    HB3  LEU  32           HB3      LEU  32  44.882  -1.332  -1.215
  230   HD11  LEU  32          HD11      LEU  32  44.905  -0.277   2.254
  231   HD12  LEU  32          HD12      LEU  32  45.446  -1.934   1.989
  232   HD13  LEU  32          HD13      LEU  32  44.082  -1.293   1.071
  233   HD21  LEU  32          HD21      LEU  32  47.485   0.113   1.800
  234   HD22  LEU  32          HD22      LEU  32  48.064  -0.158   0.156
  235   HD23  LEU  32          HD23      LEU  32  47.730  -1.532   1.213
  236    H    LEU  33           H        LEU  33  43.657  -2.724  -0.632
  237    HA   LEU  33           HA       LEU  33  42.955  -3.341   1.955
  238    HG   LEU  33           HG       LEU  33  40.908  -2.296   2.096
  239    HB2  LEU  33           HB2      LEU  33  41.587  -3.340  -0.648
  240    HB3  LEU  33           HB3      LEU  33  40.834  -4.352   0.575
  241   HD11  LEU  33          HD11      LEU  33  40.725  -0.207   0.456
  242   HD12  LEU  33          HD12      LEU  33  41.884  -1.170  -0.461
  243   HD13  LEU  33          HD13      LEU  33  42.246  -0.701   1.200
  244   HD21  LEU  33          HD21      LEU  33  39.142  -1.668  -0.187
  245   HD22  LEU  33          HD22      LEU  33  38.766  -1.851   1.526
  246   HD23  LEU  33          HD23      LEU  33  38.986  -3.279   0.514
  247    H    GLN  34           H        GLN  34  42.500  -5.641  -0.704
  248    HA   GLN  34           HA       GLN  34  41.856  -7.909   0.497
  249    HB2  GLN  34           HB2      GLN  34  43.361  -7.229  -1.865
  250    HB3  GLN  34           HB3      GLN  34  43.833  -8.801  -1.236
  251    HG2  GLN  34           HG2      GLN  34  42.130  -9.449  -2.583
  252    HG3  GLN  34           HG3      GLN  34  41.214  -9.133  -1.110
  253   HE21  GLN  34          HE21      GLN  34  39.800  -7.436  -1.037
  254   HE22  GLN  34          HE22      GLN  34  39.378  -6.492  -2.421
  255    H    THR  35           H        THR  35  45.001  -6.447   0.884
  256    HA   THR  35           HA       THR  35  46.167  -8.834   2.049
  257    HB   THR  35           HB       THR  35  47.139  -5.987   1.797
  258    HG1  THR  35           HG1      THR  35  47.270  -8.142   0.251
  259   HG21  THR  35          HG21      THR  35  48.470  -6.365   3.547
  260   HG22  THR  35          HG22      THR  35  49.363  -7.401   2.435
  261   HG23  THR  35          HG23      THR  35  48.171  -8.101   3.529
  262    H    LYS  36           H        LYS  36  45.717  -5.576   3.329
  263    HA   LYS  36           HA       LYS  36  45.743  -6.441   6.050
  264    HB2  LYS  36           HB2      LYS  36  44.965  -3.786   4.841
  265    HB3  LYS  36           HB3      LYS  36  45.167  -4.080   6.562
  266    HG2  LYS  36           HG2      LYS  36  47.282  -3.466   6.299
  267    HG3  LYS  36           HG3      LYS  36  47.529  -4.995   5.451
  268    HD2  LYS  36           HD2      LYS  36  47.039  -3.929   3.328
  269    HD3  LYS  36           HD3      LYS  36  46.685  -2.407   4.149
  270    HE2  LYS  36           HE2      LYS  36  49.321  -3.583   4.730
  271    HE3  LYS  36           HE3      LYS  36  49.086  -3.031   3.072
  272    HZ1  LYS  36           HZ1      LYS  36  50.001  -1.317   4.580
  273    HZ2  LYS  36           HZ2      LYS  36  48.563  -1.359   5.469
  274    HZ3  LYS  36           HZ3      LYS  36  48.544  -0.856   3.853
  275    H    ASN  37           H        ASN  37  43.682  -7.841   4.674
  276    HA   ASN  37           HA       ASN  37  41.462  -8.353   4.736
  277    HB2  ASN  37           HB2      ASN  37  40.483  -8.353   6.942
  278    HB3  ASN  37           HB3      ASN  37  42.196  -8.745   7.100
  279   HD21  ASN  37          HD21      ASN  37  43.586  -7.262   8.037
  280   HD22  ASN  37          HD22      ASN  37  43.015  -5.921   8.964
  281    H    TYR  38           H        TYR  38  41.760  -6.180   3.280
  282    HA   TYR  38           HA       TYR  38  40.750  -4.312   2.466
  283    HD1  TYR  38           HD1      TYR  38  40.618  -6.543   1.845
  284    HD2  TYR  38           HD2      TYR  38  36.557  -6.410   3.112
  285    HE1  TYR  38           HE1      TYR  38  40.221  -8.731   0.796
  286    HE2  TYR  38           HE2      TYR  38  36.153  -8.597   2.064
  287    HH   TYR  38           HH       TYR  38  37.108 -10.376   1.087
  288    HB2  TYR  38           HB2      TYR  38  38.359  -4.980   4.165
  289    HB3  TYR  38           HB3      TYR  38  38.399  -4.220   2.579
  290    H    ASP  39           H        ASP  39  42.418  -3.300   4.015
  291    HA   ASP  39           HA       ASP  39  41.049  -1.845   6.170
  292    HB2  ASP  39           HB2      ASP  39  42.966  -1.939   7.370
  293    HB3  ASP  39           HB3      ASP  39  43.396  -3.227   6.248
  294    H    ILE  40           H        ILE  40  40.298   0.120   5.609
  295    HA   ILE  40           HA       ILE  40  41.377   1.541   3.377
  296    HB   ILE  40           HB       ILE  40  39.776   3.298   3.945
  297   HG12  ILE  40          HG12      ILE  40  40.048   2.412   6.535
  298   HG13  ILE  40          HG13      ILE  40  38.832   3.551   5.974
  299   HG21  ILE  40          HG21      ILE  40  37.675   1.728   3.972
  300   HG22  ILE  40          HG22      ILE  40  38.885   0.465   3.747
  301   HG23  ILE  40          HG23      ILE  40  38.752   1.778   2.576
  302   HD11  ILE  40          HD11      ILE  40  37.722   1.919   7.270
  303   HD12  ILE  40          HD12      ILE  40  38.524   0.597   6.419
  304   HD13  ILE  40          HD13      ILE  40  37.324   1.584   5.583
  305    H    GLY  41           H        GLY  41  41.835   1.360   6.757
  306    HA2  GLY  41           HA2      GLY  41  42.712   3.714   7.607
  307    HA3  GLY  41           HA3      GLY  41  43.566   2.239   8.002
  308    H    ALA  42           H        ALA  42  44.560   1.530   5.610
  309    HA   ALA  42           HA       ALA  42  46.598   3.568   5.160
  310    HB1  ALA  42           HB1      ALA  42  47.692   1.586   5.610
  311    HB2  ALA  42           HB2      ALA  42  47.654   1.572   3.847
  312    HB3  ALA  42           HB3      ALA  42  46.490   0.611   4.762
  313    H    ALA  43           H        ALA  43  44.009   1.925   3.592
  314    HA   ALA  43           HA       ALA  43  44.619   2.353   0.909
  315    HB1  ALA  43           HB1      ALA  43  41.804   2.648   1.876
  316    HB2  ALA  43           HB2      ALA  43  42.625   1.092   2.016
  317    HB3  ALA  43           HB3      ALA  43  42.415   1.841   0.432
  318    H    LEU  44           H        LEU  44  43.226   4.484   3.324
  319    HA   LEU  44           HA       LEU  44  42.476   6.597   1.623
  320    HG   LEU  44           HG       LEU  44  40.769   7.746   3.183
  321    HB2  LEU  44           HB2      LEU  44  43.056   6.306   4.526
  322    HB3  LEU  44           HB3      LEU  44  43.058   7.934   3.862
  323   HD11  LEU  44          HD11      LEU  44  39.491   5.645   3.709
  324   HD12  LEU  44          HD12      LEU  44  41.046   4.852   3.957
  325   HD13  LEU  44          HD13      LEU  44  40.640   5.522   2.376
  326   HD21  LEU  44          HD21      LEU  44  40.568   6.453   5.838
  327   HD22  LEU  44          HD22      LEU  44  39.838   7.943   5.241
  328   HD23  LEU  44          HD23      LEU  44  41.532   7.926   5.731
  329    H    ASP  45           H        ASP  45  45.350   6.332   3.709
  330    HA   ASP  45           HA       ASP  45  46.777   8.498   2.917
  331    HB2  ASP  45           HB2      ASP  45  47.791   7.227   4.587
  332    HB3  ASP  45           HB3      ASP  45  47.637   5.727   3.678
  333    H    THR  46           H        THR  46  46.103   5.670   1.024
  334    HA   THR  46           HA       THR  46  48.036   6.443  -1.021
  335    HB   THR  46           HB       THR  46  47.535   4.317  -2.076
  336    HG1  THR  46           HG1      THR  46  45.278   4.311  -1.472
  337   HG21  THR  46          HG21      THR  46  47.743   3.822   0.878
  338   HG22  THR  46          HG22      THR  46  49.096   4.324  -0.136
  339   HG23  THR  46          HG23      THR  46  48.294   2.781  -0.434
  340    H    ILE  47           H        ILE  47  44.513   5.952  -0.717
  341    HA   ILE  47           HA       ILE  47  43.910   6.529  -3.399
  342    HB   ILE  47           HB       ILE  47  41.611   6.935  -2.694
  343   HG12  ILE  47          HG12      ILE  47  41.368   6.448  -0.055
  344   HG13  ILE  47          HG13      ILE  47  42.920   7.277  -0.053
  345   HG21  ILE  47          HG21      ILE  47  42.015   4.670  -2.954
  346   HG22  ILE  47          HG22      ILE  47  41.375   4.749  -1.310
  347   HG23  ILE  47          HG23      ILE  47  43.112   4.618  -1.575
  348   HD11  ILE  47          HD11      ILE  47  41.954   9.251  -0.324
  349   HD12  ILE  47          HD12      ILE  47  40.421   8.442  -0.004
  350   HD13  ILE  47          HD13      ILE  47  40.968   8.668  -1.665
  351    H    GLN  48           H        GLN  48  44.318   8.679  -0.621
  352    HA   GLN  48           HA       GLN  48  44.961  10.878  -2.227
  353    HB2  GLN  48           HB2      GLN  48  42.102  10.473  -1.736
  354    HB3  GLN  48           HB3      GLN  48  42.674  12.070  -1.275
  355    HG2  GLN  48           HG2      GLN  48  42.867  12.727  -3.391
  356    HG3  GLN  48           HG3      GLN  48  43.673  11.235  -3.870
  357   HE21  GLN  48          HE21      GLN  48  41.756   9.372  -3.284
  358   HE22  GLN  48          HE22      GLN  48  40.379   9.611  -4.310
  359    H    TYR  49           H        TYR  49  45.916   9.642   0.173
  360    HA   TYR  49           HA       TYR  49  45.927  12.001   1.883
  361    HD1  TYR  49           HD1      TYR  49  45.262  12.401   4.659
  362    HD2  TYR  49           HD2      TYR  49  42.640  10.002   2.320
  363    HE1  TYR  49           HE1      TYR  49  43.355  13.755   5.418
  364    HE2  TYR  49           HE2      TYR  49  40.726  11.349   3.071
  365    HH   TYR  49           HH       TYR  49  40.066  13.125   4.238
  366    HB2  TYR  49           HB2      TYR  49  44.880   9.324   2.631
  367    HB3  TYR  49           HB3      TYR  49  45.916  10.122   3.814
  368    H    SER  50           H        SER  50  47.773  10.659  -0.004
  369    HA   SER  50           HA       SER  50  49.886   9.680   1.763
  370    HG   SER  50           HG       SER  50  49.426   9.909  -2.112
  371    HB2  SER  50           HB2      SER  50  50.979   9.599  -0.735
  372    HB3  SER  50           HB3      SER  50  50.055   8.281  -0.016
  373    H    LYS  51           H        LYS  51  48.991  12.523   1.613
  374    HA   LYS  51           HA       LYS  51  51.642  13.693   1.319
  375    HB2  LYS  51           HB2      LYS  51  50.982  15.441  -0.148
  376    HB3  LYS  51           HB3      LYS  51  50.418  13.944  -0.879
  377    HG2  LYS  51           HG2      LYS  51  48.412  15.089   0.853
  378    HG3  LYS  51           HG3      LYS  51  48.926  16.230  -0.390
  379    HD2  LYS  51           HD2      LYS  51  48.576  13.592  -1.500
  380    HD3  LYS  51           HD3      LYS  51  47.112  14.120  -0.668
  381    HE2  LYS  51           HE2      LYS  51  47.433  16.325  -1.956
  382    HE3  LYS  51           HE3      LYS  51  48.538  15.405  -2.974
  383    HZ1  LYS  51           HZ1      LYS  51  46.754  14.789  -4.114
  384    HZ2  LYS  51           HZ2      LYS  51  45.690  15.418  -2.960
  385    HZ3  LYS  51           HZ3      LYS  51  46.292  13.847  -2.787
  386    H    HIS  52           H        HIS  52  49.705  13.075   3.490
  387    HA   HIS  52           HA       HIS  52  49.148  14.005   5.494
  388    HD1  HIS  52           HD1      HIS  52  52.740  16.672   6.338
  389    HD2  HIS  52           HD2      HIS  52  51.664  13.291   4.177
  390    HE1  HIS  52           HE1      HIS  52  54.832  15.265   6.129
  391    HB2  HIS  52           HB2      HIS  52  50.348  16.585   4.483
  392    HB3  HIS  52           HB3      HIS  52  50.077  16.116   6.158
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  26.825 -16.873   6.231
    2    H2   GLY   1           2H       GLY   1  27.233 -16.522   4.628
    3    H3   GLY   1           3H       GLY   1  25.861 -17.451   4.966
    4    HA2  GLY   1           HA2      GLY   1  24.772 -15.521   4.688
    5    HA3  GLY   1           HA3      GLY   1  25.256 -15.282   6.359
    6    H    SER   2           H        SER   2  26.951 -15.040   3.232
    7    HA   SER   2           HA       SER   2  27.711 -12.295   3.985
    8    HG   SER   2           HG       SER   2  28.958 -15.395   3.519
    9    HB2  SER   2           HB2      SER   2  29.537 -13.623   2.123
   10    HB3  SER   2           HB3      SER   2  29.891 -12.714   3.592
   11    HA   PRO   3           HA       PRO   3  25.411 -11.784   0.093
   12    HB2  PRO   3           HB2      PRO   3  24.781  -9.188   0.533
   13    HB3  PRO   3           HB3      PRO   3  23.882 -10.524   1.264
   14    HG2  PRO   3           HG2      PRO   3  26.032  -8.810   2.455
   15    HG3  PRO   3           HG3      PRO   3  24.502  -9.346   3.176
   16    HD2  PRO   3           HD2      PRO   3  26.870 -10.545   3.719
   17    HD3  PRO   3           HD3      PRO   3  25.332 -11.430   3.700
   18    HA   PRO   4           HA       PRO   4  29.012 -10.085  -1.964
   19    HB2  PRO   4           HB2      PRO   4  28.071 -10.366  -4.495
   20    HB3  PRO   4           HB3      PRO   4  28.706 -11.718  -3.551
   21    HG2  PRO   4           HG2      PRO   4  25.863 -10.911  -4.026
   22    HG3  PRO   4           HG3      PRO   4  26.585 -12.531  -4.043
   23    HD2  PRO   4           HD2      PRO   4  25.195 -11.576  -1.923
   24    HD3  PRO   4           HD3      PRO   4  26.551 -12.708  -1.746
   25    H    GLU   5           H        GLU   5  28.023  -8.046  -0.858
   26    HA   GLU   5           HA       GLU   5  28.071  -5.946  -2.701
   27    HB2  GLU   5           HB2      GLU   5  25.737  -7.003  -3.097
   28    HB3  GLU   5           HB3      GLU   5  25.303  -6.239  -1.575
   29    HG2  GLU   5           HG2      GLU   5  26.623  -4.514  -3.569
   30    HG3  GLU   5           HG3      GLU   5  24.999  -5.074  -3.964
   31    H    ALA   6           H        ALA   6  29.082  -6.766  -0.131
   32    HA   ALA   6           HA       ALA   6  29.720  -4.653   1.247
   33    HB1  ALA   6           HB1      ALA   6  27.846  -4.345   3.005
   34    HB2  ALA   6           HB2      ALA   6  26.804  -5.066   1.779
   35    HB3  ALA   6           HB3      ALA   6  27.674  -3.573   1.428
   36    H    ASP   7           H        ASP   7  31.097  -6.569   1.572
   37    HA   ASP   7           HA       ASP   7  30.241  -8.201   3.864
   38    HB2  ASP   7           HB2      ASP   7  32.092  -8.683   1.569
   39    HB3  ASP   7           HB3      ASP   7  32.434  -9.489   3.098
   40    HA   PRO   8           HA       PRO   8  32.925  -6.344   6.810
   41    HB2  PRO   8           HB2      PRO   8  34.243  -9.024   6.999
   42    HB3  PRO   8           HB3      PRO   8  33.669  -7.960   8.288
   43    HG2  PRO   8           HG2      PRO   8  32.252 -10.095   7.562
   44    HG3  PRO   8           HG3      PRO   8  31.453  -8.571   7.991
   45    HD2  PRO   8           HD2      PRO   8  31.845  -9.818   5.322
   46    HD3  PRO   8           HD3      PRO   8  30.535  -8.769   5.900
   47    H    ARG   9           H        ARG   9  34.148  -7.994   4.047
   48    HA   ARG   9           HA       ARG   9  36.878  -7.114   4.412
   49    HE   ARG   9           HE       ARG   9  35.077 -11.429   1.372
   50    HB2  ARG   9           HB2      ARG   9  35.549  -8.531   2.093
   51    HB3  ARG   9           HB3      ARG   9  37.284  -8.266   2.279
   52    HG2  ARG   9           HG2      ARG   9  37.321  -9.667   4.251
   53    HG3  ARG   9           HG3      ARG   9  35.570  -9.869   4.170
   54    HD2  ARG   9           HD2      ARG   9  37.156 -10.596   1.770
   55    HD3  ARG   9           HD3      ARG   9  37.261 -11.661   3.171
   56   HH11  ARG   9          HH11      ARG   9  35.860 -11.984   4.722
   57   HH12  ARG   9          HH12      ARG   9  34.416 -12.885   5.045
   58   HH21  ARG   9          HH21      ARG   9  33.173 -12.613   1.786
   59   HH22  ARG   9          HH22      ARG   9  32.886 -13.241   3.375
   60    H    LEU  10           H        LEU  10  34.399  -6.623   1.866
   61    HA   LEU  10           HA       LEU  10  35.818  -4.229   0.999
   62    HG   LEU  10           HG       LEU  10  34.780  -7.151  -1.075
   63    HB2  LEU  10           HB2      LEU  10  33.431  -5.575  -0.260
   64    HB3  LEU  10           HB3      LEU  10  34.401  -4.299  -0.968
   65   HD11  LEU  10          HD11      LEU  10  35.489  -6.581  -3.101
   66   HD12  LEU  10          HD12      LEU  10  36.744  -5.533  -2.443
   67   HD13  LEU  10          HD13      LEU  10  35.111  -4.913  -2.676
   68   HD21  LEU  10          HD21      LEU  10  37.351  -6.882  -0.822
   69   HD22  LEU  10          HD22      LEU  10  36.363  -7.175   0.609
   70   HD23  LEU  10          HD23      LEU  10  36.929  -5.545   0.246
   71    H    ILE  11           H        ILE  11  33.293  -5.047   3.017
   72    HA   ILE  11           HA       ILE  11  31.611  -2.776   2.481
   73    HB   ILE  11           HB       ILE  11  30.867  -4.993   3.539
   74   HG12  ILE  11          HG12      ILE  11  30.111  -2.292   4.647
   75   HG13  ILE  11          HG13      ILE  11  29.298  -3.213   3.386
   76   HG21  ILE  11          HG21      ILE  11  32.772  -4.742   5.286
   77   HG22  ILE  11          HG22      ILE  11  31.219  -5.411   5.783
   78   HG23  ILE  11          HG23      ILE  11  31.609  -3.730   6.142
   79   HD11  ILE  11          HD11      ILE  11  28.062  -4.326   4.860
   80   HD12  ILE  11          HD12      ILE  11  28.572  -3.103   6.022
   81   HD13  ILE  11          HD13      ILE  11  29.438  -4.635   5.918
   82    H    GLU  12           H        GLU  12  34.255  -3.574   4.601
   83    HA   GLU  12           HA       GLU  12  33.966  -1.139   6.141
   84    HB2  GLU  12           HB2      GLU  12  34.710  -3.239   7.212
   85    HB3  GLU  12           HB3      GLU  12  36.138  -3.242   6.188
   86    HG2  GLU  12           HG2      GLU  12  37.032  -1.342   7.252
   87    HG3  GLU  12           HG3      GLU  12  35.503  -0.982   8.054
   88    H    SER  13           H        SER  13  36.634  -2.569   4.239
   89    HA   SER  13           HA       SER  13  37.888  -0.005   3.982
   90    HG   SER  13           HG       SER  13  39.507  -0.954   4.934
   91    HB2  SER  13           HB2      SER  13  38.619  -2.781   3.502
   92    HB3  SER  13           HB3      SER  13  39.224  -1.696   2.249
   93    H    LEU  14           H        LEU  14  36.109  -2.140   1.718
   94    HA   LEU  14           HA       LEU  14  36.713  -0.434  -0.502
   95    HG   LEU  14           HG       LEU  14  36.266  -1.128  -2.477
   96    HB2  LEU  14           HB2      LEU  14  35.694  -2.967  -0.317
   97    HB3  LEU  14           HB3      LEU  14  34.271  -2.038  -0.748
   98   HD11  LEU  14          HD11      LEU  14  37.740  -2.757  -2.752
   99   HD12  LEU  14          HD12      LEU  14  36.433  -3.777  -3.352
  100   HD13  LEU  14          HD13      LEU  14  36.862  -3.809  -1.641
  101   HD21  LEU  14          HD21      LEU  14  34.486  -3.217  -3.502
  102   HD22  LEU  14          HD22      LEU  14  34.683  -1.540  -4.008
  103   HD23  LEU  14          HD23      LEU  14  33.675  -1.927  -2.613
  104    H    SER  15           H        SER  15  33.516  -1.144   0.942
  105    HA   SER  15           HA       SER  15  32.042   0.864  -0.059
  106    HG   SER  15           HG       SER  15  29.662  -0.204   1.915
  107    HB2  SER  15           HB2      SER  15  31.712  -0.837   2.056
  108    HB3  SER  15           HB3      SER  15  31.753   0.726   2.872
  109    H    GLN  16           H        GLN  16  33.617   1.364   3.101
  110    HA   GLN  16           HA       GLN  16  33.345   4.006   3.412
  111    HB2  GLN  16           HB2      GLN  16  35.002   3.926   4.976
  112    HB3  GLN  16           HB3      GLN  16  34.770   2.203   4.740
  113    HG2  GLN  16           HG2      GLN  16  37.083   2.507   4.724
  114    HG3  GLN  16           HG3      GLN  16  36.642   2.344   3.025
  115   HE21  GLN  16          HE21      GLN  16  37.862   3.626   1.850
  116   HE22  GLN  16          HE22      GLN  16  38.285   5.259   2.216
  117    H    MET  17           H        MET  17  35.584   2.489   1.148
  118    HA   MET  17           HA       MET  17  36.762   5.031   0.429
  119    HB2  MET  17           HB2      MET  17  38.381   3.833  -0.614
  120    HB3  MET  17           HB3      MET  17  37.749   2.522   0.369
  121    HG2  MET  17           HG2      MET  17  37.824   1.509  -1.666
  122    HG3  MET  17           HG3      MET  17  36.181   2.145  -1.699
  123    HE1  MET  17           HE1      MET  17  39.740   2.533  -3.908
  124    HE2  MET  17           HE2      MET  17  39.742   2.974  -2.201
  125    HE3  MET  17           HE3      MET  17  39.794   4.232  -3.436
  126    H    LEU  18           H        LEU  18  34.230   2.951  -0.694
  127    HA   LEU  18           HA       LEU  18  34.038   4.069  -3.317
  128    HG   LEU  18           HG       LEU  18  31.700   1.483  -4.192
  129    HB2  LEU  18           HB2      LEU  18  33.049   1.835  -2.023
  130    HB3  LEU  18           HB3      LEU  18  31.621   2.814  -2.303
  131   HD11  LEU  18          HD11      LEU  18  31.654   3.950  -4.694
  132   HD12  LEU  18          HD12      LEU  18  32.169   2.912  -6.024
  133   HD13  LEU  18          HD13      LEU  18  33.365   3.818  -5.098
  134   HD21  LEU  18          HD21      LEU  18  34.577   1.942  -4.792
  135   HD22  LEU  18          HD22      LEU  18  33.552   0.554  -5.158
  136   HD23  LEU  18          HD23      LEU  18  34.156   0.797  -3.519
  137    H    SER  19           H        SER  19  31.561   4.115  -0.731
  138    HA   SER  19           HA       SER  19  30.194   6.299  -1.883
  139    HG   SER  19           HG       SER  19  27.781   4.643  -0.495
  140    HB2  SER  19           HB2      SER  19  29.763   4.426   0.232
  141    HB3  SER  19           HB3      SER  19  29.423   6.052   0.828
  142    H    MET  20           H        MET  20  33.099   6.555  -0.561
  143    HA   MET  20           HA       MET  20  32.501   8.984   0.975
  144    HB2  MET  20           HB2      MET  20  34.861   7.148   0.859
  145    HB3  MET  20           HB3      MET  20  35.101   8.820   1.343
  146    HG2  MET  20           HG2      MET  20  33.167   6.933   2.664
  147    HG3  MET  20           HG3      MET  20  34.803   7.253   3.235
  148    HE1  MET  20           HE1      MET  20  35.452  10.207   3.850
  149    HE2  MET  20           HE2      MET  20  35.397   8.713   4.785
  150    HE3  MET  20           HE3      MET  20  34.572  10.156   5.378
  151    H    GLY  21           H        GLY  21  32.741   8.299  -2.096
  152    HA2  GLY  21           HA2      GLY  21  33.257   9.534  -3.965
  153    HA3  GLY  21           HA3      GLY  21  33.562  10.896  -2.887
  154    H    PHE  22           H        PHE  22  35.161   7.746  -2.887
  155    HA   PHE  22           HA       PHE  22  37.608   8.996  -3.890
  156    HD1  PHE  22           HD1      PHE  22  38.555  10.445  -3.126
  157    HD2  PHE  22           HD2      PHE  22  37.649   8.734   0.665
  158    HE1  PHE  22           HE1      PHE  22  38.901  12.636  -2.059
  159    HE2  PHE  22           HE2      PHE  22  37.994  10.922   1.740
  160    HZ   PHE  22           HZ       PHE  22  38.620  12.876   0.376
  161    HB2  PHE  22           HB2      PHE  22  37.268   7.499  -1.290
  162    HB3  PHE  22           HB3      PHE  22  38.835   7.638  -2.086
  163    H    SER  23           H        SER  23  39.008   7.535  -4.925
  164    HA   SER  23           HA       SER  23  38.008   4.805  -5.177
  165    HG   SER  23           HG       SER  23  36.282   5.511  -6.392
  166    HB2  SER  23           HB2      SER  23  38.593   6.644  -7.505
  167    HB3  SER  23           HB3      SER  23  38.324   4.908  -7.655
  168    H    ASP  24           H        ASP  24  39.579   3.506  -6.627
  169    HA   ASP  24           HA       ASP  24  42.072   3.387  -5.338
  170    HB2  ASP  24           HB2      ASP  24  42.673   1.710  -6.972
  171    HB3  ASP  24           HB3      ASP  24  40.973   1.491  -6.554
  172    H    GLU  25           H        GLU  25  43.858   4.614  -5.584
  173    HA   GLU  25           HA       GLU  25  43.945   6.793  -7.314
  174    HB2  GLU  25           HB2      GLU  25  45.349   6.778  -5.374
  175    HB3  GLU  25           HB3      GLU  25  46.192   5.346  -5.939
  176    HG2  GLU  25           HG2      GLU  25  46.612   7.042  -8.008
  177    HG3  GLU  25           HG3      GLU  25  46.578   8.157  -6.642
  178    H    GLY  26           H        GLY  26  46.454   4.377  -7.575
  179    HA2  GLY  26           HA2      GLY  26  46.133   4.503 -10.503
  180    HA3  GLY  26           HA3      GLY  26  47.664   4.254  -9.673
  181    H    GLY  27           H        GLY  27  44.622   2.641  -8.889
  182    HA2  GLY  27           HA2      GLY  27  43.947   0.455  -9.300
  183    HA3  GLY  27           HA3      GLY  27  45.387   0.222 -10.279
  184    H    TRP  28           H        TRP  28  45.340   1.379  -6.973
  185    HA   TRP  28           HA       TRP  28  46.977  -0.916  -6.199
  186    HD1  TRP  28           HD1      TRP  28  46.892   3.699  -5.651
  187    HE1  TRP  28           HE1      TRP  28  45.154   4.951  -4.216
  188    HE3  TRP  28           HE3      TRP  28  45.275  -0.177  -2.788
  189    HZ2  TRP  28           HZ2      TRP  28  43.331   4.327  -2.125
  190    HZ3  TRP  28           HZ3      TRP  28  43.549   0.222  -1.096
  191    HH2  TRP  28           HH2      TRP  28  42.594   2.429  -0.794
  192    HB2  TRP  28           HB2      TRP  28  47.605   0.386  -4.232
  193    HB3  TRP  28           HB3      TRP  28  47.863   1.334  -5.698
  194    H    LEU  29           H        LEU  29  43.891   0.627  -5.520
  195    HA   LEU  29           HA       LEU  29  43.079  -0.381  -3.165
  196    HG   LEU  29           HG       LEU  29  40.566  -1.899  -4.128
  197    HB2  LEU  29           HB2      LEU  29  41.535   0.912  -4.279
  198    HB3  LEU  29           HB3      LEU  29  41.621  -0.047  -5.739
  199   HD11  LEU  29          HD11      LEU  29  40.702  -0.350  -2.176
  200   HD12  LEU  29          HD12      LEU  29  39.080  -0.961  -2.502
  201   HD13  LEU  29          HD13      LEU  29  39.516   0.683  -2.976
  202   HD21  LEU  29          HD21      LEU  29  38.344  -0.315  -4.770
  203   HD22  LEU  29          HD22      LEU  29  39.026  -1.640  -5.712
  204   HD23  LEU  29          HD23      LEU  29  39.548   0.016  -6.014
  205    H    THR  30           H        THR  30  42.326  -2.261  -6.077
  206    HA   THR  30           HA       THR  30  41.678  -4.612  -4.872
  207    HB   THR  30           HB       THR  30  43.224  -4.185  -7.431
  208    HG1  THR  30           HG1      THR  30  40.537  -4.303  -6.711
  209   HG21  THR  30          HG21      THR  30  43.634  -6.380  -7.395
  210   HG22  THR  30          HG22      THR  30  41.927  -6.522  -7.818
  211   HG23  THR  30          HG23      THR  30  42.437  -6.691  -6.138
  212    H    ARG  31           H        ARG  31  44.846  -3.193  -5.078
  213    HA   ARG  31           HA       ARG  31  46.145  -5.663  -4.207
  214    HE   ARG  31           HE       ARG  31  50.031  -4.170  -6.577
  215    HB2  ARG  31           HB2      ARG  31  47.745  -3.197  -4.461
  216    HB3  ARG  31           HB3      ARG  31  48.080  -4.823  -5.034
  217    HG2  ARG  31           HG2      ARG  31  46.305  -4.392  -6.807
  218    HG3  ARG  31           HG3      ARG  31  46.413  -2.697  -6.330
  219    HD2  ARG  31           HD2      ARG  31  47.869  -3.548  -8.291
  220    HD3  ARG  31           HD3      ARG  31  48.589  -2.487  -7.081
  221   HH11  ARG  31          HH11      ARG  31  47.182  -5.573  -8.009
  222   HH12  ARG  31          HH12      ARG  31  47.813  -7.186  -7.997
  223   HH21  ARG  31          HH21      ARG  31  50.873  -6.287  -6.563
  224   HH22  ARG  31          HH22      ARG  31  49.912  -7.593  -7.175
  225    H    LEU  32           H        LEU  32  46.541  -2.269  -3.191
  226    HA   LEU  32           HA       LEU  32  47.792  -2.570  -0.821
  227    HG   LEU  32           HG       LEU  32  47.169   0.991  -0.192
  228    HB2  LEU  32           HB2      LEU  32  46.885  -0.467  -2.038
  229    HB3  LEU  32           HB3      LEU  32  45.492  -0.663  -0.984
  230   HD11  LEU  32          HD11      LEU  32  46.229   0.570   1.756
  231   HD12  LEU  32          HD12      LEU  32  47.402  -0.716   2.039
  232   HD13  LEU  32          HD13      LEU  32  45.867  -1.079   1.252
  233   HD21  LEU  32          HD21      LEU  32  49.070  -0.629  -0.998
  234   HD22  LEU  32          HD22      LEU  32  48.937  -1.246   0.650
  235   HD23  LEU  32          HD23      LEU  32  49.313   0.455   0.371
  236    H    LEU  33           H        LEU  33  44.243  -2.344  -1.006
  237    HA   LEU  33           HA       LEU  33  43.649  -2.891   1.631
  238    HG   LEU  33           HG       LEU  33  42.225  -1.346  -0.899
  239    HB2  LEU  33           HB2      LEU  33  42.102  -3.706  -0.832
  240    HB3  LEU  33           HB3      LEU  33  41.453  -3.703   0.800
  241   HD11  LEU  33          HD11      LEU  33  39.908  -0.643  -0.206
  242   HD12  LEU  33          HD12      LEU  33  39.704  -2.263   0.461
  243   HD13  LEU  33          HD13      LEU  33  39.994  -2.051  -1.266
  244   HD21  LEU  33          HD21      LEU  33  41.662   0.034   1.120
  245   HD22  LEU  33          HD22      LEU  33  43.191  -0.840   1.214
  246   HD23  LEU  33          HD23      LEU  33  41.777  -1.443   2.077
  247    H    GLN  34           H        GLN  34  43.304  -5.305  -0.939
  248    HA   GLN  34           HA       GLN  34  42.880  -7.593   0.321
  249    HB2  GLN  34           HB2      GLN  34  44.785  -7.026  -1.912
  250    HB3  GLN  34           HB3      GLN  34  44.468  -8.674  -1.383
  251    HG2  GLN  34           HG2      GLN  34  42.280  -6.792  -2.209
  252    HG3  GLN  34           HG3      GLN  34  43.134  -7.818  -3.358
  253   HE21  GLN  34          HE21      GLN  34  40.480  -7.589  -1.427
  254   HE22  GLN  34          HE22      GLN  34  40.077  -9.264  -1.293
  255    H    THR  35           H        THR  35  45.893  -5.853   0.597
  256    HA   THR  35           HA       THR  35  47.349  -8.070   1.736
  257    HB   THR  35           HB       THR  35  48.439  -5.478   2.434
  258    HG1  THR  35           HG1      THR  35  47.806  -5.910  -0.295
  259   HG21  THR  35          HG21      THR  35  50.265  -6.248   0.866
  260   HG22  THR  35          HG22      THR  35  49.334  -7.733   0.673
  261   HG23  THR  35          HG23      THR  35  49.939  -7.273   2.264
  262    H    LYS  36           H        LYS  36  46.465  -4.939   3.093
  263    HA   LYS  36           HA       LYS  36  46.673  -5.808   5.797
  264    HB2  LYS  36           HB2      LYS  36  45.385  -3.324   4.666
  265    HB3  LYS  36           HB3      LYS  36  45.761  -3.593   6.363
  266    HG2  LYS  36           HG2      LYS  36  47.707  -2.607   5.961
  267    HG3  LYS  36           HG3      LYS  36  48.159  -4.069   5.080
  268    HD2  LYS  36           HD2      LYS  36  47.294  -3.095   3.012
  269    HD3  LYS  36           HD3      LYS  36  46.823  -1.639   3.890
  270    HE2  LYS  36           HE2      LYS  36  48.838  -0.819   3.423
  271    HE3  LYS  36           HE3      LYS  36  49.498  -2.014   4.540
  272    HZ1  LYS  36           HZ1      LYS  36  48.953  -2.852   1.789
  273    HZ2  LYS  36           HZ2      LYS  36  50.166  -3.362   2.851
  274    HZ3  LYS  36           HZ3      LYS  36  50.303  -1.870   2.065
  275    H    ASN  37           H        ASN  37  44.890  -7.559   4.508
  276    HA   ASN  37           HA       ASN  37  42.793  -8.457   4.590
  277    HB2  ASN  37           HB2      ASN  37  41.764  -8.129   6.985
  278    HB3  ASN  37           HB3      ASN  37  43.234  -9.082   6.778
  279   HD21  ASN  37          HD21      ASN  37  41.802  -6.469   8.339
  280   HD22  ASN  37          HD22      ASN  37  43.219  -5.809   9.076
  281    H    TYR  38           H        TYR  38  42.718  -6.112   3.234
  282    HA   TYR  38           HA       TYR  38  41.245  -4.577   2.417
  283    HD1  TYR  38           HD1      TYR  38  40.084  -8.006   4.308
  284    HD2  TYR  38           HD2      TYR  38  38.824  -5.974   0.789
  285    HE1  TYR  38           HE1      TYR  38  39.907 -10.158   3.138
  286    HE2  TYR  38           HE2      TYR  38  38.639  -8.125  -0.390
  287    HH   TYR  38           HH       TYR  38  39.943 -11.010   0.834
  288    HB2  TYR  38           HB2      TYR  38  39.224  -5.673   4.372
  289    HB3  TYR  38           HB3      TYR  38  38.908  -4.817   2.870
  290    H    ASP  39           H        ASP  39  42.910  -3.318   3.921
  291    HA   ASP  39           HA       ASP  39  41.295  -1.793   5.864
  292    HB2  ASP  39           HB2      ASP  39  44.057  -2.839   6.004
  293    HB3  ASP  39           HB3      ASP  39  43.803  -1.220   6.654
  294    H    ILE  40           H        ILE  40  40.925   0.247   5.418
  295    HA   ILE  40           HA       ILE  40  42.224   1.432   3.167
  296    HB   ILE  40           HB       ILE  40  40.724   3.329   3.503
  297   HG12  ILE  40          HG12      ILE  40  40.813   2.932   6.097
  298   HG13  ILE  40          HG13      ILE  40  39.386   3.652   5.362
  299   HG21  ILE  40          HG21      ILE  40  38.531   1.723   3.688
  300   HG22  ILE  40          HG22      ILE  40  39.788   0.573   3.233
  301   HG23  ILE  40          HG23      ILE  40  39.479   1.985   2.224
  302   HD11  ILE  40          HD11      ILE  40  39.551   1.362   6.986
  303   HD12  ILE  40          HD12      ILE  40  39.083   0.820   5.376
  304   HD13  ILE  40          HD13      ILE  40  38.127   2.048   6.205
  305    H    GLY  41           H        GLY  41  42.900   1.118   6.395
  306    HA2  GLY  41           HA2      GLY  41  43.752   3.534   7.292
  307    HA3  GLY  41           HA3      GLY  41  44.584   2.026   7.633
  308    H    ALA  42           H        ALA  42  45.028   1.538   4.851
  309    HA   ALA  42           HA       ALA  42  47.321   3.305   4.415
  310    HB1  ALA  42           HB1      ALA  42  48.154   1.136   4.388
  311    HB2  ALA  42           HB2      ALA  42  47.876   1.449   2.675
  312    HB3  ALA  42           HB3      ALA  42  46.716   0.492   3.597
  313    H    ALA  43           H        ALA  43  44.400   2.023   3.046
  314    HA   ALA  43           HA       ALA  43  44.460   2.805   0.431
  315    HB1  ALA  43           HB1      ALA  43  42.502   1.746   1.305
  316    HB2  ALA  43           HB2      ALA  43  42.012   3.314   0.659
  317    HB3  ALA  43           HB3      ALA  43  42.198   3.099   2.393
  318    H    LEU  44           H        LEU  44  44.065   4.827   3.245
  319    HA   LEU  44           HA       LEU  44  43.355   7.202   1.939
  320    HG   LEU  44           HG       LEU  44  42.015   8.120   4.092
  321    HB2  LEU  44           HB2      LEU  44  44.536   6.568   4.618
  322    HB3  LEU  44           HB3      LEU  44  44.364   8.238   4.100
  323   HD11  LEU  44          HD11      LEU  44  42.008   5.168   4.611
  324   HD12  LEU  44          HD12      LEU  44  42.043   5.805   2.968
  325   HD13  LEU  44          HD13      LEU  44  40.698   6.199   4.038
  326   HD21  LEU  44          HD21      LEU  44  43.467   7.504   6.380
  327   HD22  LEU  44          HD22      LEU  44  42.106   6.381   6.394
  328   HD23  LEU  44          HD23      LEU  44  41.816   8.119   6.305
  329    H    ASP  45           H        ASP  45  46.505   6.407   3.399
  330    HA   ASP  45           HA       ASP  45  48.021   8.476   2.626
  331    HB2  ASP  45           HB2      ASP  45  49.077   6.762   3.842
  332    HB3  ASP  45           HB3      ASP  45  48.694   5.546   2.627
  333    H    THR  46           H        THR  46  46.663   6.158   0.398
  334    HA   THR  46           HA       THR  46  48.403   7.066  -1.744
  335    HB   THR  46           HB       THR  46  46.975   5.398  -3.099
  336    HG1  THR  46           HG1      THR  46  45.288   5.025  -1.775
  337   HG21  THR  46          HG21      THR  46  48.326   3.591  -2.492
  338   HG22  THR  46          HG22      THR  46  48.503   4.167  -0.834
  339   HG23  THR  46          HG23      THR  46  49.301   5.021  -2.155
  340    H    ILE  47           H        ILE  47  44.833   6.943  -1.295
  341    HA   ILE  47           HA       ILE  47  44.708   9.248  -3.117
  342    HB   ILE  47           HB       ILE  47  43.834   7.627  -4.520
  343   HG12  ILE  47          HG12      ILE  47  42.235   9.566  -3.971
  344   HG13  ILE  47          HG13      ILE  47  41.581   8.182  -4.840
  345   HG21  ILE  47          HG21      ILE  47  41.858   6.221  -3.053
  346   HG22  ILE  47          HG22      ILE  47  43.364   6.179  -2.140
  347   HG23  ILE  47          HG23      ILE  47  43.325   5.593  -3.806
  348   HD11  ILE  47          HD11      ILE  47  41.016   7.393  -2.368
  349   HD12  ILE  47          HD12      ILE  47  39.951   8.444  -3.302
  350   HD13  ILE  47          HD13      ILE  47  41.034   9.135  -2.097
  351    H    GLN  48           H        GLN  48  43.046   7.427  -0.583
  352    HA   GLN  48           HA       GLN  48  41.379   9.680   0.059
  353    HB2  GLN  48           HB2      GLN  48  41.696   7.722   2.223
  354    HB3  GLN  48           HB3      GLN  48  40.241   8.322   1.459
  355    HG2  GLN  48           HG2      GLN  48  41.770   6.455  -0.200
  356    HG3  GLN  48           HG3      GLN  48  41.152   5.773   1.296
  357   HE21  GLN  48          HE21      GLN  48  40.453   5.444  -1.600
  358   HE22  GLN  48          HE22      GLN  48  38.739   5.689  -1.661
  359    H    TYR  49           H        TYR  49  43.277  11.059   0.008
  360    HA   TYR  49           HA       TYR  49  44.271  12.646   1.425
  361    HD1  TYR  49           HD2      TYR  49  42.149  12.124   1.824
  362    HD2  TYR  49           HD1      TYR  49  43.493  10.720   5.609
  363    HE1  TYR  49           HE2      TYR  49  39.842  12.125   2.632
  364    HE2  TYR  49           HE1      TYR  49  41.180  10.726   6.433
  365    HH   TYR  49           HH       TYR  49  38.667  10.582   4.884
  366    HB2  TYR  49           HB2      TYR  49  44.820  10.408   3.373
  367    HB3  TYR  49           HB3      TYR  49  44.973  12.139   3.648
  368    H    SER  50           H        SER  50  46.328  13.313   1.126
  369    HA   SER  50           HA       SER  50  48.350  11.257   0.519
  370    HG   SER  50           HG       SER  50  49.750  14.123  -1.049
  371    HB2  SER  50           HB2      SER  50  48.912  12.225  -1.455
  372    HB3  SER  50           HB3      SER  50  47.290  12.912  -1.371
  373    H    LYS  51           H        LYS  51  47.854  12.512   3.026
  374    HA   LYS  51           HA       LYS  51  50.496  13.569   3.544
  375    HB2  LYS  51           HB2      LYS  51  48.823  15.372   4.920
  376    HB3  LYS  51           HB3      LYS  51  49.930  15.730   3.601
  377    HG2  LYS  51           HG2      LYS  51  48.271  15.788   2.035
  378    HG3  LYS  51           HG3      LYS  51  47.236  14.674   2.930
  379    HD2  LYS  51           HD2      LYS  51  46.912  16.507   4.624
  380    HD3  LYS  51           HD3      LYS  51  47.739  17.588   3.500
  381    HE2  LYS  51           HE2      LYS  51  45.735  16.171   2.065
  382    HE3  LYS  51           HE3      LYS  51  45.004  16.818   3.534
  383    HZ1  LYS  51           HZ1      LYS  51  44.899  18.355   1.636
  384    HZ2  LYS  51           HZ2      LYS  51  46.588  18.416   1.597
  385    HZ3  LYS  51           HZ3      LYS  51  45.753  19.006   2.944
  386    H    HIS  52           H        HIS  52  51.079  12.240   5.150
  387    HA   HIS  52           HA       HIS  52  49.197  11.066   6.944
  388    HD1  HIS  52           HD1      HIS  52  52.278  10.877   9.723
  389    HD2  HIS  52           HD2      HIS  52  53.673  11.932   5.954
  390    HE1  HIS  52           HE1      HIS  52  54.514  12.003  10.083
  391    HB2  HIS  52           HB2      HIS  52  50.964   9.808   7.765
  392    HB3  HIS  52           HB3      HIS  52  51.514  10.168   6.133
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1  25.330 -15.701   3.261
    2    H2   GLY   1           2H       GLY   1  26.098 -16.508   4.534
    3    H3   GLY   1           3H       GLY   1  26.829 -16.445   3.010
    4    HA2  GLY   1           HA2      GLY   1  26.518 -14.292   5.004
    5    HA3  GLY   1           HA3      GLY   1  27.990 -14.860   4.231
    6    H    SER   2           H        SER   2  28.135 -12.424   3.984
    7    HA   SER   2           HA       SER   2  26.474 -11.168   2.027
    8    HG   SER   2           HG       SER   2  26.306  -9.465   3.193
    9    HB2  SER   2           HB2      SER   2  28.923 -10.409   3.557
   10    HB3  SER   2           HB3      SER   2  28.528  -9.487   2.107
   11    HA   PRO   3           HA       PRO   3  28.692 -12.527  -1.556
   12    HB2  PRO   3           HB2      PRO   3  27.478 -11.012  -3.392
   13    HB3  PRO   3           HB3      PRO   3  26.599 -12.278  -2.525
   14    HG2  PRO   3           HG2      PRO   3  26.577  -9.323  -2.099
   15    HG3  PRO   3           HG3      PRO   3  25.239 -10.479  -2.005
   16    HD2  PRO   3           HD2      PRO   3  26.649  -9.469   0.169
   17    HD3  PRO   3           HD3      PRO   3  25.662 -10.943   0.182
   18    HA   PRO   4           HA       PRO   4  31.996  -9.874  -2.779
   19    HB2  PRO   4           HB2      PRO   4  31.095  -9.883  -5.605
   20    HB3  PRO   4           HB3      PRO   4  32.630 -10.420  -4.911
   21    HG2  PRO   4           HG2      PRO   4  30.832 -12.188  -5.772
   22    HG3  PRO   4           HG3      PRO   4  31.780 -12.493  -4.304
   23    HD2  PRO   4           HD2      PRO   4  28.943 -11.568  -4.570
   24    HD3  PRO   4           HD3      PRO   4  29.642 -12.744  -3.437
   25    H    GLU   5           H        GLU   5  30.520  -8.218  -1.643
   26    HA   GLU   5           HA       GLU   5  30.817  -5.728  -2.495
   27    HB2  GLU   5           HB2      GLU   5  28.589  -5.141  -3.605
   28    HB3  GLU   5           HB3      GLU   5  29.775  -5.979  -4.595
   29    HG2  GLU   5           HG2      GLU   5  28.476  -7.782  -4.849
   30    HG3  GLU   5           HG3      GLU   5  27.926  -7.746  -3.174
   31    H    ALA   6           H        ALA   6  30.785  -5.639  -0.227
   32    HA   ALA   6           HA       ALA   6  29.546  -4.441   1.451
   33    HB1  ALA   6           HB1      ALA   6  27.408  -4.571   0.225
   34    HB2  ALA   6           HB2      ALA   6  27.237  -4.957   1.937
   35    HB3  ALA   6           HB3      ALA   6  27.240  -6.250   0.739
   36    H    ASP   7           H        ASP   7  31.288  -6.748   1.269
   37    HA   ASP   7           HA       ASP   7  30.359  -8.613   3.277
   38    HB2  ASP   7           HB2      ASP   7  33.130  -8.373   2.087
   39    HB3  ASP   7           HB3      ASP   7  32.453  -9.761   2.933
   40    HA   PRO   8           HA       PRO   8  31.651  -6.948   7.137
   41    HB2  PRO   8           HB2      PRO   8  33.939  -8.876   6.912
   42    HB3  PRO   8           HB3      PRO   8  32.918  -8.511   8.308
   43    HG2  PRO   8           HG2      PRO   8  32.541 -10.686   6.698
   44    HG3  PRO   8           HG3      PRO   8  31.243  -9.904   7.613
   45    HD2  PRO   8           HD2      PRO   8  31.622 -10.013   4.743
   46    HD3  PRO   8           HD3      PRO   8  30.253  -9.346   5.654
   47    H    ARG   9           H        ARG   9  34.520  -7.846   5.213
   48    HA   ARG   9           HA       ARG   9  36.021  -5.587   6.031
   49    HE   ARG   9           HE       ARG   9  39.287  -8.893   6.589
   50    HB2  ARG   9           HB2      ARG   9  36.497  -7.345   3.628
   51    HB3  ARG   9           HB3      ARG   9  37.689  -6.368   4.488
   52    HG2  ARG   9           HG2      ARG   9  36.232  -8.755   5.611
   53    HG3  ARG   9           HG3      ARG   9  37.901  -8.733   5.035
   54    HD2  ARG   9           HD2      ARG   9  37.713  -6.619   6.852
   55    HD3  ARG   9           HD3      ARG   9  36.832  -7.953   7.597
   56   HH11  ARG   9          HH11      ARG   9  37.999  -6.890   9.129
   57   HH12  ARG   9          HH12      ARG   9  39.302  -7.214  10.222
   58   HH21  ARG   9          HH21      ARG   9  41.007  -9.327   8.019
   59   HH22  ARG   9          HH22      ARG   9  41.015  -8.598   9.590
   60    H    LEU  10           H        LEU  10  34.254  -6.317   3.016
   61    HA   LEU  10           HA       LEU  10  35.112  -3.911   1.776
   62    HG   LEU  10           HG       LEU  10  34.535  -7.269   0.490
   63    HB2  LEU  10           HB2      LEU  10  32.907  -5.784   0.939
   64    HB3  LEU  10           HB3      LEU  10  33.649  -4.547  -0.058
   65   HD11  LEU  10          HD11      LEU  10  34.979  -5.156  -1.574
   66   HD12  LEU  10          HD12      LEU  10  34.241  -6.749  -1.739
   67   HD13  LEU  10          HD13      LEU  10  35.989  -6.602  -1.545
   68   HD21  LEU  10          HD21      LEU  10  36.174  -6.412   1.944
   69   HD22  LEU  10          HD22      LEU  10  36.451  -4.993   0.935
   70   HD23  LEU  10          HD23      LEU  10  36.990  -6.581   0.389
   71    H    ILE  11           H        ILE  11  32.536  -4.758   3.836
   72    HA   ILE  11           HA       ILE  11  30.915  -2.448   3.119
   73    HB   ILE  11           HB       ILE  11  29.954  -4.652   4.030
   74   HG12  ILE  11          HG12      ILE  11  29.036  -2.348   5.705
   75   HG13  ILE  11          HG13      ILE  11  28.904  -2.236   3.953
   76   HG21  ILE  11          HG21      ILE  11  31.742  -4.363   6.004
   77   HG22  ILE  11          HG22      ILE  11  30.245  -5.278   6.180
   78   HG23  ILE  11          HG23      ILE  11  30.339  -3.617   6.766
   79   HD11  ILE  11          HD11      ILE  11  26.924  -3.139   5.387
   80   HD12  ILE  11          HD12      ILE  11  27.837  -4.647   5.328
   81   HD13  ILE  11          HD13      ILE  11  27.313  -3.873   3.831
   82    H    GLU  12           H        GLU  12  33.588  -3.232   4.928
   83    HA   GLU  12           HA       GLU  12  33.353  -0.955   6.756
   84    HB2  GLU  12           HB2      GLU  12  34.021  -2.928   7.905
   85    HB3  GLU  12           HB3      GLU  12  35.212  -3.327   6.675
   86    HG2  GLU  12           HG2      GLU  12  36.780  -2.024   7.591
   87    HG3  GLU  12           HG3      GLU  12  35.636  -0.735   7.966
   88    H    SER  13           H        SER  13  35.652  -2.412   4.471
   89    HA   SER  13           HA       SER  13  37.101   0.111   4.270
   90    HG   SER  13           HG       SER  13  37.402  -3.519   3.271
   91    HB2  SER  13           HB2      SER  13  38.861  -1.136   3.238
   92    HB3  SER  13           HB3      SER  13  38.285  -2.087   4.608
   93    H    LEU  14           H        LEU  14  35.348  -2.148   2.140
   94    HA   LEU  14           HA       LEU  14  35.906  -0.701  -0.239
   95    HG   LEU  14           HG       LEU  14  35.578  -3.045  -1.951
   96    HB2  LEU  14           HB2      LEU  14  34.874  -3.145   0.199
   97    HB3  LEU  14           HB3      LEU  14  33.395  -2.267  -0.126
   98   HD11  LEU  14          HD11      LEU  14  33.123  -3.864  -1.799
   99   HD12  LEU  14          HD12      LEU  14  33.844  -3.570  -3.382
  100   HD13  LEU  14          HD13      LEU  14  32.756  -2.377  -2.673
  101   HD21  LEU  14          HD21      LEU  14  36.007  -0.808  -2.309
  102   HD22  LEU  14          HD22      LEU  14  34.349  -0.322  -1.957
  103   HD23  LEU  14          HD23      LEU  14  34.730  -1.116  -3.485
  104    H    SER  15           H        SER  15  32.674  -1.116   1.241
  105    HA   SER  15           HA       SER  15  31.393   0.952  -0.002
  106    HG   SER  15           HG       SER  15  30.532  -0.294   3.781
  107    HB2  SER  15           HB2      SER  15  30.036   1.214   2.123
  108    HB3  SER  15           HB3      SER  15  30.154  -0.439   1.520
  109    H    GLN  16           H        GLN  16  32.998   1.248   3.151
  110    HA   GLN  16           HA       GLN  16  32.927   3.899   3.621
  111    HB2  GLN  16           HB2      GLN  16  34.089   2.146   5.000
  112    HB3  GLN  16           HB3      GLN  16  35.456   2.268   3.901
  113    HG2  GLN  16           HG2      GLN  16  34.358   4.564   5.495
  114    HG3  GLN  16           HG3      GLN  16  35.708   3.553   6.008
  115   HE21  GLN  16          HE21      GLN  16  37.057   3.223   3.645
  116   HE22  GLN  16          HE22      GLN  16  37.671   4.745   3.103
  117    H    MET  17           H        MET  17  34.689   2.346   1.055
  118    HA   MET  17           HA       MET  17  36.162   4.783   0.457
  119    HB2  MET  17           HB2      MET  17  37.320   2.602   0.366
  120    HB3  MET  17           HB3      MET  17  36.238   2.097  -0.924
  121    HG2  MET  17           HG2      MET  17  37.148   4.320  -2.042
  122    HG3  MET  17           HG3      MET  17  38.515   3.989  -0.980
  123    HE1  MET  17           HE1      MET  17  40.657   2.147  -2.472
  124    HE2  MET  17           HE2      MET  17  40.122   3.824  -2.364
  125    HE3  MET  17           HE3      MET  17  40.194   3.020  -3.932
  126    H    LEU  18           H        LEU  18  33.510   2.859  -0.807
  127    HA   LEU  18           HA       LEU  18  33.396   4.258  -3.312
  128    HG   LEU  18           HG       LEU  18  31.877   1.130  -4.260
  129    HB2  LEU  18           HB2      LEU  18  32.077   2.002  -2.074
  130    HB3  LEU  18           HB3      LEU  18  30.926   3.032  -2.904
  131   HD11  LEU  18          HD11      LEU  18  30.784   3.052  -5.294
  132   HD12  LEU  18          HD12      LEU  18  32.122   2.467  -6.282
  133   HD13  LEU  18          HD13      LEU  18  32.319   3.922  -5.306
  134   HD21  LEU  18          HD21      LEU  18  34.103   1.416  -5.204
  135   HD22  LEU  18          HD22      LEU  18  34.180   1.280  -3.448
  136   HD23  LEU  18          HD23      LEU  18  34.349   2.857  -4.216
  137    H    SER  19           H        SER  19  30.842   4.000  -0.831
  138    HA   SER  19           HA       SER  19  29.573   6.381  -1.744
  139    HG   SER  19           HG       SER  19  27.575   5.331  -1.762
  140    HB2  SER  19           HB2      SER  19  29.070   4.431   0.475
  141    HB3  SER  19           HB3      SER  19  28.168   5.944   0.400
  142    H    MET  20           H        MET  20  32.357   6.357  -0.232
  143    HA   MET  20           HA       MET  20  31.629   8.539   1.608
  144    HB2  MET  20           HB2      MET  20  32.918   6.285   2.314
  145    HB3  MET  20           HB3      MET  20  34.296   7.281   1.866
  146    HG2  MET  20           HG2      MET  20  33.852   7.449   4.235
  147    HG3  MET  20           HG3      MET  20  33.570   8.998   3.442
  148    HE1  MET  20           HE1      MET  20  31.066  10.252   4.949
  149    HE2  MET  20           HE2      MET  20  30.164   9.821   3.496
  150    HE3  MET  20           HE3      MET  20  31.876  10.228   3.383
  151    H    GLY  21           H        GLY  21  32.941   7.938  -1.369
  152    HA2  GLY  21           HA2      GLY  21  33.755   9.605  -2.815
  153    HA3  GLY  21           HA3      GLY  21  34.148  10.596  -1.413
  154    H    PHE  22           H        PHE  22  35.082   7.273  -2.340
  155    HA   PHE  22           HA       PHE  22  37.860   8.171  -2.489
  156    HD1  PHE  22           HD1      PHE  22  38.361   9.218  -0.978
  157    HD2  PHE  22           HD2      PHE  22  37.078   6.051   1.557
  158    HE1  PHE  22           HE1      PHE  22  38.536  10.712   0.969
  159    HE2  PHE  22           HE2      PHE  22  37.250   7.538   3.509
  160    HZ   PHE  22           HZ       PHE  22  37.977   9.872   3.217
  161    HB2  PHE  22           HB2      PHE  22  36.875   5.864  -0.807
  162    HB3  PHE  22           HB3      PHE  22  38.570   6.161  -1.185
  163    H    SER  23           H        SER  23  39.087   7.051  -3.947
  164    HA   SER  23           HA       SER  23  37.869   4.736  -5.224
  165    HG   SER  23           HG       SER  23  36.373   5.626  -6.415
  166    HB2  SER  23           HB2      SER  23  38.599   7.312  -6.595
  167    HB3  SER  23           HB3      SER  23  38.620   5.787  -7.481
  168    H    ASP  24           H        ASP  24  39.505   3.727  -6.835
  169    HA   ASP  24           HA       ASP  24  42.033   3.516  -5.437
  170    HB2  ASP  24           HB2      ASP  24  42.506   1.688  -7.022
  171    HB3  ASP  24           HB3      ASP  24  40.935   1.485  -6.245
  172    H    GLU  25           H        GLU  25  43.662   4.834  -5.854
  173    HA   GLU  25           HA       GLU  25  43.754   6.326  -8.327
  174    HB2  GLU  25           HB2      GLU  25  44.290   7.316  -6.062
  175    HB3  GLU  25           HB3      GLU  25  45.784   6.392  -6.093
  176    HG2  GLU  25           HG2      GLU  25  45.492   7.855  -8.539
  177    HG3  GLU  25           HG3      GLU  25  45.314   8.936  -7.155
  178    H    GLY  26           H        GLY  26  43.992   3.866  -9.157
  179    HA2  GLY  26           HA2      GLY  26  45.913   3.553 -10.850
  180    HA3  GLY  26           HA3      GLY  26  46.860   3.277  -9.398
  181    H    GLY  27           H        GLY  27  43.765   2.067  -8.912
  182    HA2  GLY  27           HA2      GLY  27  42.841  -0.050  -9.084
  183    HA3  GLY  27           HA3      GLY  27  44.073  -0.444 -10.277
  184    H    TRP  28           H        TRP  28  44.777   0.797  -7.109
  185    HA   TRP  28           HA       TRP  28  46.264  -1.638  -6.489
  186    HD1  TRP  28           HD1      TRP  28  47.025   2.719  -6.865
  187    HE1  TRP  28           HE1      TRP  28  45.630   4.610  -5.839
  188    HE3  TRP  28           HE3      TRP  28  44.869   0.166  -3.004
  189    HZ2  TRP  28           HZ2      TRP  28  43.853   4.993  -3.692
  190    HZ3  TRP  28           HZ3      TRP  28  43.329   1.367  -1.508
  191    HH2  TRP  28           HH2      TRP  28  42.829   3.730  -1.851
  192    HB2  TRP  28           HB2      TRP  28  47.127  -0.188  -4.568
  193    HB3  TRP  28           HB3      TRP  28  47.586   0.308  -6.200
  194    H    LEU  29           H        LEU  29  43.477   0.213  -5.428
  195    HA   LEU  29           HA       LEU  29  43.100  -0.494  -2.862
  196    HG   LEU  29           HG       LEU  29  40.373  -2.133  -3.722
  197    HB2  LEU  29           HB2      LEU  29  41.300   0.679  -3.521
  198    HB3  LEU  29           HB3      LEU  29  41.300  -0.015  -5.131
  199   HD11  LEU  29          HD11      LEU  29  38.736  -0.155  -2.369
  200   HD12  LEU  29          HD12      LEU  29  40.404  -0.170  -1.795
  201   HD13  LEU  29          HD13      LEU  29  39.445  -1.650  -1.758
  202   HD21  LEU  29          HD21      LEU  29  38.678   0.168  -4.671
  203   HD22  LEU  29          HD22      LEU  29  38.177  -1.515  -4.495
  204   HD23  LEU  29          HD23      LEU  29  39.376  -1.073  -5.712
  205    H    THR  30           H        THR  30  41.845  -2.557  -5.497
  206    HA   THR  30           HA       THR  30  41.156  -4.757  -4.035
  207    HB   THR  30           HB       THR  30  41.849  -6.109  -6.091
  208    HG1  THR  30           HG1      THR  30  43.254  -3.945  -6.566
  209   HG21  THR  30          HG21      THR  30  39.898  -3.903  -6.038
  210   HG22  THR  30          HG22      THR  30  39.670  -5.623  -6.356
  211   HG23  THR  30          HG23      THR  30  40.300  -4.569  -7.621
  212    H    ARG  31           H        ARG  31  44.326  -3.574  -4.726
  213    HA   ARG  31           HA       ARG  31  45.619  -5.997  -3.723
  214    HE   ARG  31           HE       ARG  31  46.681  -6.853  -7.691
  215    HB2  ARG  31           HB2      ARG  31  47.331  -3.702  -4.357
  216    HB3  ARG  31           HB3      ARG  31  47.443  -5.368  -4.897
  217    HG2  ARG  31           HG2      ARG  31  45.577  -3.303  -6.040
  218    HG3  ARG  31           HG3      ARG  31  47.114  -3.798  -6.748
  219    HD2  ARG  31           HD2      ARG  31  45.278  -6.001  -6.120
  220    HD3  ARG  31           HD3      ARG  31  44.698  -4.886  -7.356
  221   HH11  ARG  31          HH11      ARG  31  46.022  -3.534  -8.520
  222   HH12  ARG  31          HH12      ARG  31  46.946  -3.580  -9.984
  223   HH21  ARG  31          HH21      ARG  31  47.895  -6.928  -9.620
  224   HH22  ARG  31          HH22      ARG  31  48.010  -5.513 -10.611
  225    H    LEU  32           H        LEU  32  46.103  -2.506  -3.183
  226    HA   LEU  32           HA       LEU  32  47.521  -2.449  -0.901
  227    HG   LEU  32           HG       LEU  32  46.367   1.087  -0.388
  228    HB2  LEU  32           HB2      LEU  32  46.658  -0.497  -2.179
  229    HB3  LEU  32           HB3      LEU  32  45.091  -0.738  -1.423
  230   HD11  LEU  32          HD11      LEU  32  45.709   0.601   1.752
  231   HD12  LEU  32          HD12      LEU  32  46.261  -1.072   1.661
  232   HD13  LEU  32          HD13      LEU  32  44.779  -0.585   0.837
  233   HD21  LEU  32          HD21      LEU  32  48.384   0.717   0.799
  234   HD22  LEU  32          HD22      LEU  32  48.598   0.010  -0.802
  235   HD23  LEU  32          HD23      LEU  32  48.268  -1.030   0.584
  236    H    LEU  33           H        LEU  33  43.963  -2.435  -0.874
  237    HA   LEU  33           HA       LEU  33  43.651  -2.758   1.885
  238    HG   LEU  33           HG       LEU  33  41.827  -1.448   1.999
  239    HB2  LEU  33           HB2      LEU  33  41.935  -3.079  -0.512
  240    HB3  LEU  33           HB3      LEU  33  41.364  -3.807   0.979
  241   HD11  LEU  33          HD11      LEU  33  42.799  -0.138   0.429
  242   HD12  LEU  33          HD12      LEU  33  41.115   0.178   0.006
  243   HD13  LEU  33          HD13      LEU  33  42.052  -1.000  -0.915
  244   HD21  LEU  33          HD21      LEU  33  39.549  -0.769   1.426
  245   HD22  LEU  33          HD22      LEU  33  39.631  -2.485   1.826
  246   HD23  LEU  33          HD23      LEU  33  39.512  -1.977   0.142
  247    H    GLN  34           H        GLN  34  43.146  -5.229  -0.625
  248    HA   GLN  34           HA       GLN  34  42.675  -7.432   0.870
  249    HB2  GLN  34           HB2      GLN  34  43.937  -6.947  -1.739
  250    HB3  GLN  34           HB3      GLN  34  44.256  -8.526  -1.037
  251    HG2  GLN  34           HG2      GLN  34  42.357  -8.752  -2.428
  252    HG3  GLN  34           HG3      GLN  34  41.785  -8.803  -0.760
  253   HE21  GLN  34          HE21      GLN  34  41.222  -6.535   0.103
  254   HE22  GLN  34          HE22      GLN  34  40.253  -5.563  -0.944
  255    H    THR  35           H        THR  35  45.762  -5.814   0.617
  256    HA   THR  35           HA       THR  35  47.210  -8.060   1.753
  257    HB   THR  35           HB       THR  35  48.693  -5.605   1.887
  258    HG1  THR  35           HG1      THR  35  48.598  -5.403  -0.544
  259   HG21  THR  35          HG21      THR  35  48.968  -7.865  -0.076
  260   HG22  THR  35          HG22      THR  35  49.644  -7.862   1.553
  261   HG23  THR  35          HG23      THR  35  50.195  -6.679   0.368
  262    H    LYS  36           H        LYS  36  46.925  -4.681   2.771
  263    HA   LYS  36           HA       LYS  36  47.568  -5.245   5.482
  264    HB2  LYS  36           HB2      LYS  36  46.420  -2.788   4.163
  265    HB3  LYS  36           HB3      LYS  36  46.907  -2.851   5.852
  266    HG2  LYS  36           HG2      LYS  36  48.801  -1.990   4.953
  267    HG3  LYS  36           HG3      LYS  36  49.172  -3.707   4.779
  268    HD2  LYS  36           HD2      LYS  36  48.659  -3.702   2.494
  269    HD3  LYS  36           HD3      LYS  36  47.776  -2.178   2.606
  270    HE2  LYS  36           HE2      LYS  36  49.732  -1.453   1.658
  271    HE3  LYS  36           HE3      LYS  36  50.114  -1.253   3.368
  272    HZ1  LYS  36           HZ1      LYS  36  51.080  -3.283   1.475
  273    HZ2  LYS  36           HZ2      LYS  36  51.002  -3.663   3.121
  274    HZ3  LYS  36           HZ3      LYS  36  51.950  -2.363   2.599
  275    H    ASN  37           H        ASN  37  45.316  -6.861   4.753
  276    HA   ASN  37           HA       ASN  37  43.236  -7.461   5.452
  277    HB2  ASN  37           HB2      ASN  37  43.026  -5.932   7.870
  278    HB3  ASN  37           HB3      ASN  37  43.318  -7.662   7.684
  279   HD21  ASN  37          HD21      ASN  37  44.663  -4.613   8.442
  280   HD22  ASN  37          HD22      ASN  37  46.270  -5.150   8.778
  281    H    TYR  38           H        TYR  38  42.614  -6.024   3.623
  282    HA   TYR  38           HA       TYR  38  41.526  -4.158   2.722
  283    HD1  TYR  38           HD2      TYR  38  40.541  -7.321   4.830
  284    HD2  TYR  38           HD1      TYR  38  38.785  -5.528   1.395
  285    HE1  TYR  38           HE2      TYR  38  40.292  -9.542   3.806
  286    HE2  TYR  38           HE1      TYR  38  38.531  -7.744   0.361
  287    HH   TYR  38           HH       TYR  38  40.007 -10.198   0.877
  288    HB2  TYR  38           HB2      TYR  38  39.542  -4.978   4.850
  289    HB3  TYR  38           HB3      TYR  38  39.186  -4.219   3.302
  290    H    ASP  39           H        ASP  39  43.358  -3.042   4.129
  291    HA   ASP  39           HA       ASP  39  42.503  -1.519   6.365
  292    HB2  ASP  39           HB2      ASP  39  44.951  -2.029   4.974
  293    HB3  ASP  39           HB3      ASP  39  44.779  -0.293   5.233
  294    H    ILE  40           H        ILE  40  41.815   0.465   6.567
  295    HA   ILE  40           HA       ILE  40  41.022   1.946   4.176
  296    HB   ILE  40           HB       ILE  40  40.349   3.173   6.741
  297   HG12  ILE  40          HG12      ILE  40  40.296   0.811   7.453
  298   HG13  ILE  40          HG13      ILE  40  38.691   1.536   7.452
  299   HG21  ILE  40          HG21      ILE  40  38.179   3.393   5.744
  300   HG22  ILE  40          HG22      ILE  40  38.576   2.198   4.510
  301   HG23  ILE  40          HG23      ILE  40  39.399   3.758   4.524
  302   HD11  ILE  40          HD11      ILE  40  37.925   0.035   6.012
  303   HD12  ILE  40          HD12      ILE  40  39.430  -0.850   6.268
  304   HD13  ILE  40          HD13      ILE  40  39.288   0.279   4.920
  305    H    GLY  41           H        GLY  41  42.921   2.107   7.098
  306    HA2  GLY  41           HA2      GLY  41  43.763   4.688   7.159
  307    HA3  GLY  41           HA3      GLY  41  44.779   3.342   7.621
  308    H    ALA  42           H        ALA  42  45.066   2.087   5.238
  309    HA   ALA  42           HA       ALA  42  46.960   3.835   3.914
  310    HB1  ALA  42           HB1      ALA  42  47.698   1.591   4.338
  311    HB2  ALA  42           HB2      ALA  42  47.523   1.793   2.595
  312    HB3  ALA  42           HB3      ALA  42  46.291   0.925   3.511
  313    H    ALA  43           H        ALA  43  43.995   2.187   3.283
  314    HA   ALA  43           HA       ALA  43  43.566   2.405   0.633
  315    HB1  ALA  43           HB1      ALA  43  41.165   2.803   1.105
  316    HB2  ALA  43           HB2      ALA  43  41.581   3.107   2.792
  317    HB3  ALA  43           HB3      ALA  43  41.865   1.516   2.085
  318    H    LEU  44           H        LEU  44  43.213   5.093   2.941
  319    HA   LEU  44           HA       LEU  44  42.547   6.978   0.878
  320    HG   LEU  44           HG       LEU  44  40.702   7.615   2.197
  321    HB2  LEU  44           HB2      LEU  44  43.219   7.241   3.795
  322    HB3  LEU  44           HB3      LEU  44  42.999   8.654   2.771
  323   HD11  LEU  44          HD11      LEU  44  41.503   6.037   4.624
  324   HD12  LEU  44          HD12      LEU  44  40.894   5.443   3.079
  325   HD13  LEU  44          HD13      LEU  44  39.818   6.305   4.178
  326   HD21  LEU  44          HD21      LEU  44  40.729   9.624   3.396
  327   HD22  LEU  44          HD22      LEU  44  41.451   8.870   4.818
  328   HD23  LEU  44          HD23      LEU  44  39.773   8.529   4.396
  329    H    ASP  45           H        ASP  45  45.383   5.744   2.259
  330    HA   ASP  45           HA       ASP  45  47.305   7.624   2.129
  331    HB2  ASP  45           HB2      ASP  45  47.474   5.081   2.585
  332    HB3  ASP  45           HB3      ASP  45  47.851   4.960   0.869
  333    H    THR  46           H        THR  46  46.488   5.601  -0.717
  334    HA   THR  46           HA       THR  46  47.904   7.521  -2.384
  335    HB   THR  46           HB       THR  46  47.574   5.777  -4.176
  336    HG1  THR  46           HG1      THR  46  45.935   4.773  -2.352
  337   HG21  THR  46          HG21      THR  46  49.461   4.722  -3.600
  338   HG22  THR  46          HG22      THR  46  48.856   4.287  -2.002
  339   HG23  THR  46          HG23      THR  46  49.491   5.906  -2.293
  340    H    ILE  47           H        ILE  47  44.688   7.144  -1.474
  341    HA   ILE  47           HA       ILE  47  43.557   7.713  -4.063
  342    HB   ILE  47           HB       ILE  47  41.442   7.668  -3.093
  343   HG12  ILE  47          HG12      ILE  47  42.787   8.214  -0.441
  344   HG13  ILE  47          HG13      ILE  47  41.758   9.317  -1.346
  345   HG21  ILE  47          HG21      ILE  47  41.942   5.471  -2.950
  346   HG22  ILE  47          HG22      ILE  47  41.801   5.783  -1.221
  347   HG23  ILE  47          HG23      ILE  47  43.390   5.755  -1.986
  348   HD11  ILE  47          HD11      ILE  47  39.886   7.711  -1.047
  349   HD12  ILE  47          HD12      ILE  47  40.490   8.418   0.453
  350   HD13  ILE  47          HD13      ILE  47  40.932   6.768   0.013
  351    H    GLN  48           H        GLN  48  43.873   9.612  -1.040
  352    HA   GLN  48           HA       GLN  48  44.171  12.027  -2.603
  353    HB2  GLN  48           HB2      GLN  48  41.703  11.466  -0.989
  354    HB3  GLN  48           HB3      GLN  48  42.263  13.116  -1.225
  355    HG2  GLN  48           HG2      GLN  48  41.178  13.169  -3.145
  356    HG3  GLN  48           HG3      GLN  48  42.253  11.918  -3.763
  357   HE21  GLN  48          HE21      GLN  48  41.423   9.994  -4.246
  358   HE22  GLN  48          HE22      GLN  48  39.816   9.471  -3.860
  359    H    TYR  49           H        TYR  49  45.535  10.406  -0.426
  360    HA   TYR  49           HA       TYR  49  46.499  12.658   1.059
  361    HD1  TYR  49           HD2      TYR  49  45.467  14.250   2.666
  362    HD2  TYR  49           HD1      TYR  49  42.635  11.095   2.307
  363    HE1  TYR  49           HE2      TYR  49  43.639  15.893   2.718
  364    HE2  TYR  49           HE1      TYR  49  40.800  12.731   2.356
  365    HH   TYR  49           HH       TYR  49  41.129  15.882   1.781
  366    HB2  TYR  49           HB2      TYR  49  44.872  10.563   2.511
  367    HB3  TYR  49           HB3      TYR  49  45.933  11.720   3.314
  368    H    SER  50           H        SER  50  48.554  12.098   0.421
  369    HA   SER  50           HA       SER  50  49.533   9.445   1.209
  370    HG   SER  50           HG       SER  50  49.953  10.058  -2.192
  371    HB2  SER  50           HB2      SER  50  50.550  11.498  -0.757
  372    HB3  SER  50           HB3      SER  50  51.550  10.149  -0.214
  373    H    LYS  51           H        LYS  51  49.050  11.361   3.209
  374    HA   LYS  51           HA       LYS  51  51.733  11.620   4.307
  375    HB2  LYS  51           HB2      LYS  51  51.089  13.776   3.108
  376    HB3  LYS  51           HB3      LYS  51  49.850  13.977   4.339
  377    HG2  LYS  51           HG2      LYS  51  51.342  14.524   5.950
  378    HG3  LYS  51           HG3      LYS  51  52.611  13.494   5.284
  379    HD2  LYS  51           HD2      LYS  51  53.040  15.968   5.124
  380    HD3  LYS  51           HD3      LYS  51  53.134  15.086   3.597
  381    HE2  LYS  51           HE2      LYS  51  50.472  15.834   3.779
  382    HE3  LYS  51           HE3      LYS  51  51.349  17.230   4.403
  383    HZ1  LYS  51           HZ1      LYS  51  52.161  17.713   2.391
  384    HZ2  LYS  51           HZ2      LYS  51  50.913  16.737   1.799
  385    HZ3  LYS  51           HZ3      LYS  51  52.467  16.097   1.994
  386    H    HIS  52           H        HIS  52  50.934   9.901   5.660
  387    HA   HIS  52           HA       HIS  52  49.093  10.872   7.740
  388    HD1  HIS  52           HD1      HIS  52  46.224   8.020   6.262
  389    HD2  HIS  52           HD2      HIS  52  47.664  10.088   9.566
  390    HE1  HIS  52           HE1      HIS  52  44.211   8.557   7.695
  391    HB2  HIS  52           HB2      HIS  52  48.673   8.710   6.045
  392    HB3  HIS  52           HB3      HIS  52  49.240   7.969   7.538
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1  36.365 -15.066  -5.422
    2    H2   GLY   1           2H       GLY   1  36.814 -14.694  -7.010
    3    H3   GLY   1           3H       GLY   1  35.318 -14.179  -6.413
    4    HA2  GLY   1           HA2      GLY   1  37.407 -13.254  -4.737
    5    HA3  GLY   1           HA3      GLY   1  37.699 -12.777  -6.403
    6    H    SER   2           H        SER   2  34.578 -13.212  -4.792
    7    HA   SER   2           HA       SER   2  34.100 -10.322  -5.122
    8    HG   SER   2           HG       SER   2  33.588 -10.841  -7.218
    9    HB2  SER   2           HB2      SER   2  32.175 -12.610  -5.589
   10    HB3  SER   2           HB3      SER   2  31.704 -10.910  -5.557
   11    HA   PRO   3           HA       PRO   3  33.117 -10.355  -0.811
   12    HB2  PRO   3           HB2      PRO   3  31.819  -7.999  -0.635
   13    HB3  PRO   3           HB3      PRO   3  33.561  -8.094  -0.918
   14    HG2  PRO   3           HG2      PRO   3  31.346  -7.632  -2.879
   15    HG3  PRO   3           HG3      PRO   3  32.919  -6.821  -2.755
   16    HD2  PRO   3           HD2      PRO   3  32.403  -8.816  -4.540
   17    HD3  PRO   3           HD3      PRO   3  34.014  -8.508  -3.864
   18    HA   PRO   4           HA       PRO   4  29.090 -11.989  -0.134
   19    HB2  PRO   4           HB2      PRO   4  28.911 -10.303   2.294
   20    HB3  PRO   4           HB3      PRO   4  28.809 -12.059   2.132
   21    HG2  PRO   4           HG2      PRO   4  30.986 -10.901   3.158
   22    HG3  PRO   4           HG3      PRO   4  31.110 -12.325   2.110
   23    HD2  PRO   4           HD2      PRO   4  31.617  -9.448   1.466
   24    HD3  PRO   4           HD3      PRO   4  32.502 -10.894   0.940
   25    H    GLU   5           H        GLU   5  27.138 -10.490   1.510
   26    HA   GLU   5           HA       GLU   5  26.086  -8.820  -0.646
   27    HB2  GLU   5           HB2      GLU   5  24.635  -9.615   1.872
   28    HB3  GLU   5           HB3      GLU   5  23.946  -9.089   0.343
   29    HG2  GLU   5           HG2      GLU   5  25.199 -11.724   1.023
   30    HG3  GLU   5           HG3      GLU   5  23.572 -11.395   0.430
   31    H    ALA   6           H        ALA   6  28.246  -7.827   0.892
   32    HA   ALA   6           HA       ALA   6  28.663  -5.560   1.408
   33    HB1  ALA   6           HB1      ALA   6  27.062  -4.129   2.403
   34    HB2  ALA   6           HB2      ALA   6  26.025  -5.481   2.857
   35    HB3  ALA   6           HB3      ALA   6  26.203  -5.036   1.158
   36    H    ASP   7           H        ASP   7  30.086  -7.176   2.517
   37    HA   ASP   7           HA       ASP   7  29.528  -7.550   5.349
   38    HB2  ASP   7           HB2      ASP   7  30.871  -9.068   3.443
   39    HB3  ASP   7           HB3      ASP   7  32.161  -8.404   4.440
   40    HA   PRO   8           HA       PRO   8  31.724  -4.269   7.256
   41    HB2  PRO   8           HB2      PRO   8  33.680  -6.417   8.015
   42    HB3  PRO   8           HB3      PRO   8  33.039  -5.093   8.997
   43    HG2  PRO   8           HG2      PRO   8  32.046  -7.584   9.179
   44    HG3  PRO   8           HG3      PRO   8  31.018  -6.152   9.355
   45    HD2  PRO   8           HD2      PRO   8  31.115  -8.118   7.174
   46    HD3  PRO   8           HD3      PRO   8  29.845  -6.947   7.573
   47    H    ARG   9           H        ARG   9  33.857  -6.699   5.764
   48    HA   ARG   9           HA       ARG   9  36.069  -5.268   5.175
   49    HE   ARG   9           HE       ARG   9  37.891 -10.201   4.417
   50    HB2  ARG   9           HB2      ARG   9  34.694  -7.098   3.198
   51    HB3  ARG   9           HB3      ARG   9  36.411  -6.710   3.254
   52    HG2  ARG   9           HG2      ARG   9  36.616  -7.838   5.398
   53    HG3  ARG   9           HG3      ARG   9  34.889  -8.194   5.388
   54    HD2  ARG   9           HD2      ARG   9  35.095  -9.840   3.834
   55    HD3  ARG   9           HD3      ARG   9  36.458  -9.061   3.032
   56   HH11  ARG   9          HH11      ARG   9  34.639 -10.474   5.640
   57   HH12  ARG   9          HH12      ARG   9  35.048 -11.672   6.823
   58   HH21  ARG   9          HH21      ARG   9  38.437 -11.772   5.975
   59   HH22  ARG   9          HH22      ARG   9  37.206 -12.407   7.014
   60    H    LEU  10           H        LEU  10  33.303  -5.471   2.930
   61    HA   LEU  10           HA       LEU  10  34.268  -3.058   1.594
   62    HG   LEU  10           HG       LEU  10  33.724  -6.251  -0.269
   63    HB2  LEU  10           HB2      LEU  10  32.159  -5.039   0.756
   64    HB3  LEU  10           HB3      LEU  10  32.668  -3.653  -0.187
   65   HD11  LEU  10          HD11      LEU  10  33.974  -3.720  -1.626
   66   HD12  LEU  10          HD12      LEU  10  34.073  -5.359  -2.268
   67   HD13  LEU  10          HD13      LEU  10  35.509  -4.588  -1.593
   68   HD21  LEU  10          HD21      LEU  10  35.176  -5.985   1.563
   69   HD22  LEU  10          HD22      LEU  10  35.577  -4.327   1.116
   70   HD23  LEU  10          HD23      LEU  10  36.177  -5.670   0.145
   71    H    ILE  11           H        ILE  11  31.613  -4.144   3.574
   72    HA   ILE  11           HA       ILE  11  29.978  -1.853   2.923
   73    HB   ILE  11           HB       ILE  11  29.085  -4.105   3.774
   74   HG12  ILE  11          HG12      ILE  11  28.231  -1.441   4.901
   75   HG13  ILE  11          HG13      ILE  11  27.562  -2.300   3.518
   76   HG21  ILE  11          HG21      ILE  11  30.761  -3.553   5.891
   77   HG22  ILE  11          HG22      ILE  11  29.512  -4.797   5.847
   78   HG23  ILE  11          HG23      ILE  11  29.155  -3.210   6.530
   79   HD11  ILE  11          HD11      ILE  11  26.426  -2.251   5.945
   80   HD12  ILE  11          HD12      ILE  11  27.404  -3.710   6.094
   81   HD13  ILE  11          HD13      ILE  11  26.220  -3.572   4.795
   82    H    GLU  12           H        GLU  12  32.411  -2.734   5.120
   83    HA   GLU  12           HA       GLU  12  32.065  -0.285   6.718
   84    HB2  GLU  12           HB2      GLU  12  32.685  -2.764   7.582
   85    HB3  GLU  12           HB3      GLU  12  34.300  -2.112   7.363
   86    HG2  GLU  12           HG2      GLU  12  33.696  -1.723   9.610
   87    HG3  GLU  12           HG3      GLU  12  33.604  -0.169   8.784
   88    H    SER  13           H        SER  13  34.710  -2.025   5.064
   89    HA   SER  13           HA       SER  13  36.341   0.352   5.045
   90    HG   SER  13           HG       SER  13  38.769  -0.641   3.757
   91    HB2  SER  13           HB2      SER  13  37.001  -2.219   5.249
   92    HB3  SER  13           HB3      SER  13  37.156  -2.047   3.499
   93    H    LEU  14           H        LEU  14  34.551  -1.492   2.553
   94    HA   LEU  14           HA       LEU  14  35.725   0.094   0.461
   95    HG   LEU  14           HG       LEU  14  33.988   0.119  -1.566
   96    HB2  LEU  14           HB2      LEU  14  35.034  -2.141  -0.107
   97    HB3  LEU  14           HB3      LEU  14  33.389  -1.810   0.376
   98   HD11  LEU  14          HD11      LEU  14  34.442  -1.698  -3.434
   99   HD12  LEU  14          HD12      LEU  14  35.285  -2.495  -2.105
  100   HD13  LEU  14          HD13      LEU  14  35.756  -0.870  -2.601
  101   HD21  LEU  14          HD21      LEU  14  31.806  -0.763  -1.299
  102   HD22  LEU  14          HD22      LEU  14  32.361  -2.412  -1.589
  103   HD23  LEU  14          HD23      LEU  14  32.347  -1.242  -2.908
  104    H    SER  15           H        SER  15  32.279  -0.172   1.474
  105    HA   SER  15           HA       SER  15  31.203   1.942   0.226
  106    HG   SER  15           HG       SER  15  29.965  -0.167   1.202
  107    HB2  SER  15           HB2      SER  15  30.833   0.981   3.054
  108    HB3  SER  15           HB3      SER  15  29.932   2.375   2.462
  109    H    GLN  16           H        GLN  16  32.605   2.321   3.479
  110    HA   GLN  16           HA       GLN  16  32.646   4.979   3.789
  111    HB2  GLN  16           HB2      GLN  16  33.659   3.993   5.574
  112    HB3  GLN  16           HB3      GLN  16  34.514   2.825   4.580
  113    HG2  GLN  16           HG2      GLN  16  35.305   5.715   4.778
  114    HG3  GLN  16           HG3      GLN  16  35.950   4.460   5.830
  115   HE21  GLN  16          HE21      GLN  16  37.498   6.067   4.118
  116   HE22  GLN  16          HE22      GLN  16  38.210   5.052   2.914
  117    H    MET  17           H        MET  17  34.581   3.213   1.474
  118    HA   MET  17           HA       MET  17  36.157   5.569   0.815
  119    HB2  MET  17           HB2      MET  17  37.188   3.305   0.944
  120    HB3  MET  17           HB3      MET  17  36.212   2.822  -0.437
  121    HG2  MET  17           HG2      MET  17  37.309   4.501  -1.813
  122    HG3  MET  17           HG3      MET  17  38.272   5.015  -0.429
  123    HE1  MET  17           HE1      MET  17  39.964   1.396   0.260
  124    HE2  MET  17           HE2      MET  17  38.202   1.371   0.308
  125    HE3  MET  17           HE3      MET  17  39.085   2.691   1.072
  126    H    LEU  18           H        LEU  18  33.363   3.881  -0.326
  127    HA   LEU  18           HA       LEU  18  33.483   4.930  -3.004
  128    HG   LEU  18           HG       LEU  18  31.193   2.351  -3.897
  129    HB2  LEU  18           HB2      LEU  18  31.858   3.058  -1.528
  130    HB3  LEU  18           HB3      LEU  18  30.852   4.152  -2.460
  131   HD11  LEU  18          HD11      LEU  18  32.009   3.407  -5.714
  132   HD12  LEU  18          HD12      LEU  18  33.533   3.815  -4.924
  133   HD13  LEU  18          HD13      LEU  18  32.095   4.789  -4.621
  134   HD21  LEU  18          HD21      LEU  18  33.423   1.348  -4.303
  135   HD22  LEU  18          HD22      LEU  18  32.864   1.160  -2.640
  136   HD23  LEU  18          HD23      LEU  18  34.081   2.375  -3.030
  137    H    SER  19           H        SER  19  31.020   5.398  -0.451
  138    HA   SER  19           HA       SER  19  30.021   7.766  -1.665
  139    HG   SER  19           HG       SER  19  27.794   5.640   0.084
  140    HB2  SER  19           HB2      SER  19  29.449   7.087   1.190
  141    HB3  SER  19           HB3      SER  19  28.367   7.720  -0.051
  142    H    MET  20           H        MET  20  32.896   7.536  -0.326
  143    HA   MET  20           HA       MET  20  32.710  10.044   1.191
  144    HB2  MET  20           HB2      MET  20  33.748   8.099   2.345
  145    HB3  MET  20           HB3      MET  20  34.998   8.067   1.108
  146    HG2  MET  20           HG2      MET  20  36.114   9.778   2.016
  147    HG3  MET  20           HG3      MET  20  34.642  10.667   2.402
  148    HE1  MET  20           HE1      MET  20  36.196  10.596   5.918
  149    HE2  MET  20           HE2      MET  20  35.051  11.486   4.913
  150    HE3  MET  20           HE3      MET  20  36.681  11.167   4.321
  151    H    GLY  21           H        GLY  21  33.830   8.581  -1.682
  152    HA2  GLY  21           HA2      GLY  21  34.374   9.903  -3.602
  153    HA3  GLY  21           HA3      GLY  21  35.006  11.142  -2.522
  154    H    PHE  22           H        PHE  22  35.655   7.647  -2.518
  155    HA   PHE  22           HA       PHE  22  38.386   8.192  -3.398
  156    HD1  PHE  22           HD2      PHE  22  40.158   9.128  -2.140
  157    HD2  PHE  22           HD1      PHE  22  37.341   8.110   0.883
  158    HE1  PHE  22           HE2      PHE  22  40.775  11.156  -0.888
  159    HE2  PHE  22           HE1      PHE  22  37.951  10.135   2.139
  160    HZ   PHE  22           HZ       PHE  22  39.670  11.660   1.254
  161    HB2  PHE  22           HB2      PHE  22  37.619   6.693  -0.884
  162    HB3  PHE  22           HB3      PHE  22  39.228   6.648  -1.605
  163    H    SER  23           H        SER  23  39.389   6.420  -4.395
  164    HA   SER  23           HA       SER  23  37.814   3.996  -4.648
  165    HG   SER  23           HG       SER  23  37.151   6.682  -6.924
  166    HB2  SER  23           HB2      SER  23  38.782   5.392  -7.144
  167    HB3  SER  23           HB3      SER  23  37.669   4.030  -7.022
  168    H    ASP  24           H        ASP  24  39.387   3.046  -6.911
  169    HA   ASP  24           HA       ASP  24  41.839   2.439  -5.445
  170    HB2  ASP  24           HB2      ASP  24  42.182   0.752  -7.290
  171    HB3  ASP  24           HB3      ASP  24  40.720   0.505  -6.331
  172    H    GLU  25           H        GLU  25  43.514   3.727  -5.756
  173    HA   GLU  25           HA       GLU  25  43.695   5.323  -8.172
  174    HB2  GLU  25           HB2      GLU  25  44.327   5.854  -5.584
  175    HB3  GLU  25           HB3      GLU  25  45.912   5.456  -6.236
  176    HG2  GLU  25           HG2      GLU  25  44.966   7.123  -8.154
  177    HG3  GLU  25           HG3      GLU  25  44.205   7.792  -6.710
  178    H    GLY  26           H        GLY  26  43.953   2.761  -8.916
  179    HA2  GLY  26           HA2      GLY  26  45.855   2.459 -10.645
  180    HA3  GLY  26           HA3      GLY  26  46.835   2.269  -9.199
  181    H    GLY  27           H        GLY  27  43.749   0.998  -8.681
  182    HA2  GLY  27           HA2      GLY  27  42.870  -1.143  -8.874
  183    HA3  GLY  27           HA3      GLY  27  44.247  -1.586  -9.873
  184    H    TRP  28           H        TRP  28  44.571  -0.079  -6.760
  185    HA   TRP  28           HA       TRP  28  45.954  -2.469  -5.801
  186    HD1  TRP  28           HD1      TRP  28  46.696   2.002  -6.172
  187    HE1  TRP  28           HE1      TRP  28  45.248   3.841  -5.116
  188    HE3  TRP  28           HE3      TRP  28  44.494  -0.728  -2.478
  189    HZ2  TRP  28           HZ2      TRP  28  43.397   4.097  -3.000
  190    HZ3  TRP  28           HZ3      TRP  28  42.893   0.374  -0.981
  191    HH2  TRP  28           HH2      TRP  28  42.351   2.727  -1.230
  192    HB2  TRP  28           HB2      TRP  28  46.794  -0.973  -3.984
  193    HB3  TRP  28           HB3      TRP  28  47.242  -0.439  -5.606
  194    H    LEU  29           H        LEU  29  43.124  -0.449  -5.053
  195    HA   LEU  29           HA       LEU  29  42.518  -1.113  -2.511
  196    HG   LEU  29           HG       LEU  29  39.732  -2.480  -3.207
  197    HB2  LEU  29           HB2      LEU  29  40.953   0.232  -3.544
  198    HB3  LEU  29           HB3      LEU  29  40.803  -0.823  -4.936
  199   HD11  LEU  29          HD11      LEU  29  40.362  -0.778  -1.352
  200   HD12  LEU  29          HD12      LEU  29  38.792  -1.581  -1.295
  201   HD13  LEU  29          HD13      LEU  29  38.915   0.077  -1.889
  202   HD21  LEU  29          HD21      LEU  29  37.561  -1.649  -3.772
  203   HD22  LEU  29          HD22      LEU  29  38.625  -1.367  -5.151
  204   HD23  LEU  29          HD23      LEU  29  38.200  -0.034  -4.075
  205    H    THR  30           H        THR  30  41.254  -3.107  -5.175
  206    HA   THR  30           HA       THR  30  40.433  -5.263  -3.718
  207    HB   THR  30           HB       THR  30  40.716  -6.623  -5.705
  208    HG1  THR  30           HG1      THR  30  42.819  -6.028  -6.274
  209   HG21  THR  30          HG21      THR  30  39.301  -5.536  -7.078
  210   HG22  THR  30          HG22      THR  30  40.232  -4.039  -7.037
  211   HG23  THR  30          HG23      THR  30  39.171  -4.454  -5.691
  212    H    ARG  31           H        ARG  31  43.714  -4.275  -4.374
  213    HA   ARG  31           HA       ARG  31  44.793  -6.795  -3.373
  214    HE   ARG  31           HE       ARG  31  48.390  -6.695  -5.900
  215    HB2  ARG  31           HB2      ARG  31  46.523  -4.484  -4.124
  216    HB3  ARG  31           HB3      ARG  31  46.810  -6.207  -4.321
  217    HG2  ARG  31           HG2      ARG  31  44.778  -5.972  -6.008
  218    HG3  ARG  31           HG3      ARG  31  45.356  -4.308  -6.070
  219    HD2  ARG  31           HD2      ARG  31  46.305  -6.029  -7.751
  220    HD3  ARG  31           HD3      ARG  31  47.410  -4.914  -6.950
  221   HH11  ARG  31          HH11      ARG  31  45.325  -7.691  -7.214
  222   HH12  ARG  31          HH12      ARG  31  45.565  -9.367  -6.849
  223   HH21  ARG  31          HH21      ARG  31  48.722  -8.901  -5.418
  224   HH22  ARG  31          HH22      ARG  31  47.499 -10.056  -5.831
  225    H    LEU  32           H        LEU  32  45.627  -3.362  -2.754
  226    HA   LEU  32           HA       LEU  32  46.995  -3.744  -0.419
  227    HG   LEU  32           HG       LEU  32  44.292  -0.946  -0.374
  228    HB2  LEU  32           HB2      LEU  32  47.242  -1.555  -0.583
  229    HB3  LEU  32           HB3      LEU  32  46.080  -1.559  -1.891
  230   HD11  LEU  32          HD11      LEU  32  45.494  -0.250   2.003
  231   HD12  LEU  32          HD12      LEU  32  46.164  -1.844   1.653
  232   HD13  LEU  32          HD13      LEU  32  44.416  -1.621   1.743
  233   HD21  LEU  32          HD21      LEU  32  46.115   0.715  -1.250
  234   HD22  LEU  32          HD22      LEU  32  46.529   0.837   0.459
  235   HD23  LEU  32          HD23      LEU  32  44.906   1.252  -0.084
  236    H    LEU  33           H        LEU  33  43.561  -2.643  -0.402
  237    HA   LEU  33           HA       LEU  33  43.102  -3.022   2.280
  238    HG   LEU  33           HG       LEU  33  41.033  -2.027   2.766
  239    HB2  LEU  33           HB2      LEU  33  41.497  -2.777  -0.117
  240    HB3  LEU  33           HB3      LEU  33  40.745  -3.861   1.039
  241   HD11  LEU  33          HD11      LEU  33  42.662  -0.632   1.786
  242   HD12  LEU  33          HD12      LEU  33  41.152   0.277   1.733
  243   HD13  LEU  33          HD13      LEU  33  41.759  -0.509   0.276
  244   HD21  LEU  33          HD21      LEU  33  39.225  -0.627   1.191
  245   HD22  LEU  33          HD22      LEU  33  38.857  -1.929   2.321
  246   HD23  LEU  33          HD23      LEU  33  39.121  -2.291   0.616
  247    H    GLN  34           H        GLN  34  42.245  -5.369  -0.244
  248    HA   GLN  34           HA       GLN  34  41.475  -7.517   1.175
  249    HB2  GLN  34           HB2      GLN  34  41.731  -7.340  -1.312
  250    HB3  GLN  34           HB3      GLN  34  43.429  -7.745  -1.109
  251    HG2  GLN  34           HG2      GLN  34  42.912  -9.889  -1.169
  252    HG3  GLN  34           HG3      GLN  34  41.940  -9.691   0.287
  253   HE21  GLN  34          HE21      GLN  34  39.934  -8.054  -0.724
  254   HE22  GLN  34          HE22      GLN  34  38.997  -8.958  -1.859
  255    H    THR  35           H        THR  35  44.708  -6.254   1.121
  256    HA   THR  35           HA       THR  35  45.893  -8.619   2.328
  257    HB   THR  35           HB       THR  35  47.140  -5.871   2.255
  258    HG1  THR  35           HG1      THR  35  47.616  -7.674   0.188
  259   HG21  THR  35          HG21      THR  35  49.112  -7.569   1.638
  260   HG22  THR  35          HG22      THR  35  48.125  -8.614   2.660
  261   HG23  THR  35          HG23      THR  35  48.726  -7.078   3.287
  262    H    LYS  36           H        LYS  36  45.728  -5.259   3.371
  263    HA   LYS  36           HA       LYS  36  45.978  -5.844   6.137
  264    HB2  LYS  36           HB2      LYS  36  45.222  -3.372   4.607
  265    HB3  LYS  36           HB3      LYS  36  45.177  -3.399   6.365
  266    HG2  LYS  36           HG2      LYS  36  47.324  -2.862   6.353
  267    HG3  LYS  36           HG3      LYS  36  47.666  -4.457   5.680
  268    HD2  LYS  36           HD2      LYS  36  48.020  -3.647   3.599
  269    HD3  LYS  36           HD3      LYS  36  46.756  -2.423   3.748
  270    HE2  LYS  36           HE2      LYS  36  48.231  -0.853   4.318
  271    HE3  LYS  36           HE3      LYS  36  48.964  -1.893   5.538
  272    HZ1  LYS  36           HZ1      LYS  36  50.691  -1.583   4.082
  273    HZ2  LYS  36           HZ2      LYS  36  49.698  -1.549   2.713
  274    HZ3  LYS  36           HZ3      LYS  36  50.032  -3.020   3.477
  275    H    ASN  37           H        ASN  37  43.796  -7.392   5.114
  276    HA   ASN  37           HA       ASN  37  41.631  -7.946   5.515
  277    HB2  ASN  37           HB2      ASN  37  42.366  -8.134   7.789
  278    HB3  ASN  37           HB3      ASN  37  42.308  -6.385   8.014
  279   HD21  ASN  37          HD21      ASN  37  40.757  -5.957   9.401
  280   HD22  ASN  37          HD22      ASN  37  39.154  -6.600   9.366
  281    H    TYR  38           H        TYR  38  41.734  -5.977   3.717
  282    HA   TYR  38           HA       TYR  38  40.630  -4.183   2.805
  283    HD1  TYR  38           HD1      TYR  38  39.258  -7.503   4.287
  284    HD2  TYR  38           HD2      TYR  38  37.904  -5.040   1.093
  285    HE1  TYR  38           HE1      TYR  38  38.932  -9.501   2.893
  286    HE2  TYR  38           HE2      TYR  38  37.574  -7.032  -0.309
  287    HH   TYR  38           HH       TYR  38  37.138  -9.797   0.497
  288    HB2  TYR  38           HB2      TYR  38  38.415  -5.133   4.635
  289    HB3  TYR  38           HB3      TYR  38  38.217  -4.102   3.223
  290    H    ASP  39           H        ASP  39  42.305  -3.107   4.322
  291    HA   ASP  39           HA       ASP  39  41.158  -1.729   6.579
  292    HB2  ASP  39           HB2      ASP  39  43.375  -0.913   7.002
  293    HB3  ASP  39           HB3      ASP  39  43.488  -2.621   6.574
  294    H    ILE  40           H        ILE  40  40.645   0.289   6.773
  295    HA   ILE  40           HA       ILE  40  40.503   1.965   4.375
  296    HB   ILE  40           HB       ILE  40  39.312   3.536   6.155
  297   HG12  ILE  40          HG12      ILE  40  39.816   1.505   7.847
  298   HG13  ILE  40          HG13      ILE  40  38.424   2.565   8.011
  299   HG21  ILE  40          HG21      ILE  40  37.167   2.597   5.430
  300   HG22  ILE  40          HG22      ILE  40  38.009   1.165   4.836
  301   HG23  ILE  40          HG23      ILE  40  38.321   2.739   4.104
  302   HD11  ILE  40          HD11      ILE  40  38.491  -0.192   6.821
  303   HD12  ILE  40          HD12      ILE  40  37.102   0.890   6.707
  304   HD13  ILE  40          HD13      ILE  40  37.665   0.339   8.287
  305    H    GLY  41           H        GLY  41  41.655   1.885   7.668
  306    HA2  GLY  41           HA2      GLY  41  42.759   4.274   8.097
  307    HA3  GLY  41           HA3      GLY  41  43.552   2.800   8.594
  308    H    ALA  42           H        ALA  42  44.051   1.845   5.972
  309    HA   ALA  42           HA       ALA  42  46.294   3.590   5.289
  310    HB1  ALA  42           HB1      ALA  42  45.949   0.841   4.175
  311    HB2  ALA  42           HB2      ALA  42  46.511   1.061   5.832
  312    HB3  ALA  42           HB3      ALA  42  47.433   1.741   4.490
  313    H    ALA  43           H        ALA  43  43.339   2.333   4.063
  314    HA   ALA  43           HA       ALA  43  43.666   2.611   1.321
  315    HB1  ALA  43           HB1      ALA  43  41.582   1.937   2.869
  316    HB2  ALA  43           HB2      ALA  43  41.420   2.365   1.167
  317    HB3  ALA  43           HB3      ALA  43  41.092   3.568   2.415
  318    H    LEU  44           H        LEU  44  42.800   5.045   3.740
  319    HA   LEU  44           HA       LEU  44  42.400   7.233   2.061
  320    HG   LEU  44           HG       LEU  44  41.378   8.904   3.367
  321    HB2  LEU  44           HB2      LEU  44  42.876   6.774   4.887
  322    HB3  LEU  44           HB3      LEU  44  43.634   8.259   4.332
  323   HD11  LEU  44          HD11      LEU  44  40.714   6.305   3.944
  324   HD12  LEU  44          HD12      LEU  44  39.578   7.607   3.590
  325   HD13  LEU  44          HD13      LEU  44  39.965   7.205   5.263
  326   HD21  LEU  44          HD21      LEU  44  42.005   8.663   6.276
  327   HD22  LEU  44          HD22      LEU  44  40.457   9.334   5.764
  328   HD23  LEU  44          HD23      LEU  44  41.961  10.097   5.250
  329    H    ASP  45           H        ASP  45  45.318   6.503   3.931
  330    HA   ASP  45           HA       ASP  45  47.046   8.346   2.956
  331    HB2  ASP  45           HB2      ASP  45  47.828   6.940   4.674
  332    HB3  ASP  45           HB3      ASP  45  47.513   5.480   3.740
  333    H    THR  46           H        THR  46  45.980   5.439   1.259
  334    HA   THR  46           HA       THR  46  47.873   5.979  -0.894
  335    HB   THR  46           HB       THR  46  47.444   3.814  -1.698
  336    HG1  THR  46           HG1      THR  46  45.536   2.996  -1.626
  337   HG21  THR  46          HG21      THR  46  48.387   4.067   0.780
  338   HG22  THR  46          HG22      THR  46  48.170   2.509  -0.016
  339   HG23  THR  46          HG23      THR  46  46.954   3.097   1.118
  340    H    ILE  47           H        ILE  47  44.348   5.824  -0.402
  341    HA   ILE  47           HA       ILE  47  43.656   6.154  -3.111
  342    HB   ILE  47           HB       ILE  47  41.445   6.893  -2.327
  343   HG12  ILE  47          HG12      ILE  47  42.862   6.981   0.322
  344   HG13  ILE  47          HG13      ILE  47  41.876   8.227  -0.433
  345   HG21  ILE  47          HG21      ILE  47  42.716   4.494  -1.075
  346   HG22  ILE  47          HG22      ILE  47  41.657   4.574  -2.483
  347   HG23  ILE  47          HG23      ILE  47  41.000   4.833  -0.868
  348   HD11  ILE  47          HD11      ILE  47  40.175   6.045  -0.124
  349   HD12  ILE  47          HD12      ILE  47  40.191   7.533   0.821
  350   HD13  ILE  47          HD13      ILE  47  41.104   6.128   1.371
  351    H    GLN  48           H        GLN  48  44.406   8.513  -0.605
  352    HA   GLN  48           HA       GLN  48  45.153  10.495  -2.418
  353    HB2  GLN  48           HB2      GLN  48  42.285  10.370  -1.845
  354    HB3  GLN  48           HB3      GLN  48  42.988  11.950  -1.529
  355    HG2  GLN  48           HG2      GLN  48  43.208  12.409  -3.695
  356    HG3  GLN  48           HG3      GLN  48  43.841  10.806  -4.067
  357   HE21  GLN  48          HE21      GLN  48  42.015   9.060  -3.737
  358   HE22  GLN  48          HE22      GLN  48  40.537   9.416  -4.567
  359    H    TYR  49           H        TYR  49  46.363   9.613  -0.188
  360    HA   TYR  49           HA       TYR  49  46.645  12.003   1.356
  361    HD1  TYR  49           HD2      TYR  49  45.602  13.222   3.339
  362    HD2  TYR  49           HD1      TYR  49  43.052   9.997   2.243
  363    HE1  TYR  49           HE2      TYR  49  43.648  14.701   3.550
  364    HE2  TYR  49           HE1      TYR  49  41.093  11.466   2.453
  365    HH   TYR  49           HH       TYR  49  41.379  14.873   2.806
  366    HB2  TYR  49           HB2      TYR  49  45.310   9.586   2.552
  367    HB3  TYR  49           HB3      TYR  49  46.250  10.689   3.557
  368    H    SER  50           H        SER  50  48.217  10.200  -0.312
  369    HA   SER  50           HA       SER  50  50.058   8.924   1.552
  370    HG   SER  50           HG       SER  50  49.535   6.834   0.314
  371    HB2  SER  50           HB2      SER  50  49.300   8.499  -1.176
  372    HB3  SER  50           HB3      SER  50  51.041   8.773  -1.106
  373    H    LYS  51           H        LYS  51  49.765  11.893   1.316
  374    HA   LYS  51           HA       LYS  51  52.608  12.475   0.831
  375    HB2  LYS  51           HB2      LYS  51  50.201  14.007  -0.116
  376    HB3  LYS  51           HB3      LYS  51  51.750  14.810   0.119
  377    HG2  LYS  51           HG2      LYS  51  52.657  12.892  -1.391
  378    HG3  LYS  51           HG3      LYS  51  50.969  12.747  -1.887
  379    HD2  LYS  51           HD2      LYS  51  50.933  15.055  -2.591
  380    HD3  LYS  51           HD3      LYS  51  52.565  15.307  -1.967
  381    HE2  LYS  51           HE2      LYS  51  53.409  14.669  -3.915
  382    HE3  LYS  51           HE3      LYS  51  52.647  13.090  -3.729
  383    HZ1  LYS  51           HZ1      LYS  51  50.582  14.189  -4.650
  384    HZ2  LYS  51           HZ2      LYS  51  51.851  13.949  -5.743
  385    HZ3  LYS  51           HZ3      LYS  51  51.574  15.485  -5.095
  386    H    HIS  52           H        HIS  52  51.730  11.817   3.312
  387    HA   HIS  52           HA       HIS  52  51.296  14.343   4.732
  388    HD1  HIS  52           HD1      HIS  52  50.463  11.546   8.335
  389    HD2  HIS  52           HD2      HIS  52  52.947  10.577   5.147
  390    HE1  HIS  52           HE1      HIS  52  51.959   9.675   9.144
  391    HB2  HIS  52           HB2      HIS  52  50.267  13.165   6.396
  392    HB3  HIS  52           HB3      HIS  52  50.000  12.029   5.080
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1  37.565 -11.726  -7.438
    2    H2   GLY   1           2H       GLY   1  37.210 -10.116  -7.067
    3    H3   GLY   1           3H       GLY   1  35.962 -11.189  -7.457
    4    HA2  GLY   1           HA2      GLY   1  36.879 -12.525  -5.432
    5    HA3  GLY   1           HA3      GLY   1  37.510 -10.951  -4.974
    6    H    SER   2           H        SER   2  34.766 -12.977  -5.102
    7    HA   SER   2           HA       SER   2  32.810 -10.906  -4.708
    8    HG   SER   2           HG       SER   2  32.399 -14.910  -4.581
    9    HB2  SER   2           HB2      SER   2  31.208 -12.665  -4.558
   10    HB3  SER   2           HB3      SER   2  32.373 -13.167  -5.783
   11    HA   PRO   3           HA       PRO   3  33.572 -10.834  -0.304
   12    HB2  PRO   3           HB2      PRO   3  32.361  -8.466   0.151
   13    HB3  PRO   3           HB3      PRO   3  33.958  -8.591  -0.594
   14    HG2  PRO   3           HG2      PRO   3  31.369  -7.884  -1.809
   15    HG3  PRO   3           HG3      PRO   3  33.009  -7.501  -2.351
   16    HD2  PRO   3           HD2      PRO   3  31.273  -9.565  -3.311
   17    HD3  PRO   3           HD3      PRO   3  32.932  -9.206  -3.828
   18    HA   PRO   4           HA       PRO   4  29.972 -12.221   1.793
   19    HB2  PRO   4           HB2      PRO   4  30.149  -9.957   3.701
   20    HB3  PRO   4           HB3      PRO   4  30.177 -11.696   4.009
   21    HG2  PRO   4           HG2      PRO   4  32.404 -10.234   4.188
   22    HG3  PRO   4           HG3      PRO   4  32.435 -11.881   3.532
   23    HD2  PRO   4           HD2      PRO   4  32.545  -9.263   2.092
   24    HD3  PRO   4           HD3      PRO   4  33.406 -10.777   1.749
   25    H    GLU   5           H        GLU   5  28.081 -10.841   3.283
   26    HA   GLU   5           HA       GLU   5  26.590  -9.509   1.147
   27    HB2  GLU   5           HB2      GLU   5  25.437 -10.157   3.837
   28    HB3  GLU   5           HB3      GLU   5  24.634 -10.087   2.274
   29    HG2  GLU   5           HG2      GLU   5  26.687 -12.136   2.377
   30    HG3  GLU   5           HG3      GLU   5  25.443 -12.358   3.606
   31    H    ALA   6           H        ALA   6  28.708  -8.067   2.288
   32    HA   ALA   6           HA       ALA   6  28.854  -5.741   2.631
   33    HB1  ALA   6           HB1      ALA   6  27.141  -4.444   3.491
   34    HB2  ALA   6           HB2      ALA   6  26.463  -5.773   4.431
   35    HB3  ALA   6           HB3      ALA   6  26.248  -5.731   2.681
   36    H    ASP   7           H        ASP   7  30.576  -7.085   3.696
   37    HA   ASP   7           HA       ASP   7  30.342  -7.268   6.596
   38    HB2  ASP   7           HB2      ASP   7  31.363  -9.202   5.824
   39    HB3  ASP   7           HB3      ASP   7  32.214  -8.363   4.533
   40    HA   PRO   8           HA       PRO   8  32.358  -3.620   7.955
   41    HB2  PRO   8           HB2      PRO   8  34.568  -5.501   8.727
   42    HB3  PRO   8           HB3      PRO   8  33.881  -4.153   9.641
   43    HG2  PRO   8           HG2      PRO   8  33.173  -6.714  10.115
   44    HG3  PRO   8           HG3      PRO   8  32.041  -5.365  10.307
   45    HD2  PRO   8           HD2      PRO   8  32.059  -7.495   8.302
   46    HD3  PRO   8           HD3      PRO   8  30.762  -6.362   8.716
   47    H    ARG   9           H        ARG   9  34.438  -6.037   6.401
   48    HA   ARG   9           HA       ARG   9  36.486  -4.434   5.516
   49    HE   ARG   9           HE       ARG   9  36.705  -8.321   3.212
   50    HB2  ARG   9           HB2      ARG   9  35.189  -6.877   4.342
   51    HB3  ARG   9           HB3      ARG   9  36.545  -6.094   3.536
   52    HG2  ARG   9           HG2      ARG   9  38.045  -6.812   5.066
   53    HG3  ARG   9           HG3      ARG   9  36.900  -6.701   6.404
   54    HD2  ARG   9           HD2      ARG   9  37.675  -9.034   5.676
   55    HD3  ARG   9           HD3      ARG   9  35.948  -8.774   5.917
   56   HH11  ARG   9          HH11      ARG   9  36.044 -10.832   5.531
   57   HH12  ARG   9          HH12      ARG   9  35.547 -11.985   4.339
   58   HH21  ARG   9          HH21      ARG   9  36.057  -9.833   1.629
   59   HH22  ARG   9          HH22      ARG   9  35.556 -11.417   2.118
   60    H    LEU  10           H        LEU  10  33.415  -5.111   3.839
   61    HA   LEU  10           HA       LEU  10  34.047  -3.047   1.887
   62    HG   LEU  10           HG       LEU  10  33.152  -6.281   0.311
   63    HB2  LEU  10           HB2      LEU  10  32.026  -5.261   1.978
   64    HB3  LEU  10           HB3      LEU  10  31.897  -3.959   0.810
   65   HD11  LEU  10          HD11      LEU  10  34.409  -3.879  -0.886
   66   HD12  LEU  10          HD12      LEU  10  32.666  -4.074  -1.070
   67   HD13  LEU  10          HD13      LEU  10  33.760  -5.326  -1.658
   68   HD21  LEU  10          HD21      LEU  10  34.890  -6.049   1.933
   69   HD22  LEU  10          HD22      LEU  10  35.269  -4.417   1.377
   70   HD23  LEU  10          HD23      LEU  10  35.599  -5.805   0.338
   71    H    ILE  11           H        ILE  11  31.543  -3.892   4.237
   72    HA   ILE  11           HA       ILE  11  29.938  -1.615   3.610
   73    HB   ILE  11           HB       ILE  11  29.114  -3.751   4.727
   74   HG12  ILE  11          HG12      ILE  11  28.365  -1.200   6.159
   75   HG13  ILE  11          HG13      ILE  11  27.842  -1.576   4.521
   76   HG21  ILE  11          HG21      ILE  11  31.015  -3.017   6.646
   77   HG22  ILE  11          HG22      ILE  11  29.861  -4.348   6.729
   78   HG23  ILE  11          HG23      ILE  11  29.442  -2.774   7.406
   79   HD11  ILE  11          HD11      ILE  11  26.126  -2.698   5.336
   80   HD12  ILE  11          HD12      ILE  11  26.670  -2.347   6.977
   81   HD13  ILE  11          HD13      ILE  11  27.230  -3.803   6.155
   82    H    GLU  12           H        GLU  12  32.624  -2.223   5.579
   83    HA   GLU  12           HA       GLU  12  32.323   0.378   6.940
   84    HB2  GLU  12           HB2      GLU  12  33.149  -1.973   8.024
   85    HB3  GLU  12           HB3      GLU  12  34.691  -1.233   7.627
   86    HG2  GLU  12           HG2      GLU  12  34.108  -0.690   9.885
   87    HG3  GLU  12           HG3      GLU  12  34.020   0.770   8.901
   88    H    SER  13           H        SER  13  34.796  -1.489   5.214
   89    HA   SER  13           HA       SER  13  36.372   0.880   4.754
   90    HG   SER  13           HG       SER  13  37.526  -2.775   5.193
   91    HB2  SER  13           HB2      SER  13  37.271  -1.497   3.363
   92    HB3  SER  13           HB3      SER  13  38.073  -0.558   4.623
   93    H    LEU  14           H        LEU  14  34.501  -1.362   2.656
   94    HA   LEU  14           HA       LEU  14  35.451  -0.107   0.278
   95    HG   LEU  14           HG       LEU  14  33.323  -2.385  -1.771
   96    HB2  LEU  14           HB2      LEU  14  34.585  -2.396   0.243
   97    HB3  LEU  14           HB3      LEU  14  32.984  -1.808   0.636
   98   HD11  LEU  14          HD11      LEU  14  31.953  -0.688  -2.535
   99   HD12  LEU  14          HD12      LEU  14  32.748   0.538  -1.550
  100   HD13  LEU  14          HD13      LEU  14  31.680  -0.644  -0.794
  101   HD21  LEU  14          HD21      LEU  14  35.532  -1.711  -2.217
  102   HD22  LEU  14          HD22      LEU  14  35.253  -0.088  -1.584
  103   HD23  LEU  14          HD23      LEU  14  34.513  -0.581  -3.108
  104    H    SER  15           H        SER  15  32.212   0.029   1.817
  105    HA   SER  15           HA       SER  15  31.086   1.968   0.243
  106    HG   SER  15           HG       SER  15  29.059   3.090   1.696
  107    HB2  SER  15           HB2      SER  15  29.763   1.040   2.014
  108    HB3  SER  15           HB3      SER  15  30.894   1.609   3.243
  109    H    GLN  16           H        GLN  16  32.955   2.573   3.200
  110    HA   GLN  16           HA       GLN  16  33.191   5.221   3.337
  111    HB2  GLN  16           HB2      GLN  16  34.430   3.454   4.686
  112    HB3  GLN  16           HB3      GLN  16  35.654   3.481   3.423
  113    HG2  GLN  16           HG2      GLN  16  34.815   5.815   5.116
  114    HG3  GLN  16           HG3      GLN  16  36.284   4.866   5.319
  115   HE21  GLN  16          HE21      GLN  16  36.969   4.564   2.627
  116   HE22  GLN  16          HE22      GLN  16  37.446   6.105   2.004
  117    H    MET  17           H        MET  17  34.641   3.216   0.862
  118    HA   MET  17           HA       MET  17  36.074   5.470  -0.288
  119    HB2  MET  17           HB2      MET  17  36.214   2.563  -0.465
  120    HB3  MET  17           HB3      MET  17  36.355   3.346  -2.033
  121    HG2  MET  17           HG2      MET  17  38.064   4.867  -0.697
  122    HG3  MET  17           HG3      MET  17  38.177   3.418   0.301
  123    HE1  MET  17           HE1      MET  17  39.630   0.978  -0.881
  124    HE2  MET  17           HE2      MET  17  39.972   2.340   0.185
  125    HE3  MET  17           HE3      MET  17  41.047   1.989  -1.168
  126    H    LEU  18           H        LEU  18  33.182   3.574  -0.902
  127    HA   LEU  18           HA       LEU  18  32.878   4.512  -3.592
  128    HG   LEU  18           HG       LEU  18  30.815   1.588  -3.898
  129    HB2  LEU  18           HB2      LEU  18  31.452   2.728  -1.787
  130    HB3  LEU  18           HB3      LEU  18  30.376   3.677  -2.794
  131   HD11  LEU  18          HD11      LEU  18  31.055   2.495  -5.934
  132   HD12  LEU  18          HD12      LEU  18  32.619   3.208  -5.540
  133   HD13  LEU  18          HD13      LEU  18  31.130   4.028  -5.067
  134   HD21  LEU  18          HD21      LEU  18  33.360   1.839  -2.741
  135   HD22  LEU  18          HD22      LEU  18  33.607   1.853  -4.487
  136   HD23  LEU  18          HD23      LEU  18  32.750   0.511  -3.730
  137    H    SER  19           H        SER  19  30.726   5.109  -0.766
  138    HA   SER  19           HA       SER  19  29.515   7.334  -2.034
  139    HG   SER  19           HG       SER  19  27.708   5.529  -0.936
  140    HB2  SER  19           HB2      SER  19  29.267   5.925   0.541
  141    HB3  SER  19           HB3      SER  19  28.818   7.631   0.573
  142    H    MET  20           H        MET  20  32.557   7.246  -0.976
  143    HA   MET  20           HA       MET  20  32.473   9.958   0.163
  144    HB2  MET  20           HB2      MET  20  33.605   8.006   1.421
  145    HB3  MET  20           HB3      MET  20  34.876   8.148   0.217
  146    HG2  MET  20           HG2      MET  20  35.797   9.807   1.342
  147    HG3  MET  20           HG3      MET  20  34.304  10.738   1.247
  148    HE1  MET  20           HE1      MET  20  32.374  10.665   3.346
  149    HE2  MET  20           HE2      MET  20  33.692  11.821   3.155
  150    HE3  MET  20           HE3      MET  20  33.354  11.122   4.739
  151    H    GLY  21           H        GLY  21  33.456   8.020  -2.473
  152    HA2  GLY  21           HA2      GLY  21  33.963   8.892  -4.613
  153    HA3  GLY  21           HA3      GLY  21  34.463  10.399  -3.850
  154    H    PHE  22           H        PHE  22  35.487   7.197  -2.800
  155    HA   PHE  22           HA       PHE  22  38.185   7.793  -3.802
  156    HD1  PHE  22           HD1      PHE  22  38.453   9.488  -2.993
  157    HD2  PHE  22           HD2      PHE  22  38.104   7.716   0.860
  158    HE1  PHE  22           HE1      PHE  22  38.753  11.698  -1.953
  159    HE2  PHE  22           HE2      PHE  22  38.401   9.922   1.907
  160    HZ   PHE  22           HZ       PHE  22  38.727  11.913   0.500
  161    HB2  PHE  22           HB2      PHE  22  37.386   6.545  -1.158
  162    HB3  PHE  22           HB3      PHE  22  39.039   6.607  -1.771
  163    H    SER  23           H        SER  23  38.983   6.233  -5.065
  164    HA   SER  23           HA       SER  23  37.855   3.555  -4.751
  165    HG   SER  23           HG       SER  23  35.937   4.542  -7.439
  166    HB2  SER  23           HB2      SER  23  38.372   4.866  -7.434
  167    HB3  SER  23           HB3      SER  23  37.670   3.272  -7.156
  168    H    ASP  24           H        ASP  24  39.475   2.817  -7.218
  169    HA   ASP  24           HA       ASP  24  41.976   2.410  -5.800
  170    HB2  ASP  24           HB2      ASP  24  42.508   0.800  -7.485
  171    HB3  ASP  24           HB3      ASP  24  40.803   0.564  -7.094
  172    H    GLU  25           H        GLU  25  43.562   3.859  -5.993
  173    HA   GLU  25           HA       GLU  25  43.492   5.787  -8.162
  174    HB2  GLU  25           HB2      GLU  25  44.270   6.008  -5.587
  175    HB3  GLU  25           HB3      GLU  25  45.828   5.737  -6.350
  176    HG2  GLU  25           HG2      GLU  25  44.467   7.651  -7.909
  177    HG3  GLU  25           HG3      GLU  25  44.283   8.122  -6.220
  178    H    GLY  26           H        GLY  26  44.038   2.978  -8.779
  179    HA2  GLY  26           HA2      GLY  26  45.695   3.088 -10.883
  180    HA3  GLY  26           HA3      GLY  26  46.818   2.851  -9.550
  181    H    GLY  27           H        GLY  27  43.783   1.313  -9.037
  182    HA2  GLY  27           HA2      GLY  27  43.055  -0.852  -9.470
  183    HA3  GLY  27           HA3      GLY  27  44.534  -1.143 -10.375
  184    H    TRP  28           H        TRP  28  44.666   0.226  -7.197
  185    HA   TRP  28           HA       TRP  28  46.007  -2.202  -6.264
  186    HD1  TRP  28           HD1      TRP  28  46.922   2.192  -6.515
  187    HE1  TRP  28           HE1      TRP  28  45.531   4.107  -5.538
  188    HE3  TRP  28           HE3      TRP  28  44.312  -0.396  -2.977
  189    HZ2  TRP  28           HZ2      TRP  28  43.578   4.495  -3.549
  190    HZ3  TRP  28           HZ3      TRP  28  42.696   0.819  -1.581
  191    HH2  TRP  28           HH2      TRP  28  42.335   3.216  -1.861
  192    HB2  TRP  28           HB2      TRP  28  46.747  -0.767  -4.344
  193    HB3  TRP  28           HB3      TRP  28  47.321  -0.242  -5.927
  194    H    LEU  29           H        LEU  29  43.184  -0.193  -5.514
  195    HA   LEU  29           HA       LEU  29  42.514  -0.928  -3.008
  196    HG   LEU  29           HG       LEU  29  39.762  -2.413  -4.158
  197    HB2  LEU  29           HB2      LEU  29  40.881   0.370  -3.923
  198    HB3  LEU  29           HB3      LEU  29  40.898  -0.485  -5.456
  199   HD11  LEU  29          HD11      LEU  29  40.189  -0.665  -2.031
  200   HD12  LEU  29          HD12      LEU  29  39.210  -2.132  -2.027
  201   HD13  LEU  29          HD13      LEU  29  38.461  -0.572  -2.365
  202   HD21  LEU  29          HD21      LEU  29  38.287  -1.555  -5.630
  203   HD22  LEU  29          HD22      LEU  29  38.640   0.112  -5.179
  204   HD23  LEU  29          HD23      LEU  29  37.558  -0.860  -4.182
  205    H    THR  30           H        THR  30  41.333  -2.851  -5.753
  206    HA   THR  30           HA       THR  30  40.485  -5.060  -4.408
  207    HB   THR  30           HB       THR  30  40.805  -6.340  -6.420
  208    HG1  THR  30           HG1      THR  30  42.980  -5.764  -6.818
  209   HG21  THR  30          HG21      THR  30  39.182  -5.150  -7.332
  210   HG22  THR  30          HG22      THR  30  40.419  -4.154  -8.097
  211   HG23  THR  30          HG23      THR  30  39.739  -3.676  -6.541
  212    H    ARG  31           H        ARG  31  43.767  -4.031  -4.878
  213    HA   ARG  31           HA       ARG  31  44.824  -6.577  -3.910
  214    HE   ARG  31           HE       ARG  31  47.358  -6.285  -7.419
  215    HB2  ARG  31           HB2      ARG  31  46.743  -4.410  -4.347
  216    HB3  ARG  31           HB3      ARG  31  46.761  -6.064  -4.932
  217    HG2  ARG  31           HG2      ARG  31  45.297  -5.491  -6.751
  218    HG3  ARG  31           HG3      ARG  31  45.113  -3.849  -6.127
  219    HD2  ARG  31           HD2      ARG  31  46.719  -3.605  -7.791
  220    HD3  ARG  31           HD3      ARG  31  47.677  -3.722  -6.317
  221   HH11  ARG  31          HH11      ARG  31  48.973  -3.266  -8.043
  222   HH12  ARG  31          HH12      ARG  31  50.278  -3.994  -8.919
  223   HH21  ARG  31          HH21      ARG  31  49.069  -7.257  -8.576
  224   HH22  ARG  31          HH22      ARG  31  50.334  -6.264  -9.219
  225    H    LEU  32           H        LEU  32  45.574  -3.147  -3.159
  226    HA   LEU  32           HA       LEU  32  46.839  -3.560  -0.779
  227    HG   LEU  32           HG       LEU  32  44.041  -0.956  -0.577
  228    HB2  LEU  32           HB2      LEU  32  47.013  -1.365  -0.920
  229    HB3  LEU  32           HB3      LEU  32  45.817  -1.359  -2.199
  230   HD11  LEU  32          HD11      LEU  32  44.311  -1.616   1.523
  231   HD12  LEU  32          HD12      LEU  32  45.392  -0.239   1.743
  232   HD13  LEU  32          HD13      LEU  32  46.049  -1.815   1.298
  233   HD21  LEU  32          HD21      LEU  32  45.788   0.845  -1.470
  234   HD22  LEU  32          HD22      LEU  32  46.083   1.012   0.258
  235   HD23  LEU  32          HD23      LEU  32  44.464   1.261  -0.384
  236    H    LEU  33           H        LEU  33  43.355  -2.637  -0.902
  237    HA   LEU  33           HA       LEU  33  42.735  -3.028   1.734
  238    HG   LEU  33           HG       LEU  33  40.541  -2.207   2.026
  239    HB2  LEU  33           HB2      LEU  33  41.282  -3.032  -0.777
  240    HB3  LEU  33           HB3      LEU  33  40.563  -4.138   0.381
  241   HD11  LEU  33          HD11      LEU  33  41.623  -0.865  -0.374
  242   HD12  LEU  33          HD12      LEU  33  41.875  -0.518   1.338
  243   HD13  LEU  33          HD13      LEU  33  40.393   0.009   0.540
  244   HD21  LEU  33          HD21      LEU  33  38.767  -2.949  -0.003
  245   HD22  LEU  33          HD22      LEU  33  38.799  -1.185  -0.022
  246   HD23  LEU  33          HD23      LEU  33  38.397  -2.043   1.465
  247    H    GLN  34           H        GLN  34  42.021  -5.496  -0.697
  248    HA   GLN  34           HA       GLN  34  41.419  -7.655   0.729
  249    HB2  GLN  34           HB2      GLN  34  42.214  -7.211  -1.836
  250    HB3  GLN  34           HB3      GLN  34  43.465  -8.306  -1.266
  251    HG2  GLN  34           HG2      GLN  34  42.031  -9.899  -1.896
  252    HG3  GLN  34           HG3      GLN  34  41.251  -9.556  -0.353
  253   HE21  GLN  34          HE21      GLN  34  40.334  -6.930  -1.273
  254   HE22  GLN  34          HE22      GLN  34  38.995  -7.238  -2.320
  255    H    THR  35           H        THR  35  44.613  -6.255   0.629
  256    HA   THR  35           HA       THR  35  45.917  -8.494   1.894
  257    HB   THR  35           HB       THR  35  47.262  -5.938   2.259
  258    HG1  THR  35           HG1      THR  35  46.345  -6.628  -0.324
  259   HG21  THR  35          HG21      THR  35  48.780  -7.242   0.481
  260   HG22  THR  35          HG22      THR  35  47.874  -8.595   1.159
  261   HG23  THR  35          HG23      THR  35  48.823  -7.549   2.217
  262    H    LYS  36           H        LYS  36  45.348  -5.183   2.936
  263    HA   LYS  36           HA       LYS  36  45.602  -5.800   5.724
  264    HB2  LYS  36           HB2      LYS  36  44.780  -3.319   4.227
  265    HB3  LYS  36           HB3      LYS  36  44.827  -3.389   5.984
  266    HG2  LYS  36           HG2      LYS  36  46.902  -2.576   5.649
  267    HG3  LYS  36           HG3      LYS  36  47.290  -4.287   5.459
  268    HD2  LYS  36           HD2      LYS  36  47.442  -4.128   3.154
  269    HD3  LYS  36           HD3      LYS  36  46.436  -2.680   3.085
  270    HE2  LYS  36           HE2      LYS  36  48.300  -1.473   2.983
  271    HE3  LYS  36           HE3      LYS  36  48.649  -1.973   4.637
  272    HZ1  LYS  36           HZ1      LYS  36  50.402  -3.061   3.881
  273    HZ2  LYS  36           HZ2      LYS  36  50.037  -2.628   2.288
  274    HZ3  LYS  36           HZ3      LYS  36  49.407  -4.055   2.942
  275    H    ASN  37           H        ASN  37  43.549  -7.383   4.588
  276    HA   ASN  37           HA       ASN  37  41.363  -7.991   4.794
  277    HB2  ASN  37           HB2      ASN  37  40.402  -7.288   7.130
  278    HB3  ASN  37           HB3      ASN  37  41.734  -8.442   7.036
  279   HD21  ASN  37          HD21      ASN  37  40.705  -5.352   8.086
  280   HD22  ASN  37          HD22      ASN  37  42.176  -4.873   8.853
  281    H    TYR  38           H        TYR  38  41.518  -5.836   3.173
  282    HA   TYR  38           HA       TYR  38  40.327  -4.089   2.294
  283    HD1  TYR  38           HD2      TYR  38  39.085  -7.543   3.432
  284    HD2  TYR  38           HD1      TYR  38  37.588  -4.804   0.545
  285    HE1  TYR  38           HE2      TYR  38  38.801  -9.388   1.835
  286    HE2  TYR  38           HE1      TYR  38  37.294  -6.638  -1.055
  287    HH   TYR  38           HH       TYR  38  36.997  -9.530  -0.511
  288    HB2  TYR  38           HB2      TYR  38  38.146  -5.255   4.038
  289    HB3  TYR  38           HB3      TYR  38  37.896  -4.091   2.744
  290    H    ASP  39           H        ASP  39  41.855  -2.816   3.777
  291    HA   ASP  39           HA       ASP  39  40.232  -1.349   5.758
  292    HB2  ASP  39           HB2      ASP  39  42.025  -1.164   7.193
  293    HB3  ASP  39           HB3      ASP  39  42.341  -2.741   6.472
  294    H    ILE  40           H        ILE  40  39.824   0.722   5.350
  295    HA   ILE  40           HA       ILE  40  41.081   2.014   3.113
  296    HB   ILE  40           HB       ILE  40  39.548   3.820   3.456
  297   HG12  ILE  40          HG12      ILE  40  39.834   3.743   6.003
  298   HG13  ILE  40          HG13      ILE  40  38.242   4.173   5.386
  299   HG21  ILE  40          HG21      ILE  40  38.444   1.064   3.676
  300   HG22  ILE  40          HG22      ILE  40  38.371   2.207   2.337
  301   HG23  ILE  40          HG23      ILE  40  37.340   2.437   3.748
  302   HD11  ILE  40          HD11      ILE  40  39.127   1.757   6.844
  303   HD12  ILE  40          HD12      ILE  40  37.857   1.566   5.637
  304   HD13  ILE  40          HD13      ILE  40  37.635   2.686   6.981
  305    H    GLY  41           H        GLY  41  41.494   1.746   6.472
  306    HA2  GLY  41           HA2      GLY  41  42.520   4.148   7.245
  307    HA3  GLY  41           HA3      GLY  41  43.105   2.611   7.849
  308    H    ALA  42           H        ALA  42  43.900   1.741   5.237
  309    HA   ALA  42           HA       ALA  42  46.414   3.216   5.015
  310    HB1  ALA  42           HB1      ALA  42  47.418   1.285   4.169
  311    HB2  ALA  42           HB2      ALA  42  45.874   0.582   3.694
  312    HB3  ALA  42           HB3      ALA  42  46.316   0.667   5.398
  313    H    ALA  43           H        ALA  43  43.559   2.269   3.319
  314    HA   ALA  43           HA       ALA  43  44.201   2.706   0.696
  315    HB1  ALA  43           HB1      ALA  43  41.956   2.026   1.516
  316    HB2  ALA  43           HB2      ALA  43  41.893   3.311   0.316
  317    HB3  ALA  43           HB3      ALA  43  41.670   3.692   2.023
  318    H    LEU  44           H        LEU  44  42.644   5.239   2.640
  319    HA   LEU  44           HA       LEU  44  43.007   7.466   1.275
  320    HG   LEU  44           HG       LEU  44  41.481   8.819   3.044
  321    HB2  LEU  44           HB2      LEU  44  43.570   6.984   4.183
  322    HB3  LEU  44           HB3      LEU  44  43.771   8.586   3.495
  323   HD11  LEU  44          HD11      LEU  44  41.115   6.640   2.014
  324   HD12  LEU  44          HD12      LEU  44  39.864   7.004   3.201
  325   HD13  LEU  44          HD13      LEU  44  41.156   5.875   3.602
  326   HD21  LEU  44          HD21      LEU  44  40.648   8.901   5.150
  327   HD22  LEU  44          HD22      LEU  44  42.329   8.557   5.556
  328   HD23  LEU  44          HD23      LEU  44  41.143   7.252   5.532
  329    H    ASP  45           H        ASP  45  45.631   5.809   2.968
  330    HA   ASP  45           HA       ASP  45  47.727   7.543   2.662
  331    HB2  ASP  45           HB2      ASP  45  47.625   5.142   3.656
  332    HB3  ASP  45           HB3      ASP  45  48.107   4.633   2.041
  333    H    THR  46           H        THR  46  46.577   5.199   0.303
  334    HA   THR  46           HA       THR  46  48.324   6.325  -1.751
  335    HB   THR  46           HB       THR  46  47.671   4.356  -3.095
  336    HG1  THR  46           HG1      THR  46  45.616   4.001  -2.228
  337   HG21  THR  46          HG21      THR  46  48.809   3.978  -0.367
  338   HG22  THR  46          HG22      THR  46  49.596   3.868  -1.942
  339   HG23  THR  46          HG23      THR  46  48.512   2.583  -1.406
  340    H    ILE  47           H        ILE  47  44.880   5.898  -1.115
  341    HA   ILE  47           HA       ILE  47  43.989   6.614  -3.686
  342    HB   ILE  47           HB       ILE  47  42.005   7.533  -1.896
  343   HG12  ILE  47          HG12      ILE  47  43.114   4.839  -1.095
  344   HG13  ILE  47          HG13      ILE  47  43.251   6.311  -0.142
  345   HG21  ILE  47          HG21      ILE  47  41.617   4.841  -2.887
  346   HG22  ILE  47          HG22      ILE  47  42.256   5.919  -4.128
  347   HG23  ILE  47          HG23      ILE  47  40.761   6.331  -3.288
  348   HD11  ILE  47          HD11      ILE  47  40.848   4.645  -0.712
  349   HD12  ILE  47          HD12      ILE  47  40.667   6.351  -0.303
  350   HD13  ILE  47          HD13      ILE  47  41.455   5.250   0.829
  351    H    GLN  48           H        GLN  48  44.525   8.683  -0.839
  352    HA   GLN  48           HA       GLN  48  44.804  10.949  -2.623
  353    HB2  GLN  48           HB2      GLN  48  42.634  10.860  -0.525
  354    HB3  GLN  48           HB3      GLN  48  43.165  12.329  -1.332
  355    HG2  GLN  48           HG2      GLN  48  41.407  11.832  -2.658
  356    HG3  GLN  48           HG3      GLN  48  42.637  10.877  -3.488
  357   HE21  GLN  48          HE21      GLN  48  40.988   9.531  -4.305
  358   HE22  GLN  48          HE22      GLN  48  40.245   8.320  -3.309
  359    H    TYR  49           H        TYR  49  44.483  10.018   0.796
  360    HA   TYR  49           HA       TYR  49  46.170  12.115   1.740
  361    HD1  TYR  49           HD1      TYR  49  42.985  10.101   2.127
  362    HD2  TYR  49           HD2      TYR  49  45.107  12.616   4.825
  363    HE1  TYR  49           HE1      TYR  49  40.884  11.224   2.723
  364    HE2  TYR  49           HE2      TYR  49  43.009  13.747   5.429
  365    HH   TYR  49           HH       TYR  49  40.553  13.206   5.403
  366    HB2  TYR  49           HB2      TYR  49  45.280   9.519   3.011
  367    HB3  TYR  49           HB3      TYR  49  46.198  10.760   3.856
  368    H    SER  50           H        SER  50  48.330  12.218   1.441
  369    HA   SER  50           HA       SER  50  49.790   9.660   1.270
  370    HG   SER  50           HG       SER  50  52.119  11.025  -1.045
  371    HB2  SER  50           HB2      SER  50  49.703  10.950  -0.886
  372    HB3  SER  50           HB3      SER  50  50.583  12.251  -0.086
  373    H    LYS  51           H        LYS  51  49.525  10.402   3.732
  374    HA   LYS  51           HA       LYS  51  52.138  10.989   4.639
  375    HB2  LYS  51           HB2      LYS  51  50.449  13.251   4.172
  376    HB3  LYS  51           HB3      LYS  51  50.679  13.076   5.906
  377    HG2  LYS  51           HG2      LYS  51  52.978  13.379   5.759
  378    HG3  LYS  51           HG3      LYS  51  53.013  13.000   4.037
  379    HD2  LYS  51           HD2      LYS  51  51.406  15.343   4.893
  380    HD3  LYS  51           HD3      LYS  51  53.163  15.496   4.950
  381    HE2  LYS  51           HE2      LYS  51  52.041  14.314   2.491
  382    HE3  LYS  51           HE3      LYS  51  51.678  16.018   2.762
  383    HZ1  LYS  51           HZ1      LYS  51  54.442  15.241   3.181
  384    HZ2  LYS  51           HZ2      LYS  51  53.806  16.612   2.423
  385    HZ3  LYS  51           HZ3      LYS  51  53.898  15.149   1.580
  386    H    HIS  52           H        HIS  52  51.944  11.512   7.172
  387    HA   HIS  52           HA       HIS  52  49.895   9.666   8.201
  388    HD1  HIS  52           HD1      HIS  52  52.850   7.348   7.629
  389    HD2  HIS  52           HD2      HIS  52  50.105   7.764  10.720
  390    HE1  HIS  52           HE1      HIS  52  52.018   5.019   8.158
  391    HB2  HIS  52           HB2      HIS  52  52.752   9.696   8.542
  392    HB3  HIS  52           HB3      HIS  52  51.971   9.892  10.107
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1  25.553 -16.666   0.543
    2    H2   GLY   1           2H       GLY   1  24.544 -16.041   1.748
    3    H3   GLY   1           3H       GLY   1  24.941 -17.685   1.747
    4    HA2  GLY   1           HA2      GLY   1  26.236 -16.631   3.429
    5    HA3  GLY   1           HA3      GLY   1  27.290 -17.106   2.107
    6    H    SER   2           H        SER   2  28.870 -15.593   2.439
    7    HA   SER   2           HA       SER   2  28.115 -12.772   2.495
    8    HG   SER   2           HG       SER   2  29.903 -11.409   3.266
    9    HB2  SER   2           HB2      SER   2  30.089 -14.185   3.821
   10    HB3  SER   2           HB3      SER   2  30.979 -13.361   2.541
   11    HA   PRO   3           HA       PRO   3  29.268 -12.756  -1.850
   12    HB2  PRO   3           HB2      PRO   3  27.491 -10.846  -2.566
   13    HB3  PRO   3           HB3      PRO   3  27.026 -12.528  -2.305
   14    HG2  PRO   3           HG2      PRO   3  26.431 -10.167  -0.681
   15    HG3  PRO   3           HG3      PRO   3  25.666 -11.762  -0.661
   16    HD2  PRO   3           HD2      PRO   3  27.694 -10.692   1.118
   17    HD3  PRO   3           HD3      PRO   3  26.797 -12.215   1.247
   18    HA   PRO   4           HA       PRO   4  32.089  -9.339  -1.780
   19    HB2  PRO   4           HB2      PRO   4  32.497  -9.062  -4.462
   20    HB3  PRO   4           HB3      PRO   4  33.227 -10.349  -3.497
   21    HG2  PRO   4           HG2      PRO   4  30.799 -10.438  -5.245
   22    HG3  PRO   4           HG3      PRO   4  32.105 -11.627  -5.081
   23    HD2  PRO   4           HD2      PRO   4  29.714 -11.940  -3.869
   24    HD3  PRO   4           HD3      PRO   4  31.226 -12.510  -3.136
   25    H    GLU   5           H        GLU   5  30.246  -7.978  -1.010
   26    HA   GLU   5           HA       GLU   5  30.088  -5.566  -2.251
   27    HB2  GLU   5           HB2      GLU   5  27.598  -5.834  -3.138
   28    HB3  GLU   5           HB3      GLU   5  28.992  -6.126  -4.169
   29    HG2  GLU   5           HG2      GLU   5  28.372  -8.219  -4.506
   30    HG3  GLU   5           HG3      GLU   5  28.306  -8.526  -2.771
   31    H    ALA   6           H        ALA   6  30.237  -5.590   0.162
   32    HA   ALA   6           HA       ALA   6  29.000  -4.259   1.752
   33    HB1  ALA   6           HB1      ALA   6  26.721  -6.161   1.267
   34    HB2  ALA   6           HB2      ALA   6  26.854  -4.547   0.568
   35    HB3  ALA   6           HB3      ALA   6  26.727  -4.744   2.316
   36    H    ASP   7           H        ASP   7  30.833  -6.465   1.806
   37    HA   ASP   7           HA       ASP   7  29.939  -8.092   4.057
   38    HB2  ASP   7           HB2      ASP   7  32.657  -8.133   2.726
   39    HB3  ASP   7           HB3      ASP   7  31.939  -9.378   3.744
   40    HA   PRO   8           HA       PRO   8  31.533  -5.868   7.511
   41    HB2  PRO   8           HB2      PRO   8  33.709  -7.937   7.474
   42    HB3  PRO   8           HB3      PRO   8  32.832  -7.264   8.855
   43    HG2  PRO   8           HG2      PRO   8  32.187  -9.653   7.746
   44    HG3  PRO   8           HG3      PRO   8  30.991  -8.594   8.510
   45    HD2  PRO   8           HD2      PRO   8  31.287  -9.296   5.695
   46    HD3  PRO   8           HD3      PRO   8  29.955  -8.438   6.495
   47    H    ARG   9           H        ARG   9  34.271  -7.219   5.661
   48    HA   ARG   9           HA       ARG   9  35.923  -4.962   5.998
   49    HE   ARG   9           HE       ARG   9  38.335  -9.725   5.410
   50    HB2  ARG   9           HB2      ARG   9  36.145  -6.967   3.762
   51    HB3  ARG   9           HB3      ARG   9  37.439  -6.045   4.527
   52    HG2  ARG   9           HG2      ARG   9  37.797  -7.719   5.925
   53    HG3  ARG   9           HG3      ARG   9  36.154  -7.555   6.548
   54    HD2  ARG   9           HD2      ARG   9  35.676  -9.543   5.681
   55    HD3  ARG   9           HD3      ARG   9  35.924  -8.861   4.074
   56   HH11  ARG   9          HH11      ARG   9  35.728 -10.592   3.271
   57   HH12  ARG   9          HH12      ARG   9  36.586 -11.913   2.549
   58   HH21  ARG   9          HH21      ARG   9  39.474 -11.463   4.468
   59   HH22  ARG   9          HH22      ARG   9  38.716 -12.408   3.231
   60    H    LEU  10           H        LEU  10  33.772  -5.935   3.338
   61    HA   LEU  10           HA       LEU  10  34.608  -3.708   1.722
   62    HG   LEU  10           HG       LEU  10  34.021  -6.999   0.168
   63    HB2  LEU  10           HB2      LEU  10  32.521  -5.837   1.348
   64    HB3  LEU  10           HB3      LEU  10  32.757  -4.534   0.199
   65   HD11  LEU  10          HD11      LEU  10  33.687  -4.901  -1.502
   66   HD12  LEU  10          HD12      LEU  10  34.701  -6.302  -1.850
   67   HD13  LEU  10          HD13      LEU  10  35.426  -4.825  -1.212
   68   HD21  LEU  10          HD21      LEU  10  35.984  -4.901   1.107
   69   HD22  LEU  10          HD22      LEU  10  36.407  -6.494   0.479
   70   HD23  LEU  10          HD23      LEU  10  35.508  -6.353   1.989
   71    H    ILE  11           H        ILE  11  32.337  -4.181   4.162
   72    HA   ILE  11           HA       ILE  11  30.685  -1.936   3.267
   73    HB   ILE  11           HB       ILE  11  29.696  -4.083   4.332
   74   HG12  ILE  11          HG12      ILE  11  28.590  -1.900   5.922
   75   HG13  ILE  11          HG13      ILE  11  28.846  -1.449   4.240
   76   HG21  ILE  11          HG21      ILE  11  31.145  -4.326   6.212
   77   HG22  ILE  11          HG22      ILE  11  29.536  -3.940   6.822
   78   HG23  ILE  11          HG23      ILE  11  30.782  -2.694   6.773
   79   HD11  ILE  11          HD11      ILE  11  27.626  -4.044   4.414
   80   HD12  ILE  11          HD12      ILE  11  27.056  -2.583   3.607
   81   HD13  ILE  11          HD13      ILE  11  26.692  -2.848   5.312
   82    H    GLU  12           H        GLU  12  33.248  -2.824   5.242
   83    HA   GLU  12           HA       GLU  12  33.166  -0.374   6.839
   84    HB2  GLU  12           HB2      GLU  12  34.941  -2.813   7.016
   85    HB3  GLU  12           HB3      GLU  12  35.104  -1.397   8.046
   86    HG2  GLU  12           HG2      GLU  12  32.415  -2.561   7.966
   87    HG3  GLU  12           HG3      GLU  12  33.658  -3.599   8.661
   88    H    SER  13           H        SER  13  35.501  -2.208   4.856
   89    HA   SER  13           HA       SER  13  37.069   0.214   4.493
   90    HG   SER  13           HG       SER  13  37.723  -3.404   5.029
   91    HB2  SER  13           HB2      SER  13  37.946  -2.327   3.249
   92    HB3  SER  13           HB3      SER  13  38.873  -1.119   4.140
   93    H    LEU  14           H        LEU  14  35.230  -2.071   2.414
   94    HA   LEU  14           HA       LEU  14  36.215  -0.841   0.025
   95    HG   LEU  14           HG       LEU  14  34.026  -3.131  -2.010
   96    HB2  LEU  14           HB2      LEU  14  35.428  -3.122  -0.084
   97    HB3  LEU  14           HB3      LEU  14  33.830  -2.633   0.418
   98   HD11  LEU  14          HD11      LEU  14  32.514  -1.509  -2.621
   99   HD12  LEU  14          HD12      LEU  14  33.348  -0.240  -1.723
  100   HD13  LEU  14          HD13      LEU  14  32.402  -1.453  -0.862
  101   HD21  LEU  14          HD21      LEU  14  36.225  -1.291  -1.771
  102   HD22  LEU  14          HD22      LEU  14  35.072  -0.732  -2.982
  103   HD23  LEU  14          HD23      LEU  14  35.780  -2.342  -3.114
  104    H    SER  15           H        SER  15  32.903  -0.792   1.419
  105    HA   SER  15           HA       SER  15  31.836   1.171  -0.168
  106    HG   SER  15           HG       SER  15  30.179   2.642   2.211
  107    HB2  SER  15           HB2      SER  15  30.636  -0.049   1.694
  108    HB3  SER  15           HB3      SER  15  31.432   1.037   2.835
  109    H    GLN  16           H        GLN  16  33.553   1.634   2.903
  110    HA   GLN  16           HA       GLN  16  33.750   4.367   2.981
  111    HB2  GLN  16           HB2      GLN  16  34.664   2.544   4.600
  112    HB3  GLN  16           HB3      GLN  16  36.135   2.661   3.645
  113    HG2  GLN  16           HG2      GLN  16  34.978   5.190   4.610
  114    HG3  GLN  16           HG3      GLN  16  35.671   4.124   5.827
  115   HE21  GLN  16          HE21      GLN  16  36.317   6.002   2.957
  116   HE22  GLN  16          HE22      GLN  16  38.033   6.071   3.149
  117    H    MET  17           H        MET  17  35.456   2.097   0.942
  118    HA   MET  17           HA       MET  17  37.393   3.956  -0.017
  119    HB2  MET  17           HB2      MET  17  37.401   1.341  -0.090
  120    HB3  MET  17           HB3      MET  17  36.492   1.558  -1.579
  121    HG2  MET  17           HG2      MET  17  38.549   1.527  -2.486
  122    HG3  MET  17           HG3      MET  17  38.511   3.237  -2.064
  123    HE1  MET  17           HE1      MET  17  38.624   2.349   1.309
  124    HE2  MET  17           HE2      MET  17  39.158   3.875   0.605
  125    HE3  MET  17           HE3      MET  17  40.282   2.899   1.550
  126    H    LEU  18           H        LEU  18  34.221   2.824  -1.108
  127    HA   LEU  18           HA       LEU  18  34.334   4.674  -3.376
  128    HG   LEU  18           HG       LEU  18  34.662   1.868  -3.757
  129    HB2  LEU  18           HB2      LEU  18  32.428   2.454  -2.664
  130    HB3  LEU  18           HB3      LEU  18  32.173   3.542  -4.015
  131   HD11  LEU  18          HD11      LEU  18  33.588   0.312  -5.352
  132   HD12  LEU  18          HD12      LEU  18  32.065   1.171  -5.117
  133   HD13  LEU  18          HD13      LEU  18  32.817   0.324  -3.765
  134   HD21  LEU  18          HD21      LEU  18  35.220   3.248  -5.435
  135   HD22  LEU  18          HD22      LEU  18  33.553   3.754  -5.707
  136   HD23  LEU  18          HD23      LEU  18  34.140   2.242  -6.400
  137    H    SER  19           H        SER  19  31.719   3.706  -1.165
  138    HA   SER  19           HA       SER  19  30.196   5.999  -1.466
  139    HG   SER  19           HG       SER  19  28.539   3.134  -0.401
  140    HB2  SER  19           HB2      SER  19  30.179   4.277   1.004
  141    HB3  SER  19           HB3      SER  19  28.838   5.175   0.293
  142    H    MET  20           H        MET  20  33.176   6.135  -0.084
  143    HA   MET  20           HA       MET  20  32.354   8.020   2.000
  144    HB2  MET  20           HB2      MET  20  34.123   6.201   2.400
  145    HB3  MET  20           HB3      MET  20  35.194   7.209   1.432
  146    HG2  MET  20           HG2      MET  20  35.699   7.884   3.567
  147    HG3  MET  20           HG3      MET  20  34.502   9.083   3.083
  148    HE1  MET  20           HE1      MET  20  34.170   8.419   6.907
  149    HE2  MET  20           HE2      MET  20  35.450   8.773   5.748
  150    HE3  MET  20           HE3      MET  20  35.281   7.144   6.403
  151    H    GLY  21           H        GLY  21  33.465   7.897  -1.200
  152    HA2  GLY  21           HA2      GLY  21  33.228   9.991  -2.449
  153    HA3  GLY  21           HA3      GLY  21  34.026  10.794  -1.102
  154    H    PHE  22           H        PHE  22  35.358   7.728  -1.911
  155    HA   PHE  22           HA       PHE  22  37.370   8.978  -3.628
  156    HD1  PHE  22           HD2      PHE  22  36.328   8.759  -0.133
  157    HD2  PHE  22           HD1      PHE  22  40.258   9.678  -1.477
  158    HE1  PHE  22           HE2      PHE  22  36.463  10.580   1.516
  159    HE2  PHE  22           HE1      PHE  22  40.402  11.500   0.168
  160    HZ   PHE  22           HZ       PHE  22  38.503  11.954   1.668
  161    HB2  PHE  22           HB2      PHE  22  38.026   7.064  -1.378
  162    HB3  PHE  22           HB3      PHE  22  39.164   7.916  -2.418
  163    H    SER  23           H        SER  23  38.931   6.923  -4.212
  164    HA   SER  23           HA       SER  23  37.382   4.542  -4.685
  165    HG   SER  23           HG       SER  23  35.709   5.544  -6.420
  166    HB2  SER  23           HB2      SER  23  38.396   6.159  -7.042
  167    HB3  SER  23           HB3      SER  23  37.580   4.597  -7.127
  168    H    ASP  24           H        ASP  24  39.444   4.213  -7.081
  169    HA   ASP  24           HA       ASP  24  41.738   3.561  -5.351
  170    HB2  ASP  24           HB2      ASP  24  42.096   1.803  -7.331
  171    HB3  ASP  24           HB3      ASP  24  41.100   1.433  -5.921
  172    H    GLU  25           H        GLU  25  43.435   4.811  -5.821
  173    HA   GLU  25           HA       GLU  25  43.682   6.636  -7.805
  174    HB2  GLU  25           HB2      GLU  25  45.286   6.594  -6.030
  175    HB3  GLU  25           HB3      GLU  25  45.854   5.002  -6.512
  176    HG2  GLU  25           HG2      GLU  25  47.509   6.261  -7.401
  177    HG3  GLU  25           HG3      GLU  25  46.392   6.264  -8.764
  178    H    GLY  26           H        GLY  26  45.749   3.846  -8.011
  179    HA2  GLY  26           HA2      GLY  26  45.174   3.714 -10.901
  180    HA3  GLY  26           HA3      GLY  26  46.740   3.364 -10.182
  181    H    GLY  27           H        GLY  27  43.661   2.289  -8.880
  182    HA2  GLY  27           HA2      GLY  27  42.700   0.186  -8.806
  183    HA3  GLY  27           HA3      GLY  27  43.846  -0.339 -10.033
  184    H    TRP  28           H        TRP  28  44.351   1.010  -6.811
  185    HA   TRP  28           HA       TRP  28  46.098  -1.246  -6.226
  186    HD1  TRP  28           HD1      TRP  28  46.518   3.240  -6.104
  187    HE1  TRP  28           HE1      TRP  28  45.020   4.897  -4.847
  188    HE3  TRP  28           HE3      TRP  28  44.425   0.069  -2.686
  189    HZ2  TRP  28           HZ2      TRP  28  43.202   4.887  -2.713
  190    HZ3  TRP  28           HZ3      TRP  28  42.812   0.983  -1.068
  191    HH2  TRP  28           HH2      TRP  28  42.211   3.351  -1.091
  192    HB2  TRP  28           HB2      TRP  28  46.812   0.102  -4.230
  193    HB3  TRP  28           HB3      TRP  28  47.192   0.814  -5.796
  194    H    LEU  29           H        LEU  29  43.153   0.303  -5.093
  195    HA   LEU  29           HA       LEU  29  42.743  -0.721  -2.638
  196    HG   LEU  29           HG       LEU  29  40.207  -2.331  -3.210
  197    HB2  LEU  29           HB2      LEU  29  40.901   0.425  -3.265
  198    HB3  LEU  29           HB3      LEU  29  40.964  -0.152  -4.921
  199   HD11  LEU  29          HD11      LEU  29  39.481  -0.070  -1.952
  200   HD12  LEU  29          HD12      LEU  29  38.554  -1.569  -1.893
  201   HD13  LEU  29          HD13      LEU  29  38.096  -0.293  -3.021
  202   HD21  LEU  29          HD21      LEU  29  38.012  -1.804  -4.625
  203   HD22  LEU  29          HD22      LEU  29  39.435  -2.576  -5.327
  204   HD23  LEU  29          HD23      LEU  29  39.170  -0.847  -5.549
  205    H    THR  30           H        THR  30  41.773  -2.530  -5.558
  206    HA   THR  30           HA       THR  30  41.145  -4.931  -4.470
  207    HB   THR  30           HB       THR  30  42.749  -4.436  -6.984
  208    HG1  THR  30           HG1      THR  30  39.981  -4.884  -6.563
  209   HG21  THR  30          HG21      THR  30  41.478  -6.659  -7.599
  210   HG22  THR  30          HG22      THR  30  41.638  -6.944  -5.866
  211   HG23  THR  30          HG23      THR  30  43.076  -6.675  -6.852
  212    H    ARG  31           H        ARG  31  44.352  -3.577  -4.840
  213    HA   ARG  31           HA       ARG  31  45.561  -6.013  -3.769
  214    HE   ARG  31           HE       ARG  31  49.644  -4.007  -6.333
  215    HB2  ARG  31           HB2      ARG  31  47.727  -4.551  -4.124
  216    HB3  ARG  31           HB3      ARG  31  46.969  -5.412  -5.451
  217    HG2  ARG  31           HG2      ARG  31  45.729  -3.213  -5.897
  218    HG3  ARG  31           HG3      ARG  31  46.956  -2.489  -4.855
  219    HD2  ARG  31           HD2      ARG  31  47.569  -4.195  -7.259
  220    HD3  ARG  31           HD3      ARG  31  47.469  -2.439  -7.301
  221   HH11  ARG  31          HH11      ARG  31  47.948  -1.000  -5.903
  222   HH12  ARG  31          HH12      ARG  31  49.321  -0.164  -5.260
  223   HH21  ARG  31          HH21      ARG  31  51.466  -2.920  -5.490
  224   HH22  ARG  31          HH22      ARG  31  51.326  -1.257  -5.026
  225    H    LEU  32           H        LEU  32  46.008  -2.508  -3.149
  226    HA   LEU  32           HA       LEU  32  47.281  -2.456  -0.802
  227    HG   LEU  32           HG       LEU  32  46.219   1.020  -0.415
  228    HB2  LEU  32           HB2      LEU  32  46.103  -0.576  -2.122
  229    HB3  LEU  32           HB3      LEU  32  44.722  -0.903  -1.090
  230   HD11  LEU  32          HD11      LEU  32  46.145  -0.925   1.821
  231   HD12  LEU  32          HD12      LEU  32  44.625  -0.496   1.034
  232   HD13  LEU  32          HD13      LEU  32  45.627   0.760   1.760
  233   HD21  LEU  32          HD21      LEU  32  48.246   0.464   0.820
  234   HD22  LEU  32          HD22      LEU  32  48.361  -0.047  -0.864
  235   HD23  LEU  32          HD23      LEU  32  48.043  -1.237   0.400
  236    H    LEU  33           H        LEU  33  43.729  -2.446  -0.757
  237    HA   LEU  33           HA       LEU  33  43.357  -3.112   1.892
  238    HG   LEU  33           HG       LEU  33  41.214  -2.065   2.127
  239    HB2  LEU  33           HB2      LEU  33  41.745  -3.282  -0.588
  240    HB3  LEU  33           HB3      LEU  33  41.155  -4.175   0.806
  241   HD11  LEU  33          HD11      LEU  33  42.261  -1.037  -0.455
  242   HD12  LEU  33          HD12      LEU  33  42.686  -0.594   1.197
  243   HD13  LEU  33          HD13      LEU  33  41.190   0.004   0.481
  244   HD21  LEU  33          HD21      LEU  33  39.499  -1.178  -0.015
  245   HD22  LEU  33          HD22      LEU  33  39.076  -1.805   1.578
  246   HD23  LEU  33          HD23      LEU  33  39.350  -2.917   0.238
  247    H    GLN  34           H        GLN  34  43.015  -5.358  -0.836
  248    HA   GLN  34           HA       GLN  34  42.545  -7.712   0.329
  249    HB2  GLN  34           HB2      GLN  34  44.092  -6.891  -2.029
  250    HB3  GLN  34           HB3      GLN  34  44.359  -8.544  -1.488
  251    HG2  GLN  34           HG2      GLN  34  42.565  -8.197  -3.235
  252    HG3  GLN  34           HG3      GLN  34  42.110  -9.128  -1.809
  253   HE21  GLN  34          HE21      GLN  34  40.575  -8.352  -0.440
  254   HE22  GLN  34          HE22      GLN  34  39.649  -6.927  -0.748
  255    H    THR  35           H        THR  35  45.566  -6.004   0.665
  256    HA   THR  35           HA       THR  35  46.844  -8.387   1.793
  257    HB   THR  35           HB       THR  35  48.662  -6.366   2.130
  258    HG1  THR  35           HG1      THR  35  47.563  -5.853  -0.400
  259   HG21  THR  35          HG21      THR  35  48.329  -8.584   0.363
  260   HG22  THR  35          HG22      THR  35  49.814  -7.835   0.954
  261   HG23  THR  35          HG23      THR  35  49.040  -7.224  -0.509
  262    H    LYS  36           H        LYS  36  46.740  -4.999   2.821
  263    HA   LYS  36           HA       LYS  36  47.144  -5.614   5.549
  264    HB2  LYS  36           HB2      LYS  36  46.155  -3.098   4.214
  265    HB3  LYS  36           HB3      LYS  36  46.531  -3.209   5.928
  266    HG2  LYS  36           HG2      LYS  36  48.631  -2.713   5.459
  267    HG3  LYS  36           HG3      LYS  36  48.762  -4.232   4.568
  268    HD2  LYS  36           HD2      LYS  36  48.646  -3.210   2.563
  269    HD3  LYS  36           HD3      LYS  36  47.433  -2.052   3.113
  270    HE2  LYS  36           HE2      LYS  36  49.053  -0.523   3.096
  271    HE3  LYS  36           HE3      LYS  36  49.717  -1.344   4.506
  272    HZ1  LYS  36           HZ1      LYS  36  51.509  -1.380   3.129
  273    HZ2  LYS  36           HZ2      LYS  36  50.586  -1.452   1.714
  274    HZ3  LYS  36           HZ3      LYS  36  50.791  -2.839   2.660
  275    H    ASN  37           H        ASN  37  44.840  -7.116   4.625
  276    HA   ASN  37           HA       ASN  37  42.708  -7.639   5.190
  277    HB2  ASN  37           HB2      ASN  37  42.298  -6.424   7.673
  278    HB3  ASN  37           HB3      ASN  37  42.886  -8.062   7.387
  279   HD21  ASN  37          HD21      ASN  37  43.656  -4.900   8.450
  280   HD22  ASN  37          HD22      ASN  37  45.298  -5.204   8.891
  281    H    TYR  38           H        TYR  38  42.327  -5.965   3.422
  282    HA   TYR  38           HA       TYR  38  41.285  -4.077   2.620
  283    HD1  TYR  38           HD1      TYR  38  40.026  -7.182   4.746
  284    HD2  TYR  38           HD2      TYR  38  38.476  -5.237   1.294
  285    HE1  TYR  38           HE1      TYR  38  39.581  -9.371   3.720
  286    HE2  TYR  38           HE2      TYR  38  38.026  -7.422   0.259
  287    HH   TYR  38           HH       TYR  38  37.840  -9.662   0.688
  288    HB2  TYR  38           HB2      TYR  38  39.272  -4.763   4.763
  289    HB3  TYR  38           HB3      TYR  38  38.962  -3.971   3.220
  290    H    ASP  39           H        ASP  39  43.210  -3.029   3.883
  291    HA   ASP  39           HA       ASP  39  42.391  -1.439   6.152
  292    HB2  ASP  39           HB2      ASP  39  44.706  -2.443   5.836
  293    HB3  ASP  39           HB3      ASP  39  44.976  -1.205   4.612
  294    H    ILE  40           H        ILE  40  41.539   0.500   6.061
  295    HA   ILE  40           HA       ILE  40  41.458   1.922   3.515
  296    HB   ILE  40           HB       ILE  40  40.040   3.560   4.994
  297   HG12  ILE  40          HG12      ILE  40  40.768   1.912   7.009
  298   HG13  ILE  40          HG13      ILE  40  39.288   2.861   7.024
  299   HG21  ILE  40          HG21      ILE  40  39.275   2.079   3.114
  300   HG22  ILE  40          HG22      ILE  40  38.055   2.435   4.337
  301   HG23  ILE  40          HG23      ILE  40  38.865   0.869   4.330
  302   HD11  ILE  40          HD11      ILE  40  39.484  -0.003   6.122
  303   HD12  ILE  40          HD12      ILE  40  38.013   0.954   6.292
  304   HD13  ILE  40          HD13      ILE  40  38.957   0.527   7.719
  305    H    GLY  41           H        GLY  41  42.569   2.179   6.814
  306    HA2  GLY  41           HA2      GLY  41  43.474   4.700   7.015
  307    HA3  GLY  41           HA3      GLY  41  44.334   3.348   7.706
  308    H    ALA  42           H        ALA  42  44.964   2.137   5.197
  309    HA   ALA  42           HA       ALA  42  47.106   3.964   4.366
  310    HB1  ALA  42           HB1      ALA  42  48.356   2.077   3.660
  311    HB2  ALA  42           HB2      ALA  42  46.946   1.022   3.753
  312    HB3  ALA  42           HB3      ALA  42  47.673   1.656   5.230
  313    H    ALA  43           H        ALA  43  44.300   2.332   3.297
  314    HA   ALA  43           HA       ALA  43  44.634   2.282   0.542
  315    HB1  ALA  43           HB1      ALA  43  42.090   2.891   2.049
  316    HB2  ALA  43           HB2      ALA  43  42.721   1.281   1.715
  317    HB3  ALA  43           HB3      ALA  43  42.210   2.313   0.390
  318    H    LEU  44           H        LEU  44  43.453   4.888   2.633
  319    HA   LEU  44           HA       LEU  44  42.848   6.776   0.699
  320    HG   LEU  44           HG       LEU  44  41.150   7.186   2.218
  321    HB2  LEU  44           HB2      LEU  44  43.825   7.026   3.528
  322    HB3  LEU  44           HB3      LEU  44  43.460   8.442   2.552
  323   HD11  LEU  44          HD11      LEU  44  41.418   5.199   3.362
  324   HD12  LEU  44          HD12      LEU  44  40.619   6.212   4.564
  325   HD13  LEU  44          HD13      LEU  44  42.360   5.946   4.652
  326   HD21  LEU  44          HD21      LEU  44  40.444   8.343   4.438
  327   HD22  LEU  44          HD22      LEU  44  41.051   9.317   3.099
  328   HD23  LEU  44          HD23      LEU  44  42.109   8.922   4.453
  329    H    ASP  45           H        ASP  45  45.809   6.592   2.619
  330    HA   ASP  45           HA       ASP  45  47.364   8.500   1.670
  331    HB2  ASP  45           HB2      ASP  45  48.339   7.053   3.237
  332    HB3  ASP  45           HB3      ASP  45  48.103   5.641   2.212
  333    H    THR  46           H        THR  46  46.426   5.728  -0.280
  334    HA   THR  46           HA       THR  46  48.270   6.562  -2.373
  335    HB   THR  46           HB       THR  46  47.384   4.457  -3.521
  336    HG1  THR  46           HG1      THR  46  45.547   4.460  -1.912
  337   HG21  THR  46          HG21      THR  46  49.431   3.967  -2.727
  338   HG22  THR  46          HG22      THR  46  48.503   3.001  -1.581
  339   HG23  THR  46          HG23      THR  46  49.082   4.602  -1.119
  340    H    ILE  47           H        ILE  47  45.023   7.190  -1.620
  341    HA   ILE  47           HA       ILE  47  44.278   7.442  -4.448
  342    HB   ILE  47           HB       ILE  47  42.123   8.442  -3.086
  343   HG12  ILE  47          HG12      ILE  47  43.336   6.216  -1.440
  344   HG13  ILE  47          HG13      ILE  47  43.052   7.872  -0.918
  345   HG21  ILE  47          HG21      ILE  47  41.322   6.952  -4.526
  346   HG22  ILE  47          HG22      ILE  47  41.617   5.719  -3.301
  347   HG23  ILE  47          HG23      ILE  47  42.835   6.044  -4.534
  348   HD11  ILE  47          HD11      ILE  47  40.752   6.242  -1.869
  349   HD12  ILE  47          HD12      ILE  47  40.795   7.563  -0.702
  350   HD13  ILE  47          HD13      ILE  47  41.404   5.970  -0.253
  351    H    GLN  48           H        GLN  48  44.779   9.452  -1.607
  352    HA   GLN  48           HA       GLN  48  45.418  11.720  -3.224
  353    HB2  GLN  48           HB2      GLN  48  42.775  11.592  -1.799
  354    HB3  GLN  48           HB3      GLN  48  43.584  13.134  -2.037
  355    HG2  GLN  48           HG2      GLN  48  42.358  13.164  -3.918
  356    HG3  GLN  48           HG3      GLN  48  43.687  12.190  -4.540
  357   HE21  GLN  48          HE21      GLN  48  41.024  11.327  -2.365
  358   HE22  GLN  48          HE22      GLN  48  40.376  10.072  -3.373
  359    H    TYR  49           H        TYR  49  43.972  11.308  -0.016
  360    HA   TYR  49           HA       TYR  49  45.735  13.035   1.314
  361    HD1  TYR  49           HD1      TYR  49  43.766  13.511   0.426
  362    HD2  TYR  49           HD2      TYR  49  42.031  11.391   3.680
  363    HE1  TYR  49           HE1      TYR  49  41.575  14.484  -0.115
  364    HE2  TYR  49           HE2      TYR  49  39.837  12.360   3.149
  365    HH   TYR  49           HH       TYR  49  39.402  14.981   1.213
  366    HB2  TYR  49           HB2      TYR  49  44.259  10.718   2.568
  367    HB3  TYR  49           HB3      TYR  49  44.750  12.224   3.337
  368    H    SER  50           H        SER  50  47.765  12.134   0.261
  369    HA   SER  50           HA       SER  50  48.754   9.648   1.354
  370    HG   SER  50           HG       SER  50  48.930  11.984  -1.300
  371    HB2  SER  50           HB2      SER  50  50.889  10.514   0.097
  372    HB3  SER  50           HB3      SER  50  49.504   9.922  -0.820
  373    H    LYS  51           H        LYS  51  48.169  11.516   3.375
  374    HA   LYS  51           HA       LYS  51  50.781  11.707   4.612
  375    HB2  LYS  51           HB2      LYS  51  49.509  13.995   3.474
  376    HB3  LYS  51           HB3      LYS  51  49.465  14.161   5.224
  377    HG2  LYS  51           HG2      LYS  51  51.839  13.990   5.374
  378    HG3  LYS  51           HG3      LYS  51  51.966  13.546   3.671
  379    HD2  LYS  51           HD2      LYS  51  52.582  15.878   3.997
  380    HD3  LYS  51           HD3      LYS  51  51.105  15.754   3.039
  381    HE2  LYS  51           HE2      LYS  51  50.315  17.286   4.477
  382    HE3  LYS  51           HE3      LYS  51  50.088  15.904   5.549
  383    HZ1  LYS  51           HZ1      LYS  51  52.537  17.580   5.497
  384    HZ2  LYS  51           HZ2      LYS  51  52.156  16.369   6.615
  385    HZ3  LYS  51           HZ3      LYS  51  51.261  17.804   6.586
  386    H    HIS  52           H        HIS  52  50.643  12.029   6.925
  387    HA   HIS  52           HA       HIS  52  48.087  11.043   7.955
  388    HD1  HIS  52           HD1      HIS  52  49.876   8.015  10.251
  389    HD2  HIS  52           HD2      HIS  52  49.967   9.342   6.315
  390    HE1  HIS  52           HE1      HIS  52  49.930   5.942   8.805
  391    HB2  HIS  52           HB2      HIS  52  50.897  10.925   9.047
  392    HB3  HIS  52           HB3      HIS  52  49.491  10.520  10.027
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  30.259 -17.731   4.972
    2    H2   GLY   1           2H       GLY   1  31.625 -18.722   4.844
    3    H3   GLY   1           3H       GLY   1  30.727 -18.337   3.463
    4    HA2  GLY   1           HA2      GLY   1  32.415 -16.516   5.083
    5    HA3  GLY   1           HA3      GLY   1  32.678 -17.008   3.416
    6    H    SER   2           H        SER   2  32.783 -14.717   2.958
    7    HA   SER   2           HA       SER   2  30.120 -13.462   2.830
    8    HG   SER   2           HG       SER   2  33.578 -12.585   3.862
    9    HB2  SER   2           HB2      SER   2  32.318 -11.610   2.436
   10    HB3  SER   2           HB3      SER   2  31.002 -11.551   3.610
   11    HA   PRO   3           HA       PRO   3  30.889 -13.827  -1.565
   12    HB2  PRO   3           HB2      PRO   3  28.365 -13.481  -2.364
   13    HB3  PRO   3           HB3      PRO   3  28.865 -14.960  -1.534
   14    HG2  PRO   3           HG2      PRO   3  27.354 -12.614  -0.485
   15    HG3  PRO   3           HG3      PRO   3  27.165 -14.334  -0.105
   16    HD2  PRO   3           HD2      PRO   3  28.550 -12.453   1.437
   17    HD3  PRO   3           HD3      PRO   3  28.678 -14.215   1.585
   18    HA   PRO   4           HA       PRO   4  31.377  -9.644  -2.890
   19    HB2  PRO   4           HB2      PRO   4  30.655 -10.539  -5.610
   20    HB3  PRO   4           HB3      PRO   4  32.161  -9.827  -5.024
   21    HG2  PRO   4           HG2      PRO   4  32.000 -12.422  -5.678
   22    HG3  PRO   4           HG3      PRO   4  33.011 -11.860  -4.333
   23    HD2  PRO   4           HD2      PRO   4  30.320 -13.169  -4.266
   24    HD3  PRO   4           HD3      PRO   4  31.718 -13.409  -3.197
   25    H    GLU   5           H        GLU   5  29.261  -9.215  -1.717
   26    HA   GLU   5           HA       GLU   5  27.456  -7.942  -3.579
   27    HB2  GLU   5           HB2      GLU   5  25.491  -9.096  -3.066
   28    HB3  GLU   5           HB3      GLU   5  26.683 -10.372  -3.261
   29    HG2  GLU   5           HG2      GLU   5  26.914 -10.566  -0.858
   30    HG3  GLU   5           HG3      GLU   5  25.782  -9.235  -0.625
   31    H    ALA   6           H        ALA   6  29.290  -7.294  -1.319
   32    HA   ALA   6           HA       ALA   6  29.174  -5.331  -0.029
   33    HB1  ALA   6           HB1      ALA   6  26.315  -5.997   0.634
   34    HB2  ALA   6           HB2      ALA   6  26.777  -4.998  -0.745
   35    HB3  ALA   6           HB3      ALA   6  27.170  -4.476   0.894
   36    H    ASP   7           H        ASP   7  30.640  -6.848   0.986
   37    HA   ASP   7           HA       ASP   7  29.554  -8.159   3.378
   38    HB2  ASP   7           HB2      ASP   7  32.408  -8.497   2.591
   39    HB3  ASP   7           HB3      ASP   7  31.285  -9.670   3.274
   40    HA   PRO   8           HA       PRO   8  30.996  -5.347   6.433
   41    HB2  PRO   8           HB2      PRO   8  33.023  -7.472   7.045
   42    HB3  PRO   8           HB3      PRO   8  32.041  -6.510   8.158
   43    HG2  PRO   8           HG2      PRO   8  31.390  -9.045   7.487
   44    HG3  PRO   8           HG3      PRO   8  30.172  -7.811   7.851
   45    HD2  PRO   8           HD2      PRO   8  30.817  -9.079   5.291
   46    HD3  PRO   8           HD3      PRO   8  29.396  -8.116   5.735
   47    H    ARG   9           H        ARG   9  33.646  -7.206   4.960
   48    HA   ARG   9           HA       ARG   9  35.705  -5.431   5.158
   49    HE   ARG   9           HE       ARG   9  36.014 -11.018   3.279
   50    HB2  ARG   9           HB2      ARG   9  35.029  -7.220   2.815
   51    HB3  ARG   9           HB3      ARG   9  36.606  -6.481   3.099
   52    HG2  ARG   9           HG2      ARG   9  36.772  -7.705   5.227
   53    HG3  ARG   9           HG3      ARG   9  35.228  -8.484   4.876
   54    HD2  ARG   9           HD2      ARG   9  36.647  -8.950   2.586
   55    HD3  ARG   9           HD3      ARG   9  37.902  -9.037   3.823
   56   HH11  ARG   9          HH11      ARG   9  37.320  -9.306   6.016
   57   HH12  ARG   9          HH12      ARG   9  37.069 -10.617   7.121
   58   HH21  ARG   9          HH21      ARG   9  35.680 -12.753   4.728
   59   HH22  ARG   9          HH22      ARG   9  36.137 -12.575   6.389
   60    H    LEU  10           H        LEU  10  33.346  -5.570   2.501
   61    HA   LEU  10           HA       LEU  10  34.368  -3.031   1.523
   62    HG   LEU  10           HG       LEU  10  35.261  -5.143   0.409
   63    HB2  LEU  10           HB2      LEU  10  32.529  -5.038   0.249
   64    HB3  LEU  10           HB3      LEU  10  32.991  -3.516  -0.495
   65   HD11  LEU  10          HD11      LEU  10  35.075  -6.951  -0.946
   66   HD12  LEU  10          HD12      LEU  10  34.021  -6.126  -2.096
   67   HD13  LEU  10          HD13      LEU  10  33.369  -6.712  -0.566
   68   HD21  LEU  10          HD21      LEU  10  34.600  -3.186  -1.606
   69   HD22  LEU  10          HD22      LEU  10  35.462  -4.559  -2.299
   70   HD23  LEU  10          HD23      LEU  10  36.173  -3.656  -0.961
   71    H    ILE  11           H        ILE  11  31.596  -4.293   3.138
   72    HA   ILE  11           HA       ILE  11  29.965  -1.982   2.471
   73    HB   ILE  11           HB       ILE  11  29.060  -4.361   2.971
   74   HG12  ILE  11          HG12      ILE  11  27.701  -2.186   4.544
   75   HG13  ILE  11          HG13      ILE  11  27.786  -2.118   2.787
   76   HG21  ILE  11          HG21      ILE  11  29.119  -5.193   5.045
   77   HG22  ILE  11          HG22      ILE  11  28.705  -3.643   5.777
   78   HG23  ILE  11          HG23      ILE  11  30.377  -3.993   5.340
   79   HD11  ILE  11          HD11      ILE  11  25.936  -3.497   4.409
   80   HD12  ILE  11          HD12      ILE  11  26.881  -4.701   3.535
   81   HD13  ILE  11          HD13      ILE  11  26.024  -3.440   2.649
   82    H    GLU  12           H        GLU  12  32.125  -3.082   4.813
   83    HA   GLU  12           HA       GLU  12  31.541  -0.874   6.662
   84    HB2  GLU  12           HB2      GLU  12  32.118  -3.448   7.248
   85    HB3  GLU  12           HB3      GLU  12  33.730  -2.748   7.317
   86    HG2  GLU  12           HG2      GLU  12  32.525  -0.943   8.798
   87    HG3  GLU  12           HG3      GLU  12  31.364  -2.248   9.043
   88    H    SER  13           H        SER  13  34.402  -2.375   5.147
   89    HA   SER  13           HA       SER  13  35.926   0.033   5.574
   90    HG   SER  13           HG       SER  13  36.878  -2.607   3.205
   91    HB2  SER  13           HB2      SER  13  37.667  -1.351   5.610
   92    HB3  SER  13           HB3      SER  13  36.537  -2.685   5.390
   93    H    LEU  14           H        LEU  14  34.579  -1.635   2.700
   94    HA   LEU  14           HA       LEU  14  36.037   0.092   0.932
   95    HG   LEU  14           HG       LEU  14  34.499   0.312  -1.319
   96    HB2  LEU  14           HB2      LEU  14  35.401  -2.078   0.108
   97    HB3  LEU  14           HB3      LEU  14  33.710  -1.721   0.351
   98   HD11  LEU  14          HD11      LEU  14  36.387  -0.278  -2.332
   99   HD12  LEU  14          HD12      LEU  14  35.479  -1.586  -3.089
  100   HD13  LEU  14          HD13      LEU  14  36.365  -1.879  -1.592
  101   HD21  LEU  14          HD21      LEU  14  32.779  -0.474  -2.497
  102   HD22  LEU  14          HD22      LEU  14  32.648  -1.730  -1.266
  103   HD23  LEU  14          HD23      LEU  14  33.559  -2.036  -2.746
  104    H    SER  15           H        SER  15  32.539  -0.074   1.772
  105    HA   SER  15           HA       SER  15  31.566   2.004   0.371
  106    HG   SER  15           HG       SER  15  30.457   2.523   4.034
  107    HB2  SER  15           HB2      SER  15  29.904   2.285   2.032
  108    HB3  SER  15           HB3      SER  15  30.415   0.605   2.200
  109    H    GLN  16           H        GLN  16  32.987   2.445   3.613
  110    HA   GLN  16           HA       GLN  16  33.053   5.159   3.746
  111    HB2  GLN  16           HB2      GLN  16  34.251   4.801   5.609
  112    HB3  GLN  16           HB3      GLN  16  34.152   3.096   5.218
  113    HG2  GLN  16           HG2      GLN  16  36.414   3.599   5.711
  114    HG3  GLN  16           HG3      GLN  16  36.297   3.325   3.975
  115   HE21  GLN  16          HE21      GLN  16  37.586   4.634   2.912
  116   HE22  GLN  16          HE22      GLN  16  37.884   6.297   3.270
  117    H    MET  17           H        MET  17  34.935   3.123   1.693
  118    HA   MET  17           HA       MET  17  36.809   5.222   0.989
  119    HB2  MET  17           HB2      MET  17  37.219   2.626   1.083
  120    HB3  MET  17           HB3      MET  17  36.538   2.659  -0.537
  121    HG2  MET  17           HG2      MET  17  38.863   4.361   0.314
  122    HG3  MET  17           HG3      MET  17  39.037   2.759  -0.402
  123    HE1  MET  17           HE1      MET  17  36.104   3.580  -2.491
  124    HE2  MET  17           HE2      MET  17  37.274   2.261  -2.437
  125    HE3  MET  17           HE3      MET  17  37.209   3.324  -3.842
  126    H    LEU  18           H        LEU  18  33.849   3.825  -0.150
  127    HA   LEU  18           HA       LEU  18  34.038   5.110  -2.751
  128    HG   LEU  18           HG       LEU  18  30.725   4.486  -3.284
  129    HB2  LEU  18           HB2      LEU  18  33.102   2.845  -2.532
  130    HB3  LEU  18           HB3      LEU  18  31.821   3.479  -1.517
  131   HD11  LEU  18          HD11      LEU  18  32.148   5.863  -4.397
  132   HD12  LEU  18          HD12      LEU  18  32.063   4.561  -5.583
  133   HD13  LEU  18          HD13      LEU  18  33.432   4.657  -4.475
  134   HD21  LEU  18          HD21      LEU  18  30.465   2.825  -4.978
  135   HD22  LEU  18          HD22      LEU  18  30.783   1.993  -3.457
  136   HD23  LEU  18          HD23      LEU  18  32.067   2.164  -4.654
  137    H    SER  19           H        SER  19  31.348   5.026  -0.379
  138    HA   SER  19           HA       SER  19  30.230   7.443  -1.275
  139    HG   SER  19           HG       SER  19  27.594   6.761  -0.230
  140    HB2  SER  19           HB2      SER  19  29.190   5.434   0.026
  141    HB3  SER  19           HB3      SER  19  29.668   6.353   1.453
  142    H    MET  20           H        MET  20  33.089   7.404   0.111
  143    HA   MET  20           HA       MET  20  32.548   9.686   1.882
  144    HB2  MET  20           HB2      MET  20  33.756   7.687   2.849
  145    HB3  MET  20           HB3      MET  20  35.091   8.065   1.770
  146    HG2  MET  20           HG2      MET  20  35.363   8.902   4.092
  147    HG3  MET  20           HG3      MET  20  35.479  10.146   2.848
  148    HE1  MET  20           HE1      MET  20  34.839  12.150   5.103
  149    HE2  MET  20           HE2      MET  20  35.286  10.575   5.758
  150    HE3  MET  20           HE3      MET  20  33.822  11.382   6.321
  151    H    GLY  21           H        GLY  21  33.851   8.716  -1.091
  152    HA2  GLY  21           HA2      GLY  21  34.329  10.361  -2.775
  153    HA3  GLY  21           HA3      GLY  21  34.930  11.424  -1.505
  154    H    PHE  22           H        PHE  22  35.648   8.003  -2.119
  155    HA   PHE  22           HA       PHE  22  38.384   8.729  -2.842
  156    HD1  PHE  22           HD1      PHE  22  39.769   9.571  -1.932
  157    HD2  PHE  22           HD2      PHE  22  38.340   7.591   1.554
  158    HE1  PHE  22           HE1      PHE  22  40.862  11.266  -0.526
  159    HE2  PHE  22           HE2      PHE  22  39.430   9.285   2.967
  160    HZ   PHE  22           HZ       PHE  22  40.693  11.126   1.927
  161    HB2  PHE  22           HB2      PHE  22  37.532   6.966  -0.561
  162    HB3  PHE  22           HB3      PHE  22  39.062   6.674  -1.387
  163    H    SER  23           H        SER  23  39.453   7.111  -4.062
  164    HA   SER  23           HA       SER  23  37.845   4.829  -4.866
  165    HG   SER  23           HG       SER  23  36.406   6.784  -7.014
  166    HB2  SER  23           HB2      SER  23  39.031   6.616  -6.992
  167    HB3  SER  23           HB3      SER  23  37.873   5.303  -7.196
  168    H    ASP  24           H        ASP  24  39.631   4.322  -7.187
  169    HA   ASP  24           HA       ASP  24  42.012   3.540  -5.646
  170    HB2  ASP  24           HB2      ASP  24  42.039   2.130  -8.062
  171    HB3  ASP  24           HB3      ASP  24  41.594   1.497  -6.478
  172    H    GLU  25           H        GLU  25  43.733   4.789  -6.017
  173    HA   GLU  25           HA       GLU  25  43.998   6.736  -7.918
  174    HB2  GLU  25           HB2      GLU  25  45.564   6.543  -6.064
  175    HB3  GLU  25           HB3      GLU  25  46.210   5.057  -6.745
  176    HG2  GLU  25           HG2      GLU  25  46.574   6.737  -8.820
  177    HG3  GLU  25           HG3      GLU  25  46.736   7.854  -7.466
  178    H    GLY  26           H        GLY  26  45.941   3.826  -8.164
  179    HA2  GLY  26           HA2      GLY  26  45.415   3.821 -11.065
  180    HA3  GLY  26           HA3      GLY  26  46.984   3.443 -10.363
  181    H    GLY  27           H        GLY  27  43.879   2.370  -9.095
  182    HA2  GLY  27           HA2      GLY  27  42.873   0.279  -9.171
  183    HA3  GLY  27           HA3      GLY  27  44.139  -0.257 -10.266
  184    H    TRP  28           H        TRP  28  44.555   1.181  -7.068
  185    HA   TRP  28           HA       TRP  28  46.046  -1.196  -6.300
  186    HD1  TRP  28           HD1      TRP  28  46.729   3.336  -6.225
  187    HE1  TRP  28           HE1      TRP  28  45.299   5.056  -4.959
  188    HE3  TRP  28           HE3      TRP  28  44.441   0.233  -2.901
  189    HZ2  TRP  28           HZ2      TRP  28  43.442   5.097  -2.850
  190    HZ3  TRP  28           HZ3      TRP  28  42.852   1.176  -1.289
  191    HH2  TRP  28           HH2      TRP  28  42.354   3.558  -1.267
  192    HB2  TRP  28           HB2      TRP  28  46.865   0.171  -4.399
  193    HB3  TRP  28           HB3      TRP  28  47.246   0.861  -5.975
  194    H    LEU  29           H        LEU  29  43.163   0.633  -5.386
  195    HA   LEU  29           HA       LEU  29  42.600  -0.257  -2.891
  196    HG   LEU  29           HG       LEU  29  39.857  -1.708  -3.914
  197    HB2  LEU  29           HB2      LEU  29  40.934   1.080  -3.691
  198    HB3  LEU  29           HB3      LEU  29  40.893   0.294  -5.257
  199   HD11  LEU  29          HD11      LEU  29  39.638   0.602  -2.034
  200   HD12  LEU  29          HD12      LEU  29  40.017  -1.087  -1.697
  201   HD13  LEU  29          HD13      LEU  29  38.363  -0.616  -2.090
  202   HD21  LEU  29          HD21      LEU  29  38.767  -0.263  -5.654
  203   HD22  LEU  29          HD22      LEU  29  38.198   0.767  -4.339
  204   HD23  LEU  29          HD23      LEU  29  37.678  -0.915  -4.430
  205    H    THR  30           H        THR  30  41.444  -2.049  -5.741
  206    HA   THR  30           HA       THR  30  40.612  -4.348  -4.589
  207    HB   THR  30           HB       THR  30  40.434  -4.272  -6.925
  208    HG1  THR  30           HG1      THR  30  42.611  -6.027  -6.823
  209   HG21  THR  30          HG21      THR  30  43.403  -4.150  -7.305
  210   HG22  THR  30          HG22      THR  30  42.402  -2.700  -7.213
  211   HG23  THR  30          HG23      THR  30  42.125  -3.884  -8.490
  212    H    ARG  31           H        ARG  31  43.891  -3.223  -4.853
  213    HA   ARG  31           HA       ARG  31  44.997  -5.717  -3.826
  214    HE   ARG  31           HE       ARG  31  48.129  -2.750  -6.646
  215    HB2  ARG  31           HB2      ARG  31  46.666  -3.293  -4.283
  216    HB3  ARG  31           HB3      ARG  31  47.035  -4.980  -4.600
  217    HG2  ARG  31           HG2      ARG  31  45.036  -4.565  -6.373
  218    HG3  ARG  31           HG3      ARG  31  45.780  -2.972  -6.321
  219    HD2  ARG  31           HD2      ARG  31  47.323  -5.518  -6.751
  220    HD3  ARG  31           HD3      ARG  31  46.695  -4.522  -8.065
  221   HH11  ARG  31          HH11      ARG  31  48.853  -5.936  -7.831
  222   HH12  ARG  31          HH12      ARG  31  50.545  -5.624  -8.030
  223   HH21  ARG  31          HH21      ARG  31  50.358  -2.315  -6.909
  224   HH22  ARG  31          HH22      ARG  31  51.403  -3.563  -7.505
  225    H    LEU  32           H        LEU  32  45.427  -2.261  -3.028
  226    HA   LEU  32           HA       LEU  32  46.647  -2.272  -0.671
  227    HG   LEU  32           HG       LEU  32  45.192   1.094   0.059
  228    HB2  LEU  32           HB2      LEU  32  45.763  -0.281  -1.756
  229    HB3  LEU  32           HB3      LEU  32  44.129  -0.728  -1.291
  230   HD11  LEU  32          HD11      LEU  32  44.558  -1.228   1.826
  231   HD12  LEU  32          HD12      LEU  32  43.324  -0.534   0.774
  232   HD13  LEU  32          HD13      LEU  32  44.106   0.469   1.996
  233   HD21  LEU  32          HD21      LEU  32  47.446   0.154   0.129
  234   HD22  LEU  32          HD22      LEU  32  46.859  -1.169   1.139
  235   HD23  LEU  32          HD23      LEU  32  46.823   0.487   1.744
  236    H    LEU  33           H        LEU  33  43.075  -2.452  -0.701
  237    HA   LEU  33           HA       LEU  33  42.605  -3.074   1.919
  238    HG   LEU  33           HG       LEU  33  40.237  -2.927   2.178
  239    HB2  LEU  33           HB2      LEU  33  41.227  -3.495  -0.614
  240    HB3  LEU  33           HB3      LEU  33  40.854  -4.750   0.556
  241   HD11  LEU  33          HD11      LEU  33  39.638  -0.919   0.261
  242   HD12  LEU  33          HD12      LEU  33  41.355  -1.302   0.152
  243   HD13  LEU  33          HD13      LEU  33  40.657  -0.810   1.695
  244   HD21  LEU  33          HD21      LEU  33  38.243  -2.283   0.353
  245   HD22  LEU  33          HD22      LEU  33  38.236  -3.622   1.501
  246   HD23  LEU  33          HD23      LEU  33  38.810  -3.877  -0.147
  247    H    GLN  34           H        GLN  34  42.906  -5.466  -0.642
  248    HA   GLN  34           HA       GLN  34  42.964  -7.822   0.679
  249    HB2  GLN  34           HB2      GLN  34  44.836  -6.981  -1.521
  250    HB3  GLN  34           HB3      GLN  34  44.595  -8.650  -1.025
  251    HG2  GLN  34           HG2      GLN  34  42.272  -6.971  -1.862
  252    HG3  GLN  34           HG3      GLN  34  43.317  -7.716  -3.071
  253   HE21  GLN  34          HE21      GLN  34  40.472  -8.106  -1.800
  254   HE22  GLN  34          HE22      GLN  34  40.362  -9.827  -1.686
  255    H    THR  35           H        THR  35  45.819  -5.736   0.265
  256    HA   THR  35           HA       THR  35  47.476  -7.337   1.994
  257    HB   THR  35           HB       THR  35  48.877  -5.049   1.754
  258    HG1  THR  35           HG1      THR  35  48.151  -3.810   0.239
  259   HG21  THR  35          HG21      THR  35  48.686  -6.820  -0.646
  260   HG22  THR  35          HG22      THR  35  49.397  -7.390   0.863
  261   HG23  THR  35          HG23      THR  35  50.096  -6.002   0.028
  262    H    LYS  36           H        LYS  36  45.008  -5.454   2.635
  263    HA   LYS  36           HA       LYS  36  46.018  -4.635   5.270
  264    HB2  LYS  36           HB2      LYS  36  45.267  -2.860   3.283
  265    HB3  LYS  36           HB3      LYS  36  43.823  -2.983   4.277
  266    HG2  LYS  36           HG2      LYS  36  46.292  -2.655   5.806
  267    HG3  LYS  36           HG3      LYS  36  45.908  -1.301   4.739
  268    HD2  LYS  36           HD2      LYS  36  43.644  -1.218   5.711
  269    HD3  LYS  36           HD3      LYS  36  44.098  -2.512   6.824
  270    HE2  LYS  36           HE2      LYS  36  46.114  -0.658   7.145
  271    HE3  LYS  36           HE3      LYS  36  44.674   0.338   6.943
  272    HZ1  LYS  36           HZ1      LYS  36  45.487  -0.927   9.240
  273    HZ2  LYS  36           HZ2      LYS  36  44.180  -1.850   8.692
  274    HZ3  LYS  36           HZ3      LYS  36  43.985  -0.193   8.969
  275    H    ASN  37           H        ASN  37  44.547  -6.994   4.242
  276    HA   ASN  37           HA       ASN  37  42.761  -8.311   4.730
  277    HB2  ASN  37           HB2      ASN  37  41.980  -8.263   7.065
  278    HB3  ASN  37           HB3      ASN  37  43.740  -8.194   6.972
  279   HD21  ASN  37          HD21      ASN  37  40.857  -6.562   7.890
  280   HD22  ASN  37          HD22      ASN  37  41.608  -5.199   8.640
  281    H    TYR  38           H        TYR  38  42.231  -5.995   3.226
  282    HA   TYR  38           HA       TYR  38  40.435  -4.927   2.317
  283    HD1  TYR  38           HD1      TYR  38  40.037  -8.417   2.157
  284    HD2  TYR  38           HD2      TYR  38  37.301  -5.240   1.440
  285    HE1  TYR  38           HE1      TYR  38  39.523  -9.366  -0.053
  286    HE2  TYR  38           HE2      TYR  38  36.779  -6.179  -0.772
  287    HH   TYR  38           HH       TYR  38  37.417  -7.691  -2.333
  288    HB2  TYR  38           HB2      TYR  38  39.195  -7.005   3.994
  289    HB3  TYR  38           HB3      TYR  38  38.161  -5.622   3.647
  290    H    ASP  39           H        ASP  39  41.800  -3.306   3.820
  291    HA   ASP  39           HA       ASP  39  39.748  -1.873   5.373
  292    HB2  ASP  39           HB2      ASP  39  42.360  -2.831   6.301
  293    HB3  ASP  39           HB3      ASP  39  42.010  -1.149   6.694
  294    H    ILE  40           H        ILE  40  39.761   0.305   5.337
  295    HA   ILE  40           HA       ILE  40  41.195   1.481   3.120
  296    HB   ILE  40           HB       ILE  40  39.807   3.509   3.658
  297   HG12  ILE  40          HG12      ILE  40  39.475   2.527   6.090
  298   HG13  ILE  40          HG13      ILE  40  38.238   3.527   5.341
  299   HG21  ILE  40          HG21      ILE  40  39.082   2.103   1.894
  300   HG22  ILE  40          HG22      ILE  40  37.661   2.452   2.879
  301   HG23  ILE  40          HG23      ILE  40  38.472   0.891   3.021
  302   HD11  ILE  40          HD11      ILE  40  37.772   1.147   6.505
  303   HD12  ILE  40          HD12      ILE  40  38.002   0.647   4.830
  304   HD13  ILE  40          HD13      ILE  40  36.766   1.835   5.232
  305    H    GLY  41           H        GLY  41  41.359   1.236   6.516
  306    HA2  GLY  41           HA2      GLY  41  42.397   3.517   7.468
  307    HA3  GLY  41           HA3      GLY  41  43.066   1.958   7.913
  308    H    ALA  42           H        ALA  42  43.989   1.273   5.366
  309    HA   ALA  42           HA       ALA  42  46.319   3.030   5.173
  310    HB1  ALA  42           HB1      ALA  42  46.446   0.444   5.545
  311    HB2  ALA  42           HB2      ALA  42  47.578   1.231   4.446
  312    HB3  ALA  42           HB3      ALA  42  46.175   0.377   3.804
  313    H    ALA  43           H        ALA  43  43.517   1.963   3.492
  314    HA   ALA  43           HA       ALA  43  44.217   2.459   0.834
  315    HB1  ALA  43           HB1      ALA  43  41.593   3.067   2.213
  316    HB2  ALA  43           HB2      ALA  43  42.032   1.550   1.428
  317    HB3  ALA  43           HB3      ALA  43  41.835   3.016   0.466
  318    H    LEU  44           H        LEU  44  42.912   4.669   3.267
  319    HA   LEU  44           HA       LEU  44  42.823   7.055   1.980
  320    HG   LEU  44           HG       LEU  44  41.417   7.974   3.468
  321    HB2  LEU  44           HB2      LEU  44  43.516   6.260   4.751
  322    HB3  LEU  44           HB3      LEU  44  43.895   7.912   4.282
  323   HD11  LEU  44          HD11      LEU  44  39.993   6.560   5.003
  324   HD12  LEU  44          HD12      LEU  44  41.443   5.609   5.323
  325   HD13  LEU  44          HD13      LEU  44  40.797   5.710   3.684
  326   HD21  LEU  44          HD21      LEU  44  40.720   8.510   5.864
  327   HD22  LEU  44          HD22      LEU  44  42.073   9.421   5.191
  328   HD23  LEU  44          HD23      LEU  44  42.373   8.093   6.312
  329    H    ASP  45           H        ASP  45  45.689   6.158   3.879
  330    HA   ASP  45           HA       ASP  45  47.460   8.016   3.022
  331    HB2  ASP  45           HB2      ASP  45  48.005   6.308   4.694
  332    HB3  ASP  45           HB3      ASP  45  48.095   5.086   3.428
  333    H    THR  46           H        THR  46  46.243   5.375   1.108
  334    HA   THR  46           HA       THR  46  48.232   5.844  -0.983
  335    HB   THR  46           HB       THR  46  47.424   3.833  -2.011
  336    HG1  THR  46           HG1      THR  46  45.469   3.144  -1.715
  337   HG21  THR  46          HG21      THR  46  47.538   3.489   0.973
  338   HG22  THR  46          HG22      THR  46  48.877   3.357  -0.168
  339   HG23  THR  46          HG23      THR  46  47.573   2.170  -0.194
  340    H    ILE  47           H        ILE  47  44.781   6.218  -0.413
  341    HA   ILE  47           HA       ILE  47  44.132   6.828  -3.125
  342    HB   ILE  47           HB       ILE  47  42.255   8.051  -1.316
  343   HG12  ILE  47          HG12      ILE  47  42.956   5.169  -0.777
  344   HG13  ILE  47          HG13      ILE  47  43.108   6.503   0.344
  345   HG21  ILE  47          HG21      ILE  47  41.232   5.693  -2.498
  346   HG22  ILE  47          HG22      ILE  47  42.313   6.454  -3.664
  347   HG23  ILE  47          HG23      ILE  47  40.968   7.369  -2.983
  348   HD11  ILE  47          HD11      ILE  47  40.656   5.109  -0.608
  349   HD12  ILE  47          HD12      ILE  47  40.558   6.770  -0.026
  350   HD13  ILE  47          HD13      ILE  47  41.161   5.498   1.036
  351    H    GLN  48           H        GLN  48  44.940   8.838  -0.323
  352    HA   GLN  48           HA       GLN  48  45.741  10.999  -1.974
  353    HB2  GLN  48           HB2      GLN  48  42.943  10.946  -1.034
  354    HB3  GLN  48           HB3      GLN  48  43.791  12.463  -0.782
  355    HG2  GLN  48           HG2      GLN  48  43.660  13.008  -2.930
  356    HG3  GLN  48           HG3      GLN  48  44.186  11.411  -3.457
  357   HE21  GLN  48          HE21      GLN  48  42.401   9.684  -2.973
  358   HE22  GLN  48          HE22      GLN  48  40.817  10.105  -3.521
  359    H    TYR  49           H        TYR  49  46.665   9.518   0.415
  360    HA   TYR  49           HA       TYR  49  47.247  11.861   2.054
  361    HD1  TYR  49           HD1      TYR  49  46.514  12.883   4.129
  362    HD2  TYR  49           HD2      TYR  49  43.639   9.911   3.126
  363    HE1  TYR  49           HE1      TYR  49  44.706  14.442   4.717
  364    HE2  TYR  49           HE2      TYR  49  41.823  11.464   3.709
  365    HH   TYR  49           HH       TYR  49  41.762  14.281   3.771
  366    HB2  TYR  49           HB2      TYR  49  45.872   9.373   2.998
  367    HB3  TYR  49           HB3      TYR  49  46.961  10.227   4.092
  368    H    SER  50           H        SER  50  48.711  10.099   0.133
  369    HA   SER  50           HA       SER  50  50.594   8.669   1.799
  370    HG   SER  50           HG       SER  50  49.658   8.006  -1.921
  371    HB2  SER  50           HB2      SER  50  51.491   8.926  -0.916
  372    HB3  SER  50           HB3      SER  50  50.935   7.483  -0.068
  373    H    LYS  51           H        LYS  51  50.302  11.694   1.848
  374    HA   LYS  51           HA       LYS  51  53.084  12.262   2.125
  375    HB2  LYS  51           HB2      LYS  51  52.042  12.646  -0.443
  376    HB3  LYS  51           HB3      LYS  51  52.116  14.254   0.263
  377    HG2  LYS  51           HG2      LYS  51  54.297  14.341  -0.089
  378    HG3  LYS  51           HG3      LYS  51  54.539  12.871   0.856
  379    HD2  LYS  51           HD2      LYS  51  54.714  11.570  -0.979
  380    HD3  LYS  51           HD3      LYS  51  53.462  12.457  -1.851
  381    HE2  LYS  51           HE2      LYS  51  55.458  14.302  -1.731
  382    HE3  LYS  51           HE3      LYS  51  56.375  12.801  -1.853
  383    HZ1  LYS  51           HZ1      LYS  51  54.577  14.044  -3.795
  384    HZ2  LYS  51           HZ2      LYS  51  54.625  12.355  -3.747
  385    HZ3  LYS  51           HZ3      LYS  51  56.041  13.231  -4.042
  386    H    HIS  52           H        HIS  52  50.648  12.406   3.698
  387    HA   HIS  52           HA       HIS  52  50.491  15.306   4.180
  388    HD1  HIS  52           HD1      HIS  52  47.534  14.727   7.096
  389    HD2  HIS  52           HD2      HIS  52  48.043  16.801   3.533
  390    HE1  HIS  52           HE1      HIS  52  46.441  16.982   7.427
  391    HB2  HIS  52           HB2      HIS  52  48.376  13.921   3.631
  392    HB3  HIS  52           HB3      HIS  52  48.534  13.301   5.271
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1  26.272 -18.720   2.447
    2    H2   GLY   1           2H       GLY   1  27.093 -17.800   1.288
    3    H3   GLY   1           3H       GLY   1  25.693 -17.190   2.015
    4    HA2  GLY   1           HA2      GLY   1  26.922 -17.352   4.206
    5    HA3  GLY   1           HA3      GLY   1  28.363 -17.579   3.226
    6    H    SER   2           H        SER   2  29.259 -15.857   2.156
    7    HA   SER   2           HA       SER   2  28.176 -13.233   2.907
    8    HG   SER   2           HG       SER   2  30.666 -13.270   4.557
    9    HB2  SER   2           HB2      SER   2  30.854 -14.348   2.763
   10    HB3  SER   2           HB3      SER   2  30.728 -12.842   1.855
   11    HA   PRO   3           HA       PRO   3  27.276 -13.029  -1.512
   12    HB2  PRO   3           HB2      PRO   3  25.215 -11.332  -1.324
   13    HB3  PRO   3           HB3      PRO   3  25.053 -13.030  -0.861
   14    HG2  PRO   3           HG2      PRO   3  25.390 -10.618   0.866
   15    HG3  PRO   3           HG3      PRO   3  24.378 -12.049   1.123
   16    HD2  PRO   3           HD2      PRO   3  26.862 -11.622   2.283
   17    HD3  PRO   3           HD3      PRO   3  26.076 -13.203   2.107
   18    HA   PRO   4           HA       PRO   4  29.763  -9.406  -2.259
   19    HB2  PRO   4           HB2      PRO   4  29.372  -9.293  -4.960
   20    HB3  PRO   4           HB3      PRO   4  30.493 -10.414  -4.180
   21    HG2  PRO   4           HG2      PRO   4  27.701 -10.897  -5.148
   22    HG3  PRO   4           HG3      PRO   4  29.138 -11.924  -5.320
   23    HD2  PRO   4           HD2      PRO   4  27.257 -12.414  -3.457
   24    HD3  PRO   4           HD3      PRO   4  28.980 -12.720  -3.151
   25    H    GLU   5           H        GLU   5  27.519  -8.587  -1.096
   26    HA   GLU   5           HA       GLU   5  26.716  -6.331  -2.760
   27    HB2  GLU   5           HB2      GLU   5  24.317  -6.661  -1.983
   28    HB3  GLU   5           HB3      GLU   5  24.900  -7.769  -3.219
   29    HG2  GLU   5           HG2      GLU   5  25.508  -9.151  -0.976
   30    HG3  GLU   5           HG3      GLU   5  24.062  -8.286  -0.456
   31    H    ALA   6           H        ALA   6  28.460  -6.598  -0.493
   32    HA   ALA   6           HA       ALA   6  28.769  -4.732   1.023
   33    HB1  ALA   6           HB1      ALA   6  26.400  -4.017   0.863
   34    HB2  ALA   6           HB2      ALA   6  27.021  -4.032   2.514
   35    HB3  ALA   6           HB3      ALA   6  25.966  -5.331   1.957
   36    H    ASP   7           H        ASP   7  30.220  -6.556   1.442
   37    HA   ASP   7           HA       ASP   7  29.407  -8.171   3.762
   38    HB2  ASP   7           HB2      ASP   7  31.741  -8.632   1.894
   39    HB3  ASP   7           HB3      ASP   7  31.178  -9.717   3.162
   40    HA   PRO   8           HA       PRO   8  32.001  -6.204   6.715
   41    HB2  PRO   8           HB2      PRO   8  33.294  -8.873   7.069
   42    HB3  PRO   8           HB3      PRO   8  32.639  -7.768   8.284
   43    HG2  PRO   8           HG2      PRO   8  31.270  -9.926   7.561
   44    HG3  PRO   8           HG3      PRO   8  30.440  -8.386   7.853
   45    HD2  PRO   8           HD2      PRO   8  31.079  -9.737   5.273
   46    HD3  PRO   8           HD3      PRO   8  29.676  -8.744   5.711
   47    H    ARG   9           H        ARG   9  33.329  -7.780   3.986
   48    HA   ARG   9           HA       ARG   9  36.072  -7.097   4.554
   49    HE   ARG   9           HE       ARG   9  37.745  -9.968   2.432
   50    HB2  ARG   9           HB2      ARG   9  34.880  -8.030   1.939
   51    HB3  ARG   9           HB3      ARG   9  36.579  -8.069   2.411
   52    HG2  ARG   9           HG2      ARG   9  34.488  -9.581   3.939
   53    HG3  ARG   9           HG3      ARG   9  35.266 -10.253   2.504
   54    HD2  ARG   9           HD2      ARG   9  36.817  -9.183   4.848
   55    HD3  ARG   9           HD3      ARG   9  36.291 -10.863   4.742
   56   HH11  ARG   9          HH11      ARG   9  38.014 -11.286   5.645
   57   HH12  ARG   9          HH12      ARG   9  39.566 -12.000   5.363
   58   HH21  ARG   9          HH21      ARG   9  39.792 -10.905   2.050
   59   HH22  ARG   9          HH22      ARG   9  40.576 -11.784   3.320
   60    H    LEU  10           H        LEU  10  33.837  -6.177   1.913
   61    HA   LEU  10           HA       LEU  10  35.330  -3.704   1.588
   62    HG   LEU  10           HG       LEU  10  36.243  -5.319  -0.008
   63    HB2  LEU  10           HB2      LEU  10  33.538  -5.300  -0.210
   64    HB3  LEU  10           HB3      LEU  10  33.893  -3.620  -0.563
   65   HD11  LEU  10          HD11      LEU  10  34.469  -6.617  -1.469
   66   HD12  LEU  10          HD12      LEU  10  36.196  -6.665  -1.832
   67   HD13  LEU  10          HD13      LEU  10  35.131  -5.591  -2.742
   68   HD21  LEU  10          HD21      LEU  10  35.556  -3.254  -2.092
   69   HD22  LEU  10          HD22      LEU  10  37.116  -4.070  -1.962
   70   HD23  LEU  10          HD23      LEU  10  36.553  -3.031  -0.654
   71    H    ILE  11           H        ILE  11  32.571  -4.886   3.042
   72    HA   ILE  11           HA       ILE  11  30.792  -2.689   2.592
   73    HB   ILE  11           HB       ILE  11  30.137  -4.984   3.566
   74   HG12  ILE  11          HG12      ILE  11  29.222  -2.370   4.759
   75   HG13  ILE  11          HG13      ILE  11  28.477  -3.285   3.451
   76   HG21  ILE  11          HG21      ILE  11  30.507  -5.487   5.778
   77   HG22  ILE  11          HG22      ILE  11  30.716  -3.797   6.237
   78   HG23  ILE  11          HG23      ILE  11  32.002  -4.641   5.375
   79   HD11  ILE  11          HD11      ILE  11  27.767  -4.989   4.983
   80   HD12  ILE  11          HD12      ILE  11  27.246  -3.416   5.585
   81   HD13  ILE  11          HD13      ILE  11  28.642  -4.218   6.307
   82    H    GLU  12           H        GLU  12  33.475  -3.413   4.606
   83    HA   GLU  12           HA       GLU  12  33.144  -0.976   6.180
   84    HB2  GLU  12           HB2      GLU  12  33.827  -2.624   7.652
   85    HB3  GLU  12           HB3      GLU  12  34.779  -3.463   6.437
   86    HG2  GLU  12           HG2      GLU  12  36.637  -2.282   6.882
   87    HG3  GLU  12           HG3      GLU  12  35.748  -0.789   7.180
   88    H    SER  13           H        SER  13  35.663  -2.633   4.295
   89    HA   SER  13           HA       SER  13  37.359  -0.411   4.044
   90    HG   SER  13           HG       SER  13  37.763  -2.703   4.811
   91    HB2  SER  13           HB2      SER  13  37.242  -2.740   2.133
   92    HB3  SER  13           HB3      SER  13  38.637  -1.743   2.543
   93    H    LEU  14           H        LEU  14  35.166  -1.832   1.544
   94    HA   LEU  14           HA       LEU  14  35.716   0.258  -0.304
   95    HG   LEU  14           HG       LEU  14  33.348   0.297  -2.060
   96    HB2  LEU  14           HB2      LEU  14  34.772  -2.051  -0.810
   97    HB3  LEU  14           HB3      LEU  14  33.221  -1.424  -0.290
   98   HD11  LEU  14          HD11      LEU  14  35.034   0.264  -3.729
   99   HD12  LEU  14          HD12      LEU  14  35.734  -1.222  -3.088
  100   HD13  LEU  14          HD13      LEU  14  35.858   0.279  -2.170
  101   HD21  LEU  14          HD21      LEU  14  32.053  -1.399  -2.837
  102   HD22  LEU  14          HD22      LEU  14  33.305  -2.617  -2.592
  103   HD23  LEU  14          HD23      LEU  14  33.381  -1.540  -3.988
  104    H    SER  15           H        SER  15  32.725  -0.459   1.503
  105    HA   SER  15           HA       SER  15  31.322   1.827   0.984
  106    HG   SER  15           HG       SER  15  30.439   1.778   4.394
  107    HB2  SER  15           HB2      SER  15  29.878   1.038   2.502
  108    HB3  SER  15           HB3      SER  15  31.007  -0.302   2.688
  109    H    GLN  16           H        GLN  16  34.298   1.842   2.521
  110    HA   GLN  16           HA       GLN  16  33.776   4.292   4.027
  111    HB2  GLN  16           HB2      GLN  16  35.677   3.906   5.220
  112    HB3  GLN  16           HB3      GLN  16  35.396   2.259   4.693
  113    HG2  GLN  16           HG2      GLN  16  37.615   2.516   4.218
  114    HG3  GLN  16           HG3      GLN  16  36.881   2.934   2.671
  115   HE21  GLN  16          HE21      GLN  16  37.827   4.603   1.760
  116   HE22  GLN  16          HE22      GLN  16  38.466   5.987   2.574
  117    H    MET  17           H        MET  17  35.528   3.061   1.255
  118    HA   MET  17           HA       MET  17  36.519   5.705   0.551
  119    HB2  MET  17           HB2      MET  17  37.441   3.098   0.149
  120    HB3  MET  17           HB3      MET  17  36.941   3.644  -1.445
  121    HG2  MET  17           HG2      MET  17  38.498   5.350  -1.495
  122    HG3  MET  17           HG3      MET  17  38.674   5.379   0.258
  123    HE1  MET  17           HE1      MET  17  38.922   2.972   1.277
  124    HE2  MET  17           HE2      MET  17  40.677   2.847   1.393
  125    HE3  MET  17           HE3      MET  17  39.765   1.635   0.494
  126    H    LEU  18           H        LEU  18  33.806   3.741  -0.085
  127    HA   LEU  18           HA       LEU  18  33.287   4.594  -2.755
  128    HG   LEU  18           HG       LEU  18  30.448   4.152  -3.153
  129    HB2  LEU  18           HB2      LEU  18  32.368   2.557  -1.451
  130    HB3  LEU  18           HB3      LEU  18  31.165   3.683  -0.849
  131   HD11  LEU  18          HD11      LEU  18  32.886   2.719  -3.768
  132   HD12  LEU  18          HD12      LEU  18  31.901   3.766  -4.789
  133   HD13  LEU  18          HD13      LEU  18  31.497   2.057  -4.630
  134   HD21  LEU  18          HD21      LEU  18  30.010   1.442  -3.525
  135   HD22  LEU  18          HD22      LEU  18  28.989   2.557  -2.619
  136   HD23  LEU  18          HD23      LEU  18  30.218   1.609  -1.782
  137    H    SER  19           H        SER  19  31.403   5.337   0.179
  138    HA   SER  19           HA       SER  19  30.229   7.635  -1.078
  139    HG   SER  19           HG       SER  19  27.750   7.647   1.181
  140    HB2  SER  19           HB2      SER  19  29.108   6.046   0.599
  141    HB3  SER  19           HB3      SER  19  29.987   6.939   1.841
  142    H    MET  20           H        MET  20  33.176   7.225   0.269
  143    HA   MET  20           HA       MET  20  33.255   9.805   1.633
  144    HB2  MET  20           HB2      MET  20  34.398   7.854   2.645
  145    HB3  MET  20           HB3      MET  20  35.459   7.771   1.245
  146    HG2  MET  20           HG2      MET  20  36.785   9.367   2.036
  147    HG3  MET  20           HG3      MET  20  35.422  10.410   2.439
  148    HE1  MET  20           HE1      MET  20  33.970   9.809   5.097
  149    HE2  MET  20           HE2      MET  20  34.923  11.138   4.440
  150    HE3  MET  20           HE3      MET  20  35.304  10.484   6.033
  151    H    GLY  21           H        GLY  21  33.616   8.598  -1.457
  152    HA2  GLY  21           HA2      GLY  21  34.157   9.733  -3.395
  153    HA3  GLY  21           HA3      GLY  21  34.658  11.105  -2.410
  154    H    PHE  22           H        PHE  22  35.861   7.768  -2.186
  155    HA   PHE  22           HA       PHE  22  38.443   8.723  -3.216
  156    HD1  PHE  22           HD1      PHE  22  36.716   9.473  -0.501
  157    HD2  PHE  22           HD2      PHE  22  40.881   8.629  -0.341
  158    HE1  PHE  22           HE1      PHE  22  37.069  11.494   0.856
  159    HE2  PHE  22           HE2      PHE  22  41.243  10.645   1.020
  160    HZ   PHE  22           HZ       PHE  22  39.336  12.081   1.620
  161    HB2  PHE  22           HB2      PHE  22  37.950   7.002  -0.774
  162    HB3  PHE  22           HB3      PHE  22  39.530   7.232  -1.521
  163    H    SER  23           H        SER  23  39.397   7.370  -4.655
  164    HA   SER  23           HA       SER  23  38.290   4.672  -4.856
  165    HG   SER  23           HG       SER  23  36.785   7.062  -6.453
  166    HB2  SER  23           HB2      SER  23  38.740   6.554  -7.186
  167    HB3  SER  23           HB3      SER  23  38.270   4.861  -7.329
  168    H    ASP  24           H        ASP  24  39.704   3.287  -6.397
  169    HA   ASP  24           HA       ASP  24  42.323   3.197  -5.408
  170    HB2  ASP  24           HB2      ASP  24  42.728   1.601  -7.325
  171    HB3  ASP  24           HB3      ASP  24  41.347   1.198  -6.304
  172    H    GLU  25           H        GLU  25  43.984   4.502  -5.816
  173    HA   GLU  25           HA       GLU  25  43.860   6.272  -8.111
  174    HB2  GLU  25           HB2      GLU  25  44.564   6.925  -5.728
  175    HB3  GLU  25           HB3      GLU  25  46.108   6.188  -6.128
  176    HG2  GLU  25           HG2      GLU  25  46.745   7.915  -7.380
  177    HG3  GLU  25           HG3      GLU  25  45.167   8.053  -8.154
  178    H    GLY  26           H        GLY  26  44.373   3.434  -8.649
  179    HA2  GLY  26           HA2      GLY  26  46.070   3.542 -10.745
  180    HA3  GLY  26           HA3      GLY  26  47.175   3.324  -9.399
  181    H    GLY  27           H        GLY  27  44.165   1.710  -8.953
  182    HA2  GLY  27           HA2      GLY  27  43.538  -0.499  -9.289
  183    HA3  GLY  27           HA3      GLY  27  44.920  -0.686 -10.364
  184    H    TRP  28           H        TRP  28  45.309   0.604  -7.205
  185    HA   TRP  28           HA       TRP  28  46.899  -1.720  -6.440
  186    HD1  TRP  28           HD1      TRP  28  47.283   2.813  -6.673
  187    HE1  TRP  28           HE1      TRP  28  45.788   4.507  -5.448
  188    HE3  TRP  28           HE3      TRP  28  45.465  -0.204  -3.002
  189    HZ2  TRP  28           HZ2      TRP  28  44.064   4.558  -3.209
  190    HZ3  TRP  28           HZ3      TRP  28  43.909   0.729  -1.346
  191    HH2  TRP  28           HH2      TRP  28  43.218   3.062  -1.450
  192    HB2  TRP  28           HB2      TRP  28  47.722  -0.227  -4.610
  193    HB3  TRP  28           HB3      TRP  28  48.040   0.397  -6.231
  194    H    LEU  29           H        LEU  29  44.026   0.066  -5.575
  195    HA   LEU  29           HA       LEU  29  43.427  -0.611  -3.041
  196    HG   LEU  29           HG       LEU  29  40.826  -1.960  -3.206
  197    HB2  LEU  29           HB2      LEU  29  41.836   0.588  -4.355
  198    HB3  LEU  29           HB3      LEU  29  41.628  -0.765  -5.452
  199   HD11  LEU  29          HD11      LEU  29  39.428  -0.298  -1.945
  200   HD12  LEU  29          HD12      LEU  29  40.340   0.974  -2.758
  201   HD13  LEU  29          HD13      LEU  29  41.169  -0.164  -1.697
  202   HD21  LEU  29          HD21      LEU  29  39.061  -2.107  -4.543
  203   HD22  LEU  29          HD22      LEU  29  39.574  -0.680  -5.443
  204   HD23  LEU  29          HD23      LEU  29  38.564  -0.503  -4.009
  205    H    THR  30           H        THR  30  42.345  -2.752  -5.663
  206    HA   THR  30           HA       THR  30  41.699  -4.959  -4.227
  207    HB   THR  30           HB       THR  30  41.314  -5.146  -6.517
  208    HG1  THR  30           HG1      THR  30  43.661  -6.696  -6.289
  209   HG21  THR  30          HG21      THR  30  42.907  -4.891  -8.274
  210   HG22  THR  30          HG22      THR  30  44.227  -4.709  -7.118
  211   HG23  THR  30          HG23      THR  30  42.985  -3.464  -7.243
  212    H    ARG  31           H        ARG  31  44.926  -3.781  -4.908
  213    HA   ARG  31           HA       ARG  31  46.173  -6.165  -3.813
  214    HE   ARG  31           HE       ARG  31  51.468  -3.849  -4.631
  215    HB2  ARG  31           HB2      ARG  31  47.935  -5.564  -5.054
  216    HB3  ARG  31           HB3      ARG  31  46.923  -4.299  -5.723
  217    HG2  ARG  31           HG2      ARG  31  47.789  -2.696  -4.159
  218    HG3  ARG  31           HG3      ARG  31  48.691  -3.953  -3.308
  219    HD2  ARG  31           HD2      ARG  31  49.597  -4.287  -5.838
  220    HD3  ARG  31           HD3      ARG  31  49.291  -2.552  -5.825
  221   HH11  ARG  31          HH11      ARG  31  49.111  -1.396  -3.890
  222   HH12  ARG  31          HH12      ARG  31  50.164  -0.521  -2.830
  223   HH21  ARG  31          HH21      ARG  31  52.863  -2.706  -3.239
  224   HH22  ARG  31          HH22      ARG  31  52.297  -1.268  -2.457
  225    H    LEU  32           H        LEU  32  46.307  -2.668  -3.086
  226    HA   LEU  32           HA       LEU  32  47.736  -2.717  -0.749
  227    HG   LEU  32           HG       LEU  32  46.614   0.819  -0.219
  228    HB2  LEU  32           HB2      LEU  32  46.902  -0.727  -2.010
  229    HB3  LEU  32           HB3      LEU  32  45.323  -0.986  -1.291
  230   HD11  LEU  32          HD11      LEU  32  44.940  -0.783   0.947
  231   HD12  LEU  32          HD12      LEU  32  45.899   0.346   1.902
  232   HD13  LEU  32          HD13      LEU  32  46.373  -1.351   1.806
  233   HD21  LEU  32          HD21      LEU  32  48.836  -0.214  -0.551
  234   HD22  LEU  32          HD22      LEU  32  48.451  -1.369   0.726
  235   HD23  LEU  32          HD23      LEU  32  48.558   0.353   1.095
  236    H    LEU  33           H        LEU  33  44.172  -2.714  -0.910
  237    HA   LEU  33           HA       LEU  33  43.667  -3.213   1.771
  238    HG   LEU  33           HG       LEU  33  41.180  -2.614   1.975
  239    HB2  LEU  33           HB2      LEU  33  42.197  -3.390  -0.758
  240    HB3  LEU  33           HB3      LEU  33  41.593  -4.466   0.493
  241   HD11  LEU  33          HD11      LEU  33  41.617  -0.301   1.302
  242   HD12  LEU  33          HD12      LEU  33  42.403  -0.882  -0.166
  243   HD13  LEU  33          HD13      LEU  33  43.105  -1.241   1.411
  244   HD21  LEU  33          HD21      LEU  33  39.490  -1.399   0.697
  245   HD22  LEU  33          HD22      LEU  33  39.451  -3.123   0.328
  246   HD23  LEU  33          HD23      LEU  33  40.192  -1.994  -0.807
  247    H    GLN  34           H        GLN  34  43.308  -5.621  -0.812
  248    HA   GLN  34           HA       GLN  34  42.896  -7.908   0.453
  249    HB2  GLN  34           HB2      GLN  34  44.598  -7.236  -1.874
  250    HB3  GLN  34           HB3      GLN  34  44.704  -8.876  -1.251
  251    HG2  GLN  34           HG2      GLN  34  42.020  -7.703  -1.785
  252    HG3  GLN  34           HG3      GLN  34  43.003  -8.252  -3.142
  253   HE21  GLN  34          HE21      GLN  34  43.072  -9.714   0.028
  254   HE22  GLN  34          HE22      GLN  34  42.344 -11.211  -0.433
  255    H    THR  35           H        THR  35  45.951  -6.191   0.598
  256    HA   THR  35           HA       THR  35  47.361  -8.369   1.860
  257    HB   THR  35           HB       THR  35  48.215  -5.482   1.955
  258    HG1  THR  35           HG1      THR  35  48.571  -5.479  -0.108
  259   HG21  THR  35          HG21      THR  35  49.482  -7.522   3.021
  260   HG22  THR  35          HG22      THR  35  50.350  -6.227   2.196
  261   HG23  THR  35          HG23      THR  35  50.035  -7.748   1.362
  262    H    LYS  36           H        LYS  36  46.542  -5.125   2.984
  263    HA   LYS  36           HA       LYS  36  46.793  -5.808   5.748
  264    HB2  LYS  36           HB2      LYS  36  45.519  -3.370   4.493
  265    HB3  LYS  36           HB3      LYS  36  46.011  -3.532   6.174
  266    HG2  LYS  36           HG2      LYS  36  48.343  -3.756   5.470
  267    HG3  LYS  36           HG3      LYS  36  47.845  -3.582   3.786
  268    HD2  LYS  36           HD2      LYS  36  47.990  -1.374   3.992
  269    HD3  LYS  36           HD3      LYS  36  46.719  -1.421   5.215
  270    HE2  LYS  36           HE2      LYS  36  48.663  -0.306   6.110
  271    HE3  LYS  36           HE3      LYS  36  48.432  -1.845   6.937
  272    HZ1  LYS  36           HZ1      LYS  36  50.384  -2.597   6.212
  273    HZ2  LYS  36           HZ2      LYS  36  50.744  -0.993   5.818
  274    HZ3  LYS  36           HZ3      LYS  36  50.137  -2.037   4.634
  275    H    ASN  37           H        ASN  37  44.925  -7.569   4.536
  276    HA   ASN  37           HA       ASN  37  42.803  -8.385   4.691
  277    HB2  ASN  37           HB2      ASN  37  41.860  -8.349   6.933
  278    HB3  ASN  37           HB3      ASN  37  43.605  -8.594   7.031
  279   HD21  ASN  37          HD21      ASN  37  44.908  -6.940   7.819
  280   HD22  ASN  37          HD22      ASN  37  44.264  -5.614   8.718
  281    H    TYR  38           H        TYR  38  42.849  -6.105   3.202
  282    HA   TYR  38           HA       TYR  38  41.501  -4.486   2.342
  283    HD1  TYR  38           HD1      TYR  38  41.288  -7.564   2.662
  284    HD2  TYR  38           HD2      TYR  38  37.846  -5.497   1.254
  285    HE1  TYR  38           HE1      TYR  38  41.029  -9.227   0.873
  286    HE2  TYR  38           HE2      TYR  38  37.575  -7.157  -0.541
  287    HH   TYR  38           HH       TYR  38  39.959  -9.285  -1.445
  288    HB2  TYR  38           HB2      TYR  38  39.471  -5.856   4.116
  289    HB3  TYR  38           HB3      TYR  38  39.070  -4.575   2.980
  290    H    ASP  39           H        ASP  39  43.134  -3.331   3.903
  291    HA   ASP  39           HA       ASP  39  41.610  -1.865   5.947
  292    HB2  ASP  39           HB2      ASP  39  43.619  -3.094   6.727
  293    HB3  ASP  39           HB3      ASP  39  44.610  -2.115   5.647
  294    H    ILE  40           H        ILE  40  40.888   0.034   5.282
  295    HA   ILE  40           HA       ILE  40  42.107   1.443   3.088
  296    HB   ILE  40           HB       ILE  40  40.330   3.050   3.331
  297   HG12  ILE  40          HG12      ILE  40  40.483   2.813   5.953
  298   HG13  ILE  40          HG13      ILE  40  38.983   3.319   5.192
  299   HG21  ILE  40          HG21      ILE  40  39.898   0.742   2.352
  300   HG22  ILE  40          HG22      ILE  40  38.487   1.692   2.808
  301   HG23  ILE  40          HG23      ILE  40  39.044   0.385   3.854
  302   HD11  ILE  40          HD11      ILE  40  38.398   0.795   5.255
  303   HD12  ILE  40          HD12      ILE  40  38.276   1.760   6.725
  304   HD13  ILE  40          HD13      ILE  40  39.672   0.716   6.471
  305    H    GLY  41           H        GLY  41  42.282   1.321   6.490
  306    HA2  GLY  41           HA2      GLY  41  42.891   3.780   7.351
  307    HA3  GLY  41           HA3      GLY  41  43.772   2.366   7.893
  308    H    ALA  42           H        ALA  42  45.061   1.613   5.685
  309    HA   ALA  42           HA       ALA  42  47.076   3.692   5.414
  310    HB1  ALA  42           HB1      ALA  42  48.457   1.923   4.402
  311    HB2  ALA  42           HB2      ALA  42  47.088   0.812   4.506
  312    HB3  ALA  42           HB3      ALA  42  47.829   1.441   5.979
  313    H    ALA  43           H        ALA  43  44.777   1.920   3.510
  314    HA   ALA  43           HA       ALA  43  45.579   2.660   0.945
  315    HB1  ALA  43           HB1      ALA  43  43.517   1.926   0.215
  316    HB2  ALA  43           HB2      ALA  43  42.668   2.572   1.619
  317    HB3  ALA  43           HB3      ALA  43  43.631   1.101   1.770
  318    H    LEU  44           H        LEU  44  43.845   4.345   3.442
  319    HA   LEU  44           HA       LEU  44  42.813   6.526   2.086
  320    HG   LEU  44           HG       LEU  44  41.263   7.518   4.034
  321    HB2  LEU  44           HB2      LEU  44  43.734   6.013   4.852
  322    HB3  LEU  44           HB3      LEU  44  43.584   7.700   4.381
  323   HD11  LEU  44          HD11      LEU  44  41.631   5.174   2.905
  324   HD12  LEU  44          HD12      LEU  44  40.069   5.615   3.591
  325   HD13  LEU  44          HD13      LEU  44  41.170   4.578   4.499
  326   HD21  LEU  44          HD21      LEU  44  41.632   7.649   6.344
  327   HD22  LEU  44          HD22      LEU  44  42.159   5.969   6.443
  328   HD23  LEU  44          HD23      LEU  44  40.460   6.345   6.151
  329    H    ASP  45           H        ASP  45  45.861   6.558   3.911
  330    HA   ASP  45           HA       ASP  45  46.931   8.896   3.072
  331    HB2  ASP  45           HB2      ASP  45  48.191   7.658   4.627
  332    HB3  ASP  45           HB3      ASP  45  48.262   6.244   3.579
  333    H    THR  46           H        THR  46  46.489   6.054   1.101
  334    HA   THR  46           HA       THR  46  48.148   7.150  -1.030
  335    HB   THR  46           HB       THR  46  48.229   5.040  -1.940
  336    HG1  THR  46           HG1      THR  46  46.038   4.711  -2.239
  337   HG21  THR  46          HG21      THR  46  47.537   4.308   0.891
  338   HG22  THR  46          HG22      THR  46  49.103   4.938   0.381
  339   HG23  THR  46          HG23      THR  46  48.527   3.394  -0.247
  340    H    ILE  47           H        ILE  47  44.750   6.149  -0.552
  341    HA   ILE  47           HA       ILE  47  43.913   6.677  -3.172
  342    HB   ILE  47           HB       ILE  47  41.643   7.284  -1.760
  343   HG12  ILE  47          HG12      ILE  47  42.773   5.021  -0.190
  344   HG13  ILE  47          HG13      ILE  47  43.204   6.661   0.291
  345   HG21  ILE  47          HG21      ILE  47  42.177   4.412  -2.085
  346   HG22  ILE  47          HG22      ILE  47  42.436   5.404  -3.516
  347   HG23  ILE  47          HG23      ILE  47  40.867   5.405  -2.715
  348   HD11  ILE  47          HD11      ILE  47  41.208   7.015   1.202
  349   HD12  ILE  47          HD12      ILE  47  40.986   5.269   1.089
  350   HD13  ILE  47          HD13      ILE  47  40.358   6.321  -0.177
  351    H    GLN  48           H        GLN  48  44.066   8.866  -0.380
  352    HA   GLN  48           HA       GLN  48  44.382  11.129  -2.010
  353    HB2  GLN  48           HB2      GLN  48  41.610  10.364  -1.389
  354    HB3  GLN  48           HB3      GLN  48  42.002  12.045  -1.060
  355    HG2  GLN  48           HG2      GLN  48  42.018  12.571  -3.218
  356    HG3  GLN  48           HG3      GLN  48  42.980  11.158  -3.645
  357   HE21  GLN  48          HE21      GLN  48  41.884   9.154  -3.984
  358   HE22  GLN  48          HE22      GLN  48  40.228   9.142  -4.498
  359    H    TYR  49           H        TYR  49  45.506  10.026   0.409
  360    HA   TYR  49           HA       TYR  49  45.182  12.380   2.114
  361    HD1  TYR  49           HD2      TYR  49  44.067  12.750   4.581
  362    HD2  TYR  49           HD1      TYR  49  42.532   9.332   2.564
  363    HE1  TYR  49           HE2      TYR  49  41.778  13.456   5.139
  364    HE2  TYR  49           HE1      TYR  49  40.238  10.029   3.114
  365    HH   TYR  49           HH       TYR  49  39.118  12.408   3.667
  366    HB2  TYR  49           HB2      TYR  49  44.839   9.511   2.925
  367    HB3  TYR  49           HB3      TYR  49  45.479  10.677   4.082
  368    H    SER  50           H        SER  50  47.181  11.380   0.155
  369    HA   SER  50           HA       SER  50  49.480  10.663   1.766
  370    HG   SER  50           HG       SER  50  48.829  10.366  -2.151
  371    HB2  SER  50           HB2      SER  50  50.317  11.278  -0.853
  372    HB3  SER  50           HB3      SER  50  50.062   9.678  -0.160
  373    H    LYS  51           H        LYS  51  48.145  13.322   2.066
  374    HA   LYS  51           HA       LYS  51  50.513  14.992   1.546
  375    HB2  LYS  51           HB2      LYS  51  47.594  15.682   1.263
  376    HB3  LYS  51           HB3      LYS  51  48.830  16.920   1.445
  377    HG2  LYS  51           HG2      LYS  51  49.482  14.991  -0.627
  378    HG3  LYS  51           HG3      LYS  51  47.956  15.827  -0.920
  379    HD2  LYS  51           HD2      LYS  51  49.797  17.770  -0.030
  380    HD3  LYS  51           HD3      LYS  51  50.632  16.791  -1.237
  381    HE2  LYS  51           HE2      LYS  51  48.082  18.355  -1.540
  382    HE3  LYS  51           HE3      LYS  51  49.594  18.548  -2.426
  383    HZ1  LYS  51           HZ1      LYS  51  48.155  17.434  -3.874
  384    HZ2  LYS  51           HZ2      LYS  51  47.595  16.381  -2.673
  385    HZ3  LYS  51           HZ3      LYS  51  49.167  16.218  -3.272
  386    H    HIS  52           H        HIS  52  50.851  13.942   3.794
  387    HA   HIS  52           HA       HIS  52  49.346  14.930   5.992
  388    HD1  HIS  52           HD1      HIS  52  51.881  11.127   5.819
  389    HD2  HIS  52           HD2      HIS  52  48.378  12.993   7.045
  390    HE1  HIS  52           HE1      HIS  52  50.169   9.290   6.130
  391    HB2  HIS  52           HB2      HIS  52  52.061  13.630   5.787
  392    HB3  HIS  52           HB3      HIS  52  51.362  14.124   7.326
  Start of MODEL   16
    1    H1   GLY   1           1H       GLY   1  29.714 -17.459   6.753
    2    H2   GLY   1           2H       GLY   1  28.830 -18.634   5.916
    3    H3   GLY   1           3H       GLY   1  28.281 -17.035   5.959
    4    HA2  GLY   1           HA2      GLY   1  30.946 -17.532   4.862
    5    HA3  GLY   1           HA3      GLY   1  29.560 -17.989   3.885
    6    H    SER   2           H        SER   2  31.628 -15.862   3.560
    7    HA   SER   2           HA       SER   2  29.780 -13.580   3.315
    8    HG   SER   2           HG       SER   2  32.677 -14.320   5.223
    9    HB2  SER   2           HB2      SER   2  32.080 -12.261   3.409
   10    HB3  SER   2           HB3      SER   2  31.239 -12.730   4.888
   11    HA   PRO   3           HA       PRO   3  31.159 -14.155  -0.932
   12    HB2  PRO   3           HB2      PRO   3  28.805 -13.518  -2.068
   13    HB3  PRO   3           HB3      PRO   3  29.078 -15.082  -1.297
   14    HG2  PRO   3           HG2      PRO   3  27.446 -12.808  -0.391
   15    HG3  PRO   3           HG3      PRO   3  27.346 -14.515   0.064
   16    HD2  PRO   3           HD2      PRO   3  28.606 -12.347   1.492
   17    HD3  PRO   3           HD3      PRO   3  28.442 -14.041   1.986
   18    HA   PRO   4           HA       PRO   4  32.170  -9.977  -1.997
   19    HB2  PRO   4           HB2      PRO   4  32.320 -10.223  -4.722
   20    HB3  PRO   4           HB3      PRO   4  33.585 -10.763  -3.615
   21    HG2  PRO   4           HG2      PRO   4  31.446 -12.352  -4.967
   22    HG3  PRO   4           HG3      PRO   4  33.148 -12.766  -4.693
   23    HD2  PRO   4           HD2      PRO   4  31.153 -13.764  -3.168
   24    HD3  PRO   4           HD3      PRO   4  32.768 -13.424  -2.514
   25    H    GLU   5           H        GLU   5  29.606 -10.019  -1.337
   26    HA   GLU   5           HA       GLU   5  28.318  -8.433  -3.441
   27    HB2  GLU   5           HB2      GLU   5  27.004 -10.657  -1.869
   28    HB3  GLU   5           HB3      GLU   5  26.140  -9.513  -2.887
   29    HG2  GLU   5           HG2      GLU   5  27.745 -10.351  -4.745
   30    HG3  GLU   5           HG3      GLU   5  27.978 -11.728  -3.670
   31    H    ALA   6           H        ALA   6  29.683  -7.380  -1.315
   32    HA   ALA   6           HA       ALA   6  29.236  -5.513   0.006
   33    HB1  ALA   6           HB1      ALA   6  27.140  -4.802   0.488
   34    HB2  ALA   6           HB2      ALA   6  26.555  -6.423   0.863
   35    HB3  ALA   6           HB3      ALA   6  26.729  -5.915  -0.817
   36    H    ASP   7           H        ASP   7  30.865  -6.858   1.068
   37    HA   ASP   7           HA       ASP   7  29.866  -8.163   3.504
   38    HB2  ASP   7           HB2      ASP   7  32.621  -8.418   2.279
   39    HB3  ASP   7           HB3      ASP   7  31.948  -9.380   3.593
   40    HA   PRO   8           HA       PRO   8  31.254  -5.209   6.437
   41    HB2  PRO   8           HB2      PRO   8  33.441  -7.190   6.983
   42    HB3  PRO   8           HB3      PRO   8  32.462  -6.265   8.127
   43    HG2  PRO   8           HG2      PRO   8  31.936  -8.855   7.518
   44    HG3  PRO   8           HG3      PRO   8  30.674  -7.696   7.964
   45    HD2  PRO   8           HD2      PRO   8  31.179  -8.962   5.385
   46    HD3  PRO   8           HD3      PRO   8  29.771  -8.017   5.907
   47    H    ARG   9           H        ARG   9  33.969  -6.923   4.884
   48    HA   ARG   9           HA       ARG   9  35.852  -4.907   4.935
   49    HE   ARG   9           HE       ARG   9  37.476  -9.787   5.290
   50    HB2  ARG   9           HB2      ARG   9  35.430  -6.951   2.747
   51    HB3  ARG   9           HB3      ARG   9  36.927  -6.086   3.081
   52    HG2  ARG   9           HG2      ARG   9  37.527  -7.581   4.606
   53    HG3  ARG   9           HG3      ARG   9  35.986  -7.422   5.449
   54    HD2  ARG   9           HD2      ARG   9  34.991  -9.121   4.207
   55    HD3  ARG   9           HD3      ARG   9  36.192  -9.015   2.921
   56   HH11  ARG   9          HH11      ARG   9  35.180 -11.017   2.982
   57   HH12  ARG   9          HH12      ARG   9  35.623 -12.673   3.227
   58   HH21  ARG   9          HH21      ARG   9  38.065 -11.965   5.624
   59   HH22  ARG   9          HH22      ARG   9  37.263 -13.213   4.730
   60    H    LEU  10           H        LEU  10  33.572  -5.630   2.346
   61    HA   LEU  10           HA       LEU  10  34.342  -3.298   0.845
   62    HG   LEU  10           HG       LEU  10  33.593  -6.304  -1.280
   63    HB2  LEU  10           HB2      LEU  10  32.219  -5.380   0.375
   64    HB3  LEU  10           HB3      LEU  10  32.517  -4.038  -0.716
   65   HD11  LEU  10          HD11      LEU  10  34.213  -3.836  -2.025
   66   HD12  LEU  10          HD12      LEU  10  35.175  -5.232  -2.511
   67   HD13  LEU  10          HD13      LEU  10  35.702  -4.225  -1.163
   68   HD21  LEU  10          HD21      LEU  10  35.561  -5.382   0.814
   69   HD22  LEU  10          HD22      LEU  10  35.693  -6.808  -0.215
   70   HD23  LEU  10          HD23      LEU  10  34.435  -6.725   1.018
   71    H    ILE  11           H        ILE  11  31.739  -4.149   3.023
   72    HA   ILE  11           HA       ILE  11  30.226  -1.783   2.340
   73    HB   ILE  11           HB       ILE  11  29.910  -3.692   4.667
   74   HG12  ILE  11          HG12      ILE  11  28.551  -3.450   1.985
   75   HG13  ILE  11          HG13      ILE  11  29.380  -4.849   2.662
   76   HG21  ILE  11          HG21      ILE  11  27.987  -1.567   3.734
   77   HG22  ILE  11          HG22      ILE  11  29.070  -1.393   5.115
   78   HG23  ILE  11          HG23      ILE  11  27.811  -2.629   5.131
   79   HD11  ILE  11          HD11      ILE  11  27.252  -5.510   3.015
   80   HD12  ILE  11          HD12      ILE  11  26.637  -3.861   3.115
   81   HD13  ILE  11          HD13      ILE  11  27.470  -4.577   4.495
   82    H    GLU  12           H        GLU  12  32.714  -2.733   4.409
   83    HA   GLU  12           HA       GLU  12  32.572  -0.277   6.021
   84    HB2  GLU  12           HB2      GLU  12  32.962  -2.479   7.163
   85    HB3  GLU  12           HB3      GLU  12  34.512  -2.571   6.340
   86    HG2  GLU  12           HG2      GLU  12  35.479  -1.235   7.823
   87    HG3  GLU  12           HG3      GLU  12  34.182  -0.046   7.709
   88    H    SER  13           H        SER  13  35.077  -2.139   4.318
   89    HA   SER  13           HA       SER  13  36.790   0.139   4.119
   90    HG   SER  13           HG       SER  13  37.476  -2.421   5.320
   91    HB2  SER  13           HB2      SER  13  37.422  -2.243   2.497
   92    HB3  SER  13           HB3      SER  13  38.430  -1.340   3.627
   93    H    LEU  14           H        LEU  14  34.836  -1.693   1.711
   94    HA   LEU  14           HA       LEU  14  35.892  -0.113  -0.439
   95    HG   LEU  14           HG       LEU  14  33.953  -0.058  -2.357
   96    HB2  LEU  14           HB2      LEU  14  35.065  -2.358  -0.893
   97    HB3  LEU  14           HB3      LEU  14  33.454  -1.890  -0.412
   98   HD11  LEU  14          HD11      LEU  14  34.868  -1.393  -4.264
   99   HD12  LEU  14          HD12      LEU  14  35.391  -2.600  -3.089
  100   HD13  LEU  14          HD13      LEU  14  36.051  -0.965  -3.028
  101   HD21  LEU  14          HD21      LEU  14  31.914  -1.300  -2.192
  102   HD22  LEU  14          HD22      LEU  14  32.741  -2.807  -2.585
  103   HD23  LEU  14          HD23      LEU  14  32.578  -1.548  -3.808
  104    H    SER  15           H        SER  15  32.524  -0.276   0.789
  105    HA   SER  15           HA       SER  15  31.521   1.959  -0.399
  106    HG   SER  15           HG       SER  15  30.353   1.737   3.405
  107    HB2  SER  15           HB2      SER  15  29.783   1.534   0.970
  108    HB3  SER  15           HB3      SER  15  30.785   0.366   1.827
  109    H    GLN  16           H        GLN  16  33.004   1.956   2.836
  110    HA   GLN  16           HA       GLN  16  33.280   4.577   3.390
  111    HB2  GLN  16           HB2      GLN  16  34.236   2.989   4.906
  112    HB3  GLN  16           HB3      GLN  16  35.352   2.396   3.685
  113    HG2  GLN  16           HG2      GLN  16  35.436   5.169   4.841
  114    HG3  GLN  16           HG3      GLN  16  36.390   3.819   5.442
  115   HE21  GLN  16          HE21      GLN  16  37.458   6.240   4.459
  116   HE22  GLN  16          HE22      GLN  16  38.349   5.905   3.014
  117    H    MET  17           H        MET  17  35.174   2.732   1.064
  118    HA   MET  17           HA       MET  17  37.033   4.708   0.379
  119    HB2  MET  17           HB2      MET  17  36.614   2.116  -0.375
  120    HB3  MET  17           HB3      MET  17  36.133   2.980  -1.830
  121    HG2  MET  17           HG2      MET  17  38.478   2.348  -1.906
  122    HG3  MET  17           HG3      MET  17  38.286   4.098  -1.903
  123    HE1  MET  17           HE1      MET  17  40.253   5.448  -0.277
  124    HE2  MET  17           HE2      MET  17  40.630   4.306  -1.567
  125    HE3  MET  17           HE3      MET  17  41.475   4.202  -0.023
  126    H    LEU  18           H        LEU  18  33.845   3.897  -1.046
  127    HA   LEU  18           HA       LEU  18  34.008   6.201  -2.799
  128    HG   LEU  18           HG       LEU  18  33.077   2.842  -3.168
  129    HB2  LEU  18           HB2      LEU  18  31.651   4.401  -2.228
  130    HB3  LEU  18           HB3      LEU  18  31.815   5.516  -3.572
  131   HD11  LEU  18          HD11      LEU  18  31.187   4.066  -4.934
  132   HD12  LEU  18          HD12      LEU  18  31.650   2.370  -4.797
  133   HD13  LEU  18          HD13      LEU  18  32.555   3.447  -5.860
  134   HD21  LEU  18          HD21      LEU  18  34.200   4.849  -5.106
  135   HD22  LEU  18          HD22      LEU  18  34.837   3.260  -4.679
  136   HD23  LEU  18          HD23      LEU  18  34.898   4.579  -3.509
  137    H    SER  19           H        SER  19  31.862   5.170  -0.147
  138    HA   SER  19           HA       SER  19  30.332   7.402   0.175
  139    HG   SER  19           HG       SER  19  29.283   7.094   2.885
  140    HB2  SER  19           HB2      SER  19  29.807   5.544   1.523
  141    HB3  SER  19           HB3      SER  19  31.431   5.470   2.206
  142    H    MET  20           H        MET  20  33.715   7.184   0.722
  143    HA   MET  20           HA       MET  20  33.823   9.504   2.468
  144    HB2  MET  20           HB2      MET  20  35.814   7.574   1.363
  145    HB3  MET  20           HB3      MET  20  36.387   9.162   1.847
  146    HG2  MET  20           HG2      MET  20  35.101   7.055   3.550
  147    HG3  MET  20           HG3      MET  20  36.719   7.740   3.685
  148    HE1  MET  20           HE1      MET  20  32.711   9.365   4.874
  149    HE2  MET  20           HE2      MET  20  33.389   8.103   5.903
  150    HE3  MET  20           HE3      MET  20  33.175   7.813   4.177
  151    H    GLY  21           H        GLY  21  34.247   8.661  -0.875
  152    HA2  GLY  21           HA2      GLY  21  33.793  10.381  -2.543
  153    HA3  GLY  21           HA3      GLY  21  34.652  11.517  -1.505
  154    H    PHE  22           H        PHE  22  35.917   8.323  -1.815
  155    HA   PHE  22           HA       PHE  22  37.842   9.180  -3.831
  156    HD1  PHE  22           HD1      PHE  22  38.947  11.048  -3.040
  157    HD2  PHE  22           HD2      PHE  22  38.849   8.947   0.661
  158    HE1  PHE  22           HE1      PHE  22  39.126  13.181  -1.829
  159    HE2  PHE  22           HE2      PHE  22  39.024  11.077   1.878
  160    HZ   PHE  22           HZ       PHE  22  39.163  13.199   0.634
  161    HB2  PHE  22           HB2      PHE  22  38.639   7.763  -1.284
  162    HB3  PHE  22           HB3      PHE  22  39.709   8.387  -2.541
  163    H    SER  23           H        SER  23  39.362   6.982  -4.057
  164    HA   SER  23           HA       SER  23  37.899   4.571  -3.858
  165    HG   SER  23           HG       SER  23  36.035   6.224  -6.234
  166    HB2  SER  23           HB2      SER  23  38.072   5.906  -6.571
  167    HB3  SER  23           HB3      SER  23  37.730   4.190  -6.362
  168    H    ASP  24           H        ASP  24  39.564   4.282  -6.725
  169    HA   ASP  24           HA       ASP  24  42.105   3.795  -5.327
  170    HB2  ASP  24           HB2      ASP  24  42.141   2.161  -7.568
  171    HB3  ASP  24           HB3      ASP  24  41.840   1.647  -5.910
  172    H    GLU  25           H        GLU  25  43.637   5.173  -6.008
  173    HA   GLU  25           HA       GLU  25  43.485   7.055  -7.912
  174    HB2  GLU  25           HB2      GLU  25  45.476   6.428  -6.348
  175    HB3  GLU  25           HB3      GLU  25  46.076   5.565  -7.759
  176    HG2  GLU  25           HG2      GLU  25  47.098   7.553  -8.104
  177    HG3  GLU  25           HG3      GLU  25  45.574   7.896  -8.921
  178    H    GLY  26           H        GLY  26  44.227   3.704  -8.487
  179    HA2  GLY  26           HA2      GLY  26  43.602   4.100 -11.323
  180    HA3  GLY  26           HA3      GLY  26  45.129   3.327 -10.906
  181    H    GLY  27           H        GLY  27  44.922   1.390  -9.423
  182    HA2  GLY  27           HA2      GLY  27  42.433  -0.027  -9.367
  183    HA3  GLY  27           HA3      GLY  27  43.546  -0.663 -10.576
  184    H    TRP  28           H        TRP  28  44.335   0.754  -7.483
  185    HA   TRP  28           HA       TRP  28  45.731  -1.715  -6.736
  186    HD1  TRP  28           HD1      TRP  28  46.783   2.677  -7.089
  187    HE1  TRP  28           HE1      TRP  28  45.581   4.629  -5.938
  188    HE3  TRP  28           HE3      TRP  28  44.481   0.128  -3.319
  189    HZ2  TRP  28           HZ2      TRP  28  43.887   5.051  -3.738
  190    HZ3  TRP  28           HZ3      TRP  28  43.085   1.378  -1.723
  191    HH2  TRP  28           HH2      TRP  28  42.790   3.792  -1.932
  192    HB2  TRP  28           HB2      TRP  28  46.761  -0.298  -4.933
  193    HB3  TRP  28           HB3      TRP  28  47.142   0.206  -6.579
  194    H    LEU  29           H        LEU  29  43.094   0.342  -5.784
  195    HA   LEU  29           HA       LEU  29  42.595  -0.261  -3.198
  196    HG   LEU  29           HG       LEU  29  39.853  -1.525  -3.490
  197    HB2  LEU  29           HB2      LEU  29  40.958   1.074  -4.048
  198    HB3  LEU  29           HB3      LEU  29  40.827   0.167  -5.540
  199   HD11  LEU  29          HD11      LEU  29  38.236  -0.263  -2.351
  200   HD12  LEU  29          HD12      LEU  29  38.508   1.150  -3.372
  201   HD13  LEU  29          HD13      LEU  29  39.737   0.654  -2.210
  202   HD21  LEU  29          HD21      LEU  29  39.075  -0.477  -6.014
  203   HD22  LEU  29          HD22      LEU  29  37.723  -0.292  -4.895
  204   HD23  LEU  29          HD23      LEU  29  38.438  -1.883  -5.161
  205    H    THR  30           H        THR  30  41.220  -2.259  -5.811
  206    HA   THR  30           HA       THR  30  40.319  -4.382  -4.399
  207    HB   THR  30           HB       THR  30  39.964  -4.772  -6.613
  208    HG1  THR  30           HG1      THR  30  42.472  -6.050  -6.620
  209   HG21  THR  30          HG21      THR  30  42.362  -3.204  -6.981
  210   HG22  THR  30          HG22      THR  30  40.958  -3.394  -8.030
  211   HG23  THR  30          HG23      THR  30  42.276  -4.563  -8.102
  212    H    ARG  31           H        ARG  31  43.638  -3.491  -4.928
  213    HA   ARG  31           HA       ARG  31  44.638  -5.946  -3.712
  214    HE   ARG  31           HE       ARG  31  49.611  -3.548  -3.315
  215    HB2  ARG  31           HB2      ARG  31  46.216  -5.550  -5.266
  216    HB3  ARG  31           HB3      ARG  31  45.721  -3.878  -5.466
  217    HG2  ARG  31           HG2      ARG  31  47.208  -3.107  -3.885
  218    HG3  ARG  31           HG3      ARG  31  47.303  -4.664  -3.061
  219    HD2  ARG  31           HD2      ARG  31  48.603  -5.591  -4.866
  220    HD3  ARG  31           HD3      ARG  31  48.402  -4.118  -5.815
  221   HH11  ARG  31          HH11      ARG  31  50.275  -4.914  -6.446
  222   HH12  ARG  31          HH12      ARG  31  51.965  -4.539  -6.396
  223   HH21  ARG  31          HH21      ARG  31  51.834  -3.048  -3.234
  224   HH22  ARG  31          HH22      ARG  31  52.853  -3.477  -4.568
  225    H    LEU  32           H        LEU  32  45.204  -2.435  -3.216
  226    HA   LEU  32           HA       LEU  32  46.518  -2.333  -0.901
  227    HG   LEU  32           HG       LEU  32  45.148   1.119  -0.282
  228    HB2  LEU  32           HB2      LEU  32  45.664  -0.362  -2.057
  229    HB3  LEU  32           HB3      LEU  32  44.031  -0.734  -1.529
  230   HD11  LEU  32          HD11      LEU  32  43.297  -0.369   0.609
  231   HD12  LEU  32          HD12      LEU  32  44.241   0.538   1.790
  232   HD13  LEU  32          HD13      LEU  32  44.552  -1.180   1.546
  233   HD21  LEU  32          HD21      LEU  32  47.244   0.851   0.380
  234   HD22  LEU  32          HD22      LEU  32  47.208  -0.862  -0.026
  235   HD23  LEU  32          HD23      LEU  32  46.675  -0.323   1.566
  236    H    LEU  33           H        LEU  33  42.947  -2.519  -0.896
  237    HA   LEU  33           HA       LEU  33  42.454  -2.954   1.759
  238    HG   LEU  33           HG       LEU  33  41.053  -1.857  -0.669
  239    HB2  LEU  33           HB2      LEU  33  41.170  -4.380  -0.576
  240    HB3  LEU  33           HB3      LEU  33  40.491  -4.277   1.039
  241   HD11  LEU  33          HD11      LEU  33  38.423  -1.967  -0.764
  242   HD12  LEU  33          HD12      LEU  33  38.718  -3.697  -0.593
  243   HD13  LEU  33          HD13      LEU  33  39.419  -2.812  -1.948
  244   HD21  LEU  33          HD21      LEU  33  39.309  -2.235   1.763
  245   HD22  LEU  33          HD22      LEU  33  39.583  -0.727   0.888
  246   HD23  LEU  33          HD23      LEU  33  40.910  -1.494   1.761
  247    H    GLN  34           H        GLN  34  42.638  -5.579  -0.550
  248    HA   GLN  34           HA       GLN  34  42.826  -7.794   0.960
  249    HB2  GLN  34           HB2      GLN  34  43.845  -6.983  -1.634
  250    HB3  GLN  34           HB3      GLN  34  44.806  -8.271  -0.917
  251    HG2  GLN  34           HG2      GLN  34  43.305  -9.626  -1.862
  252    HG3  GLN  34           HG3      GLN  34  42.285  -9.186  -0.491
  253   HE21  GLN  34          HE21      GLN  34  40.797  -7.402  -0.794
  254   HE22  GLN  34          HE22      GLN  34  40.129  -7.111  -2.361
  255    H    THR  35           H        THR  35  45.698  -5.900   0.033
  256    HA   THR  35           HA       THR  35  47.437  -7.360   1.784
  257    HB   THR  35           HB       THR  35  48.364  -4.740   0.815
  258    HG1  THR  35           HG1      THR  35  47.479  -4.975  -1.071
  259   HG21  THR  35          HG21      THR  35  50.240  -6.001  -0.011
  260   HG22  THR  35          HG22      THR  35  49.408  -7.519   0.333
  261   HG23  THR  35          HG23      THR  35  49.897  -6.461   1.657
  262    H    LYS  36           H        LYS  36  45.130  -5.225   2.461
  263    HA   LYS  36           HA       LYS  36  46.546  -4.196   4.833
  264    HB2  LYS  36           HB2      LYS  36  44.885  -2.750   2.866
  265    HB3  LYS  36           HB3      LYS  36  44.555  -2.378   4.550
  266    HG2  LYS  36           HG2      LYS  36  46.161  -0.823   3.629
  267    HG3  LYS  36           HG3      LYS  36  46.910  -1.810   4.886
  268    HD2  LYS  36           HD2      LYS  36  47.769  -3.302   3.053
  269    HD3  LYS  36           HD3      LYS  36  47.204  -2.093   1.901
  270    HE2  LYS  36           HE2      LYS  36  48.941  -0.744   2.304
  271    HE3  LYS  36           HE3      LYS  36  48.810  -0.959   4.050
  272    HZ1  LYS  36           HZ1      LYS  36  50.691  -2.111   3.859
  273    HZ2  LYS  36           HZ2      LYS  36  50.558  -2.252   2.178
  274    HZ3  LYS  36           HZ3      LYS  36  49.757  -3.352   3.185
  275    H    ASN  37           H        ASN  37  44.876  -6.619   4.375
  276    HA   ASN  37           HA       ASN  37  43.172  -7.770   5.376
  277    HB2  ASN  37           HB2      ASN  37  44.352  -7.507   7.414
  278    HB3  ASN  37           HB3      ASN  37  43.971  -5.788   7.509
  279   HD21  ASN  37          HD21      ASN  37  42.157  -5.146   8.515
  280   HD22  ASN  37          HD22      ASN  37  41.016  -6.212   9.254
  281    H    TYR  38           H        TYR  38  42.373  -5.938   3.522
  282    HA   TYR  38           HA       TYR  38  40.616  -4.648   2.811
  283    HD1  TYR  38           HD2      TYR  38  38.247  -5.730   1.429
  284    HD2  TYR  38           HD1      TYR  38  40.176  -8.440   4.080
  285    HE1  TYR  38           HE2      TYR  38  38.151  -7.477  -0.298
  286    HE2  TYR  38           HE1      TYR  38  40.088 -10.195   2.360
  287    HH   TYR  38           HH       TYR  38  39.038 -10.786   0.383
  288    HB2  TYR  38           HB2      TYR  38  39.282  -6.375   4.902
  289    HB3  TYR  38           HB3      TYR  38  38.388  -5.282   3.852
  290    H    ASP  39           H        ASP  39  42.135  -3.089   4.143
  291    HA   ASP  39           HA       ASP  39  40.406  -1.693   6.091
  292    HB2  ASP  39           HB2      ASP  39  43.422  -1.895   6.088
  293    HB3  ASP  39           HB3      ASP  39  42.485  -0.875   7.179
  294    H    ILE  40           H        ILE  40  40.035   0.420   5.809
  295    HA   ILE  40           HA       ILE  40  41.039   1.630   3.372
  296    HB   ILE  40           HB       ILE  40  39.461   3.468   3.896
  297   HG12  ILE  40          HG12      ILE  40  39.635   2.780   6.457
  298   HG13  ILE  40          HG13      ILE  40  38.201   3.571   5.815
  299   HG21  ILE  40          HG21      ILE  40  38.502   1.958   2.461
  300   HG22  ILE  40          HG22      ILE  40  37.360   1.911   3.804
  301   HG23  ILE  40          HG23      ILE  40  38.571   0.639   3.629
  302   HD11  ILE  40          HD11      ILE  40  38.125   0.660   5.628
  303   HD12  ILE  40          HD12      ILE  40  36.910   1.797   6.213
  304   HD13  ILE  40          HD13      ILE  40  38.219   1.278   7.276
  305    H    GLY  41           H        GLY  41  41.433   1.719   6.785
  306    HA2  GLY  41           HA2      GLY  41  42.355   4.147   7.419
  307    HA3  GLY  41           HA3      GLY  41  43.146   2.698   8.002
  308    H    ALA  42           H        ALA  42  44.213   1.697   5.760
  309    HA   ALA  42           HA       ALA  42  46.327   3.617   5.178
  310    HB1  ALA  42           HB1      ALA  42  46.686   0.963   4.050
  311    HB2  ALA  42           HB2      ALA  42  46.391   0.925   5.789
  312    HB3  ALA  42           HB3      ALA  42  47.728   1.875   5.142
  313    H    ALA  43           H        ALA  43  43.574   2.236   3.738
  314    HA   ALA  43           HA       ALA  43  44.328   2.260   1.020
  315    HB1  ALA  43           HB1      ALA  43  41.571   2.896   2.058
  316    HB2  ALA  43           HB2      ALA  43  42.218   1.259   1.960
  317    HB3  ALA  43           HB3      ALA  43  42.006   2.212   0.492
  318    H    LEU  44           H        LEU  44  43.022   4.745   3.161
  319    HA   LEU  44           HA       LEU  44  42.634   6.789   1.321
  320    HG   LEU  44           HG       LEU  44  40.994   7.590   2.422
  321    HB2  LEU  44           HB2      LEU  44  43.020   6.571   4.225
  322    HB3  LEU  44           HB3      LEU  44  43.497   8.120   3.547
  323   HD11  LEU  44          HD11      LEU  44  40.682   7.262   5.370
  324   HD12  LEU  44          HD12      LEU  44  40.968   5.844   4.360
  325   HD13  LEU  44          HD13      LEU  44  39.559   6.865   4.068
  326   HD21  LEU  44          HD21      LEU  44  40.698   9.292   4.664
  327   HD22  LEU  44          HD22      LEU  44  40.887   9.736   2.968
  328   HD23  LEU  44          HD23      LEU  44  42.309   9.562   3.998
  329    H    ASP  45           H        ASP  45  45.409   6.387   3.486
  330    HA   ASP  45           HA       ASP  45  47.118   8.264   2.692
  331    HB2  ASP  45           HB2      ASP  45  47.869   6.784   4.356
  332    HB3  ASP  45           HB3      ASP  45  47.678   5.377   3.314
  333    H    THR  46           H        THR  46  46.153   5.583   0.668
  334    HA   THR  46           HA       THR  46  48.274   6.156  -1.235
  335    HB   THR  46           HB       THR  46  47.652   4.162  -2.345
  336    HG1  THR  46           HG1      THR  46  45.707   3.290  -2.236
  337   HG21  THR  46          HG21      THR  46  47.615   4.010   0.609
  338   HG22  THR  46          HG22      THR  46  48.726   3.287  -0.555
  339   HG23  THR  46          HG23      THR  46  47.133   2.576  -0.297
  340    H    ILE  47           H        ILE  47  44.805   6.686  -0.949
  341    HA   ILE  47           HA       ILE  47  44.416   7.220  -3.720
  342    HB   ILE  47           HB       ILE  47  42.330   8.521  -2.756
  343   HG12  ILE  47          HG12      ILE  47  42.966   6.628  -0.493
  344   HG13  ILE  47          HG13      ILE  47  43.241   8.367  -0.408
  345   HG21  ILE  47          HG21      ILE  47  42.476   5.524  -2.525
  346   HG22  ILE  47          HG22      ILE  47  42.422   6.380  -4.065
  347   HG23  ILE  47          HG23      ILE  47  41.076   6.514  -2.933
  348   HD11  ILE  47          HD11      ILE  47  40.543   7.301  -1.113
  349   HD12  ILE  47          HD12      ILE  47  40.982   8.852  -0.397
  350   HD13  ILE  47          HD13      ILE  47  41.065   7.379   0.568
  351    H    GLN  48           H        GLN  48  45.321   9.249  -1.004
  352    HA   GLN  48           HA       GLN  48  46.170  11.326  -2.798
  353    HB2  GLN  48           HB2      GLN  48  43.643  11.596  -1.232
  354    HB3  GLN  48           HB3      GLN  48  44.677  13.006  -1.386
  355    HG2  GLN  48           HG2      GLN  48  43.924  13.409  -3.422
  356    HG3  GLN  48           HG3      GLN  48  44.307  11.773  -3.951
  357   HE21  GLN  48          HE21      GLN  48  42.709  10.122  -3.627
  358   HE22  GLN  48          HE22      GLN  48  41.029  10.538  -3.532
  359    H    TYR  49           H        TYR  49  45.105  10.948   0.567
  360    HA   TYR  49           HA       TYR  49  47.115  12.628   1.638
  361    HD1  TYR  49           HD2      TYR  49  45.878  14.127   3.826
  362    HD2  TYR  49           HD1      TYR  49  43.273  11.393   1.867
  363    HE1  TYR  49           HE2      TYR  49  44.139  15.863   3.726
  364    HE2  TYR  49           HE1      TYR  49  41.527  13.121   1.762
  365    HH   TYR  49           HH       TYR  49  41.659  15.873   1.774
  366    HB2  TYR  49           HB2      TYR  49  45.276  10.609   2.920
  367    HB3  TYR  49           HB3      TYR  49  46.321  11.697   3.827
  368    H    SER  50           H        SER  50  48.673  11.009   0.161
  369    HA   SER  50           HA       SER  50  49.665   8.824   1.777
  370    HG   SER  50           HG       SER  50  50.645   7.189  -0.235
  371    HB2  SER  50           HB2      SER  50  49.536   8.902  -0.805
  372    HB3  SER  50           HB3      SER  50  50.992   9.891  -0.706
  373    H    LYS  51           H        LYS  51  49.882  11.058   3.267
  374    HA   LYS  51           HA       LYS  51  52.572  11.105   4.002
  375    HB2  LYS  51           HB2      LYS  51  52.857  12.345   1.883
  376    HB3  LYS  51           HB3      LYS  51  51.736  13.569   2.465
  377    HG2  LYS  51           HG2      LYS  51  54.227  14.057   2.653
  378    HG3  LYS  51           HG3      LYS  51  53.229  14.341   4.081
  379    HD2  LYS  51           HD2      LYS  51  54.055  12.473   5.186
  380    HD3  LYS  51           HD3      LYS  51  54.595  11.706   3.691
  381    HE2  LYS  51           HE2      LYS  51  56.467  13.098   3.519
  382    HE3  LYS  51           HE3      LYS  51  55.809  14.271   4.660
  383    HZ1  LYS  51           HZ1      LYS  51  57.626  12.423   5.299
  384    HZ2  LYS  51           HZ2      LYS  51  56.206  11.603   5.717
  385    HZ3  LYS  51           HZ3      LYS  51  56.549  13.106   6.411
  386    H    HIS  52           H        HIS  52  50.802  10.729   5.732
  387    HA   HIS  52           HA       HIS  52  49.954  13.287   6.899
  388    HD1  HIS  52           HD1      HIS  52  49.046  10.352   9.958
  389    HD2  HIS  52           HD2      HIS  52  47.120  13.702   8.428
  390    HE1  HIS  52           HE1      HIS  52  47.854  11.439  11.906
  391    HB2  HIS  52           HB2      HIS  52  48.115  11.772   6.641
  392    HB3  HIS  52           HB3      HIS  52  49.019  10.455   7.382
  Start of MODEL   17
    1    H1   GLY   1           1H       GLY   1  26.979 -15.325   3.811
    2    H2   GLY   1           2H       GLY   1  27.987 -16.569   4.357
    3    H3   GLY   1           3H       GLY   1  26.488 -16.939   3.665
    4    HA2  GLY   1           HA2      GLY   1  28.907 -16.841   2.374
    5    HA3  GLY   1           HA3      GLY   1  27.321 -16.968   1.629
    6    H    SER   2           H        SER   2  29.681 -14.623   2.849
    7    HA   SER   2           HA       SER   2  28.466 -12.449   1.393
    8    HG   SER   2           HG       SER   2  30.085 -11.740   4.578
    9    HB2  SER   2           HB2      SER   2  31.193 -12.409   2.680
   10    HB3  SER   2           HB3      SER   2  30.102 -11.055   2.388
   11    HA   PRO   3           HA       PRO   3  30.996 -13.384  -2.180
   12    HB2  PRO   3           HB2      PRO   3  29.440 -11.977  -3.930
   13    HB3  PRO   3           HB3      PRO   3  29.068 -13.611  -3.378
   14    HG2  PRO   3           HG2      PRO   3  27.693 -11.126  -2.778
   15    HG3  PRO   3           HG3      PRO   3  27.197 -12.785  -2.419
   16    HD2  PRO   3           HD2      PRO   3  28.436 -10.808  -0.663
   17    HD3  PRO   3           HD3      PRO   3  27.657 -12.347  -0.250
   18    HA   PRO   4           HA       PRO   4  33.704  -9.956  -2.707
   19    HB2  PRO   4           HB2      PRO   4  33.465 -10.400  -5.637
   20    HB3  PRO   4           HB3      PRO   4  34.909 -10.350  -4.620
   21    HG2  PRO   4           HG2      PRO   4  33.975 -12.670  -5.540
   22    HG3  PRO   4           HG3      PRO   4  34.640 -12.541  -3.902
   23    HD2  PRO   4           HD2      PRO   4  31.791 -12.693  -4.787
   24    HD3  PRO   4           HD3      PRO   4  32.570 -13.405  -3.358
   25    H    GLU   5           H        GLU   5  31.731  -8.635  -2.069
   26    HA   GLU   5           HA       GLU   5  31.573  -6.272  -3.356
   27    HB2  GLU   5           HB2      GLU   5  30.772  -7.175  -5.390
   28    HB3  GLU   5           HB3      GLU   5  29.615  -8.212  -4.569
   29    HG2  GLU   5           HG2      GLU   5  28.951  -5.586  -3.846
   30    HG3  GLU   5           HG3      GLU   5  29.288  -5.552  -5.576
   31    H    ALA   6           H        ALA   6  31.391  -5.860  -1.100
   32    HA   ALA   6           HA       ALA   6  29.979  -4.760   0.411
   33    HB1  ALA   6           HB1      ALA   6  28.044  -5.127  -1.162
   34    HB2  ALA   6           HB2      ALA   6  27.659  -5.125   0.559
   35    HB3  ALA   6           HB3      ALA   6  27.764  -6.651  -0.319
   36    H    ASP   7           H        ASP   7  31.849  -6.631   0.922
   37    HA   ASP   7           HA       ASP   7  30.709  -8.554   2.800
   38    HB2  ASP   7           HB2      ASP   7  33.231  -8.306   1.314
   39    HB3  ASP   7           HB3      ASP   7  33.453  -8.783   2.995
   40    HA   PRO   8           HA       PRO   8  31.158  -6.469   6.659
   41    HB2  PRO   8           HB2      PRO   8  33.671  -8.060   7.009
   42    HB3  PRO   8           HB3      PRO   8  32.365  -7.766   8.160
   43    HG2  PRO   8           HG2      PRO   8  32.629 -10.063   6.664
   44    HG3  PRO   8           HG3      PRO   8  31.107  -9.485   7.357
   45    HD2  PRO   8           HD2      PRO   8  31.835  -9.686   4.581
   46    HD3  PRO   8           HD3      PRO   8  30.302  -9.119   5.273
   47    H    ARG   9           H        ARG   9  34.437  -7.162   5.432
   48    HA   ARG   9           HA       ARG   9  35.564  -4.725   6.181
   49    HE   ARG   9           HE       ARG   9  37.602  -9.640   4.324
   50    HB2  ARG   9           HB2      ARG   9  36.348  -6.583   3.931
   51    HB3  ARG   9           HB3      ARG   9  37.365  -5.304   4.593
   52    HG2  ARG   9           HG2      ARG   9  38.209  -7.023   5.785
   53    HG3  ARG   9           HG3      ARG   9  36.856  -6.636   6.850
   54    HD2  ARG   9           HD2      ARG   9  36.147  -8.727   6.596
   55    HD3  ARG   9           HD3      ARG   9  35.814  -8.352   4.907
   56   HH11  ARG   9          HH11      ARG   9  37.921  -8.747   7.675
   57   HH12  ARG   9          HH12      ARG   9  39.316  -9.739   7.941
   58   HH21  ARG   9          HH21      ARG   9  39.434 -10.951   4.662
   59   HH22  ARG   9          HH22      ARG   9  40.178 -10.992   6.226
   60    H    LEU  10           H        LEU  10  34.780  -5.743   2.860
   61    HA   LEU  10           HA       LEU  10  35.250  -3.371   1.618
   62    HG   LEU  10           HG       LEU  10  34.679  -6.905   0.701
   63    HB2  LEU  10           HB2      LEU  10  33.107  -5.290   0.755
   64    HB3  LEU  10           HB3      LEU  10  34.046  -4.214  -0.258
   65   HD11  LEU  10          HD11      LEU  10  34.801  -6.905  -1.538
   66   HD12  LEU  10          HD12      LEU  10  36.440  -6.306  -1.267
   67   HD13  LEU  10          HD13      LEU  10  35.134  -5.175  -1.622
   68   HD21  LEU  10          HD21      LEU  10  36.361  -6.244   2.072
   69   HD22  LEU  10          HD22      LEU  10  36.527  -4.671   1.293
   70   HD23  LEU  10          HD23      LEU  10  37.227  -6.104   0.545
   71    H    ILE  11           H        ILE  11  32.413  -4.268   3.432
   72    HA   ILE  11           HA       ILE  11  30.939  -1.948   2.488
   73    HB   ILE  11           HB       ILE  11  29.964  -4.245   3.422
   74   HG12  ILE  11          HG12      ILE  11  28.911  -1.462   3.491
   75   HG13  ILE  11          HG13      ILE  11  28.381  -2.839   2.534
   76   HG21  ILE  11          HG21      ILE  11  30.269  -2.557   5.896
   77   HG22  ILE  11          HG22      ILE  11  30.845  -4.201   5.623
   78   HG23  ILE  11          HG23      ILE  11  29.117  -3.884   5.762
   79   HD11  ILE  11          HD11      ILE  11  27.787  -2.301   5.431
   80   HD12  ILE  11          HD12      ILE  11  27.377  -3.798   4.594
   81   HD13  ILE  11          HD13      ILE  11  26.656  -2.273   4.079
   82    H    GLU  12           H        GLU  12  33.279  -2.746   4.668
   83    HA   GLU  12           HA       GLU  12  32.848  -0.472   6.461
   84    HB2  GLU  12           HB2      GLU  12  33.676  -2.928   7.089
   85    HB3  GLU  12           HB3      GLU  12  35.243  -2.229   6.708
   86    HG2  GLU  12           HG2      GLU  12  33.301  -1.371   8.827
   87    HG3  GLU  12           HG3      GLU  12  34.938  -1.992   9.032
   88    H    SER  13           H        SER  13  35.673  -1.846   4.780
   89    HA   SER  13           HA       SER  13  36.939   0.714   4.650
   90    HG   SER  13           HG       SER  13  37.921  -2.490   5.387
   91    HB2  SER  13           HB2      SER  13  37.832  -1.868   3.368
   92    HB3  SER  13           HB3      SER  13  38.831  -0.467   3.746
   93    H    LEU  14           H        LEU  14  35.509  -1.495   2.222
   94    HA   LEU  14           HA       LEU  14  36.290   0.143   0.025
   95    HG   LEU  14           HG       LEU  14  36.284  -0.860  -1.849
   96    HB2  LEU  14           HB2      LEU  14  35.246  -2.367   0.214
   97    HB3  LEU  14           HB3      LEU  14  33.855  -1.465  -0.350
   98   HD11  LEU  14          HD11      LEU  14  35.381  -3.422  -2.783
   99   HD12  LEU  14          HD12      LEU  14  35.981  -3.541  -1.128
  100   HD13  LEU  14          HD13      LEU  14  37.014  -2.879  -2.395
  101   HD21  LEU  14          HD21      LEU  14  33.749  -2.030  -2.921
  102   HD22  LEU  14          HD22      LEU  14  34.839  -0.857  -3.659
  103   HD23  LEU  14          HD23      LEU  14  33.789  -0.369  -2.328
  104    H    SER  15           H        SER  15  33.002  -0.498   1.219
  105    HA   SER  15           HA       SER  15  31.622   1.482   0.001
  106    HG   SER  15           HG       SER  15  30.129   0.172   0.292
  107    HB2  SER  15           HB2      SER  15  31.394   0.236   2.699
  108    HB3  SER  15           HB3      SER  15  30.446   1.693   2.404
  109    H    GLN  16           H        GLN  16  32.774   2.012   3.321
  110    HA   GLN  16           HA       GLN  16  32.516   4.669   3.546
  111    HB2  GLN  16           HB2      GLN  16  33.980   4.619   5.299
  112    HB3  GLN  16           HB3      GLN  16  33.747   2.894   5.088
  113    HG2  GLN  16           HG2      GLN  16  36.049   3.160   5.333
  114    HG3  GLN  16           HG3      GLN  16  35.809   2.959   3.598
  115   HE21  GLN  16          HE21      GLN  16  37.185   4.185   2.545
  116   HE22  GLN  16          HE22      GLN  16  37.596   5.820   2.924
  117    H    MET  17           H        MET  17  34.986   3.047   1.659
  118    HA   MET  17           HA       MET  17  36.515   5.350   1.044
  119    HB2  MET  17           HB2      MET  17  37.141   2.858   0.810
  120    HB3  MET  17           HB3      MET  17  36.310   2.939  -0.737
  121    HG2  MET  17           HG2      MET  17  37.912   5.068  -0.990
  122    HG3  MET  17           HG3      MET  17  38.897   4.086   0.094
  123    HE1  MET  17           HE1      MET  17  36.549   2.795  -3.112
  124    HE2  MET  17           HE2      MET  17  37.791   3.325  -4.247
  125    HE3  MET  17           HE3      MET  17  37.073   4.479  -3.123
  126    H    LEU  18           H        LEU  18  33.738   3.803  -0.505
  127    HA   LEU  18           HA       LEU  18  33.867   5.293  -2.906
  128    HG   LEU  18           HG       LEU  18  33.606   3.109  -3.588
  129    HB2  LEU  18           HB2      LEU  18  31.855   3.595  -1.550
  130    HB3  LEU  18           HB3      LEU  18  31.265   4.696  -2.781
  131   HD11  LEU  18          HD11      LEU  18  30.977   1.802  -2.926
  132   HD12  LEU  18          HD12      LEU  18  32.585   1.369  -2.341
  133   HD13  LEU  18          HD13      LEU  18  32.162   1.104  -4.033
  134   HD21  LEU  18          HD21      LEU  18  32.024   4.671  -4.943
  135   HD22  LEU  18          HD22      LEU  18  30.972   3.257  -4.988
  136   HD23  LEU  18          HD23      LEU  18  32.597   3.167  -5.662
  137    H    SER  19           H        SER  19  31.642   5.717  -0.139
  138    HA   SER  19           HA       SER  19  30.724   8.235  -1.149
  139    HG   SER  19           HG       SER  19  30.886   6.283   1.847
  140    HB2  SER  19           HB2      SER  19  29.646   8.189   1.293
  141    HB3  SER  19           HB3      SER  19  28.996   7.239  -0.043
  142    H    MET  20           H        MET  20  33.545   7.515   0.401
  143    HA   MET  20           HA       MET  20  33.525   9.958   2.020
  144    HB2  MET  20           HB2      MET  20  34.359   7.911   3.094
  145    HB3  MET  20           HB3      MET  20  35.601   7.765   1.857
  146    HG2  MET  20           HG2      MET  20  36.945   8.991   3.110
  147    HG3  MET  20           HG3      MET  20  35.838  10.350   2.933
  148    HE1  MET  20           HE1      MET  20  33.878  10.856   4.498
  149    HE2  MET  20           HE2      MET  20  35.338  11.613   5.135
  150    HE3  MET  20           HE3      MET  20  34.217  10.805   6.228
  151    H    GLY  21           H        GLY  21  33.691   9.749  -0.997
  152    HA2  GLY  21           HA2      GLY  21  34.725  10.977  -2.657
  153    HA3  GLY  21           HA3      GLY  21  35.524  11.886  -1.374
  154    H    PHE  22           H        PHE  22  35.674   8.450  -2.075
  155    HA   PHE  22           HA       PHE  22  38.453   8.720  -2.927
  156    HD1  PHE  22           HD2      PHE  22  40.065   9.381  -1.768
  157    HD2  PHE  22           HD1      PHE  22  37.834   7.685   1.435
  158    HE1  PHE  22           HE2      PHE  22  41.071  11.000  -0.213
  159    HE2  PHE  22           HE1      PHE  22  38.835   9.303   2.995
  160    HZ   PHE  22           HZ       PHE  22  40.455  10.962   2.170
  161    HB2  PHE  22           HB2      PHE  22  37.469   6.928  -0.698
  162    HB3  PHE  22           HB3      PHE  22  39.026   6.716  -1.494
  163    H    SER  23           H        SER  23  39.135   7.070  -4.318
  164    HA   SER  23           HA       SER  23  37.200   5.016  -4.978
  165    HG   SER  23           HG       SER  23  35.818   7.055  -6.015
  166    HB2  SER  23           HB2      SER  23  38.367   6.680  -7.204
  167    HB3  SER  23           HB3      SER  23  36.991   5.577  -7.262
  168    H    ASP  24           H        ASP  24  38.313   3.669  -6.951
  169    HA   ASP  24           HA       ASP  24  40.964   3.024  -5.921
  170    HB2  ASP  24           HB2      ASP  24  40.703   1.130  -7.705
  171    HB3  ASP  24           HB3      ASP  24  39.763   1.051  -6.215
  172    H    GLU  25           H        GLU  25  42.647   4.062  -6.758
  173    HA   GLU  25           HA       GLU  25  42.480   5.078  -9.491
  174    HB2  GLU  25           HB2      GLU  25  43.218   6.547  -7.597
  175    HB3  GLU  25           HB3      GLU  25  44.663   5.555  -7.460
  176    HG2  GLU  25           HG2      GLU  25  45.112   6.114  -9.885
  177    HG3  GLU  25           HG3      GLU  25  43.836   7.323  -9.740
  178    H    GLY  26           H        GLY  26  42.668   2.348  -9.491
  179    HA2  GLY  26           HA2      GLY  26  44.445   1.627 -11.312
  180    HA3  GLY  26           HA3      GLY  26  45.472   1.658  -9.884
  181    H    GLY  27           H        GLY  27  42.544   0.773  -8.707
  182    HA2  GLY  27           HA2      GLY  27  41.431  -1.275  -8.489
  183    HA3  GLY  27           HA3      GLY  27  42.664  -2.027  -9.494
  184    H    TRP  28           H        TRP  28  43.462   0.000  -6.774
  185    HA   TRP  28           HA       TRP  28  44.730  -2.291  -5.481
  186    HD1  TRP  28           HD1      TRP  28  45.827   1.696  -7.039
  187    HE1  TRP  28           HE1      TRP  28  44.668   3.927  -6.553
  188    HE3  TRP  28           HE3      TRP  28  43.645   0.545  -2.559
  189    HZ2  TRP  28           HZ2      TRP  28  43.041   5.071  -4.554
  190    HZ3  TRP  28           HZ3      TRP  28  42.301   2.264  -1.425
  191    HH2  TRP  28           HH2      TRP  28  42.004   4.481  -2.408
  192    HB2  TRP  28           HB2      TRP  28  45.754  -0.473  -4.021
  193    HB3  TRP  28           HB3      TRP  28  46.224  -0.468  -5.723
  194    H    LEU  29           H        LEU  29  42.217   0.145  -4.900
  195    HA   LEU  29           HA       LEU  29  41.808   0.043  -2.246
  196    HG   LEU  29           HG       LEU  29  38.697  -1.345  -3.104
  197    HB2  LEU  29           HB2      LEU  29  40.174   1.289  -3.200
  198    HB3  LEU  29           HB3      LEU  29  39.989   0.202  -4.566
  199   HD11  LEU  29          HD11      LEU  29  38.275  -0.962  -0.910
  200   HD12  LEU  29          HD12      LEU  29  38.320   0.790  -1.092
  201   HD13  LEU  29          HD13      LEU  29  39.825  -0.126  -1.019
  202   HD21  LEU  29          HD21      LEU  29  36.939   0.779  -2.679
  203   HD22  LEU  29          HD22      LEU  29  37.017  -0.274  -4.092
  204   HD23  LEU  29          HD23      LEU  29  37.904   1.250  -4.077
  205    H    THR  30           H        THR  30  40.159  -2.282  -4.374
  206    HA   THR  30           HA       THR  30  39.640  -4.073  -2.218
  207    HB   THR  30           HB       THR  30  38.053  -4.328  -3.858
  208    HG1  THR  30           HG1      THR  30  39.981  -6.228  -4.696
  209   HG21  THR  30          HG21      THR  30  38.665  -4.614  -6.305
  210   HG22  THR  30          HG22      THR  30  40.253  -3.993  -5.860
  211   HG23  THR  30          HG23      THR  30  38.819  -2.998  -5.619
  212    H    ARG  31           H        ARG  31  42.408  -3.532  -4.136
  213    HA   ARG  31           HA       ARG  31  43.391  -6.263  -3.791
  214    HE   ARG  31           HE       ARG  31  43.201  -8.281  -5.376
  215    HB2  ARG  31           HB2      ARG  31  44.045  -4.012  -5.559
  216    HB3  ARG  31           HB3      ARG  31  45.438  -4.912  -4.983
  217    HG2  ARG  31           HG2      ARG  31  44.392  -5.634  -7.188
  218    HG3  ARG  31           HG3      ARG  31  44.730  -6.891  -5.995
  219    HD2  ARG  31           HD2      ARG  31  42.110  -5.833  -5.554
  220    HD3  ARG  31           HD3      ARG  31  42.278  -6.291  -7.248
  221   HH11  ARG  31          HH11      ARG  31  40.512  -7.040  -7.198
  222   HH12  ARG  31          HH12      ARG  31  39.624  -8.527  -7.160
  223   HH21  ARG  31          HH21      ARG  31  42.041 -10.256  -5.318
  224   HH22  ARG  31          HH22      ARG  31  40.493 -10.354  -6.090
  225    H    LEU  32           H        LEU  32  44.916  -3.033  -3.358
  226    HA   LEU  32           HA       LEU  32  46.965  -3.868  -1.711
  227    HG   LEU  32           HG       LEU  32  44.430  -1.000  -1.824
  228    HB2  LEU  32           HB2      LEU  32  47.300  -1.615  -1.099
  229    HB3  LEU  32           HB3      LEU  32  46.676  -1.593  -2.737
  230   HD11  LEU  32          HD11      LEU  32  44.972   0.088   0.632
  231   HD12  LEU  32          HD12      LEU  32  45.813  -1.460   0.699
  232   HD13  LEU  32          HD13      LEU  32  44.087  -1.409   0.344
  233   HD21  LEU  32          HD21      LEU  32  45.126   1.316  -1.083
  234   HD22  LEU  32          HD22      LEU  32  45.715   0.786  -2.659
  235   HD23  LEU  32          HD23      LEU  32  46.790   0.765  -1.262
  236    H    LEU  33           H        LEU  33  43.626  -3.350  -0.909
  237    HA   LEU  33           HA       LEU  33  43.780  -3.076   1.868
  238    HG   LEU  33           HG       LEU  33  41.490  -2.640   2.711
  239    HB2  LEU  33           HB2      LEU  33  41.759  -3.725  -0.093
  240    HB3  LEU  33           HB3      LEU  33  41.551  -4.700   1.345
  241   HD11  LEU  33          HD11      LEU  33  40.878  -0.643   0.936
  242   HD12  LEU  33          HD12      LEU  33  42.245  -1.448   0.169
  243   HD13  LEU  33          HD13      LEU  33  42.400  -0.818   1.808
  244   HD21  LEU  33          HD21      LEU  33  39.328  -3.130   2.430
  245   HD22  LEU  33          HD22      LEU  33  39.529  -3.444   0.707
  246   HD23  LEU  33          HD23      LEU  33  39.320  -1.790   1.284
  247    H    GLN  34           H        GLN  34  43.362  -5.988  -0.071
  248    HA   GLN  34           HA       GLN  34  43.347  -7.992   1.750
  249    HB2  GLN  34           HB2      GLN  34  44.159  -7.660  -0.992
  250    HB3  GLN  34           HB3      GLN  34  45.126  -8.901  -0.205
  251    HG2  GLN  34           HG2      GLN  34  43.424 -10.209  -0.903
  252    HG3  GLN  34           HG3      GLN  34  42.716  -9.674   0.622
  253   HE21  GLN  34          HE21      GLN  34  41.857  -7.196   0.117
  254   HE22  GLN  34          HE22      GLN  34  40.662  -7.192  -1.131
  255    H    THR  35           H        THR  35  46.330  -6.582   0.388
  256    HA   THR  35           HA       THR  35  48.028  -7.961   2.248
  257    HB   THR  35           HB       THR  35  48.956  -5.574   0.706
  258    HG1  THR  35           HG1      THR  35  47.906  -7.916  -0.364
  259   HG21  THR  35          HG21      THR  35  50.507  -7.933   0.340
  260   HG22  THR  35          HG22      THR  35  50.216  -7.684   2.061
  261   HG23  THR  35          HG23      THR  35  50.959  -6.408   1.098
  262    H    LYS  36           H        LYS  36  45.973  -5.557   2.663
  263    HA   LYS  36           HA       LYS  36  47.521  -4.318   4.832
  264    HB2  LYS  36           HB2      LYS  36  46.123  -3.050   2.630
  265    HB3  LYS  36           HB3      LYS  36  45.496  -2.514   4.175
  266    HG2  LYS  36           HG2      LYS  36  47.153  -1.024   4.088
  267    HG3  LYS  36           HG3      LYS  36  48.167  -2.365   4.615
  268    HD2  LYS  36           HD2      LYS  36  48.831  -2.834   2.365
  269    HD3  LYS  36           HD3      LYS  36  47.650  -1.688   1.723
  270    HE2  LYS  36           HE2      LYS  36  48.855   0.145   2.832
  271    HE3  LYS  36           HE3      LYS  36  50.042  -1.011   3.431
  272    HZ1  LYS  36           HZ1      LYS  36  49.694  -1.213   0.608
  273    HZ2  LYS  36           HZ2      LYS  36  51.110  -0.971   1.499
  274    HZ3  LYS  36           HZ3      LYS  36  50.150   0.351   1.061
  275    H    ASN  37           H        ASN  37  45.641  -6.638   4.580
  276    HA   ASN  37           HA       ASN  37  43.927  -7.605   5.714
  277    HB2  ASN  37           HB2      ASN  37  45.242  -7.176   7.670
  278    HB3  ASN  37           HB3      ASN  37  44.766  -5.478   7.692
  279   HD21  ASN  37          HD21      ASN  37  43.013  -4.897   8.797
  280   HD22  ASN  37          HD22      ASN  37  41.920  -5.984   9.575
  281    H    TYR  38           H        TYR  38  43.079  -5.865   3.730
  282    HA   TYR  38           HA       TYR  38  41.341  -4.535   3.072
  283    HD1  TYR  38           HD2      TYR  38  39.145  -5.820   1.705
  284    HD2  TYR  38           HD1      TYR  38  40.868  -8.290   4.708
  285    HE1  TYR  38           HE2      TYR  38  39.092  -7.728   0.157
  286    HE2  TYR  38           HE1      TYR  38  40.820 -10.206   3.168
  287    HH   TYR  38           HH       TYR  38  40.272 -10.933   1.146
  288    HB2  TYR  38           HB2      TYR  38  40.021  -6.133   5.271
  289    HB3  TYR  38           HB3      TYR  38  39.147  -5.159   4.093
  290    H    ASP  39           H        ASP  39  42.765  -2.791   4.149
  291    HA   ASP  39           HA       ASP  39  41.099  -1.507   6.216
  292    HB2  ASP  39           HB2      ASP  39  43.078  -0.551   7.244
  293    HB3  ASP  39           HB3      ASP  39  43.201  -2.308   7.189
  294    H    ILE  40           H        ILE  40  40.627   0.556   6.091
  295    HA   ILE  40           HA       ILE  40  40.997   1.894   3.563
  296    HB   ILE  40           HB       ILE  40  39.796   3.796   4.948
  297   HG12  ILE  40          HG12      ILE  40  40.107   2.236   7.037
  298   HG13  ILE  40          HG13      ILE  40  38.631   3.173   6.842
  299   HG21  ILE  40          HG21      ILE  40  38.731   1.381   3.618
  300   HG22  ILE  40          HG22      ILE  40  38.544   3.085   3.208
  301   HG23  ILE  40          HG23      ILE  40  37.595   2.386   4.515
  302   HD11  ILE  40          HD11      ILE  40  37.356   1.337   6.472
  303   HD12  ILE  40          HD12      ILE  40  38.613   0.606   7.469
  304   HD13  ILE  40          HD13      ILE  40  38.671   0.438   5.714
  305    H    GLY  41           H        GLY  41  42.288   1.850   6.746
  306    HA2  GLY  41           HA2      GLY  41  43.364   4.287   7.137
  307    HA3  GLY  41           HA3      GLY  41  44.217   2.817   7.552
  308    H    ALA  42           H        ALA  42  44.970   1.697   5.415
  309    HA   ALA  42           HA       ALA  42  46.977   3.390   4.317
  310    HB1  ALA  42           HB1      ALA  42  46.625   0.650   4.601
  311    HB2  ALA  42           HB2      ALA  42  47.987   1.464   3.830
  312    HB3  ALA  42           HB3      ALA  42  46.617   0.922   2.859
  313    H    ALA  43           H        ALA  43  43.770   2.597   3.476
  314    HA   ALA  43           HA       ALA  43  43.862   2.956   0.682
  315    HB1  ALA  43           HB1      ALA  43  41.489   3.279   0.780
  316    HB2  ALA  43           HB2      ALA  43  41.560   3.716   2.487
  317    HB3  ALA  43           HB3      ALA  43  41.906   2.061   1.983
  318    H    LEU  44           H        LEU  44  42.714   5.282   3.142
  319    HA   LEU  44           HA       LEU  44  42.644   7.589   1.694
  320    HG   LEU  44           HG       LEU  44  41.349   8.930   3.170
  321    HB2  LEU  44           HB2      LEU  44  43.170   6.936   4.524
  322    HB3  LEU  44           HB3      LEU  44  43.686   8.536   4.009
  323   HD11  LEU  44          HD11      LEU  44  41.092   6.160   4.077
  324   HD12  LEU  44          HD12      LEU  44  40.124   7.074   2.918
  325   HD13  LEU  44          HD13      LEU  44  39.813   7.232   4.647
  326   HD21  LEU  44          HD21      LEU  44  40.451   9.425   5.356
  327   HD22  LEU  44          HD22      LEU  44  42.181   9.769   5.342
  328   HD23  LEU  44          HD23      LEU  44  41.579   8.301   6.112
  329    H    ASP  45           H        ASP  45  45.418   5.760   2.528
  330    HA   ASP  45           HA       ASP  45  47.366   7.840   2.238
  331    HB2  ASP  45           HB2      ASP  45  47.590   5.567   3.467
  332    HB3  ASP  45           HB3      ASP  45  47.931   4.906   1.871
  333    H    THR  46           H        THR  46  46.197   5.206   0.190
  334    HA   THR  46           HA       THR  46  47.734   6.215  -2.068
  335    HB   THR  46           HB       THR  46  47.242   4.144  -3.157
  336    HG1  THR  46           HG1      THR  46  45.338   3.358  -2.809
  337   HG21  THR  46          HG21      THR  46  48.167   4.069  -0.379
  338   HG22  THR  46          HG22      THR  46  48.894   3.406  -1.844
  339   HG23  THR  46          HG23      THR  46  47.602   2.527  -1.023
  340    H    ILE  47           H        ILE  47  44.492   6.524  -0.942
  341    HA   ILE  47           HA       ILE  47  43.310   6.686  -3.555
  342    HB   ILE  47           HB       ILE  47  41.816   8.106  -1.501
  343   HG12  ILE  47          HG12      ILE  47  42.783   5.310  -0.972
  344   HG13  ILE  47          HG13      ILE  47  42.702   6.679   0.126
  345   HG21  ILE  47          HG21      ILE  47  40.174   7.386  -2.799
  346   HG22  ILE  47          HG22      ILE  47  40.600   5.703  -2.486
  347   HG23  ILE  47          HG23      ILE  47  41.371   6.577  -3.809
  348   HD11  ILE  47          HD11      ILE  47  40.243   6.526   0.082
  349   HD12  ILE  47          HD12      ILE  47  41.024   5.081   0.723
  350   HD13  ILE  47          HD13      ILE  47  40.383   5.082  -0.921
  351    H    GLN  48           H        GLN  48  44.186   9.142  -1.110
  352    HA   GLN  48           HA       GLN  48  45.011  11.027  -3.012
  353    HB2  GLN  48           HB2      GLN  48  42.125  10.976  -2.432
  354    HB3  GLN  48           HB3      GLN  48  42.871  12.564  -2.325
  355    HG2  GLN  48           HG2      GLN  48  43.019  12.749  -4.532
  356    HG3  GLN  48           HG3      GLN  48  43.703  11.132  -4.702
  357   HE21  GLN  48          HE21      GLN  48  41.597   9.649  -3.616
  358   HE22  GLN  48          HE22      GLN  48  40.240   9.753  -4.689
  359    H    TYR  49           H        TYR  49  45.708  10.025  -0.385
  360    HA   TYR  49           HA       TYR  49  46.378  12.526   0.836
  361    HD1  TYR  49           HD2      TYR  49  45.194  14.328   1.700
  362    HD2  TYR  49           HD1      TYR  49  42.238  11.268   1.722
  363    HE1  TYR  49           HE2      TYR  49  43.478  15.990   1.109
  364    HE2  TYR  49           HE1      TYR  49  40.515  12.918   1.129
  365    HH   TYR  49           HH       TYR  49  40.913  16.179   1.406
  366    HB2  TYR  49           HB2      TYR  49  44.409  10.701   2.223
  367    HB3  TYR  49           HB3      TYR  49  45.332  11.951   3.060
  368    H    SER  50           H        SER  50  48.445  11.603   0.378
  369    HA   SER  50           HA       SER  50  49.224   9.415   2.183
  370    HG   SER  50           HG       SER  50  51.882   8.516   0.087
  371    HB2  SER  50           HB2      SER  50  49.531   9.156  -0.350
  372    HB3  SER  50           HB3      SER  50  50.808  10.361  -0.205
  373    H    LYS  51           H        LYS  51  49.099  11.516   3.649
  374    HA   LYS  51           HA       LYS  51  51.810  12.158   4.295
  375    HB2  LYS  51           HB2      LYS  51  50.772  13.821   2.413
  376    HB3  LYS  51           HB3      LYS  51  50.309  14.662   3.885
  377    HG2  LYS  51           HG2      LYS  51  52.407  15.524   3.153
  378    HG3  LYS  51           HG3      LYS  51  52.682  14.572   4.614
  379    HD2  LYS  51           HD2      LYS  51  53.986  13.103   3.540
  380    HD3  LYS  51           HD3      LYS  51  52.885  13.005   2.163
  381    HE2  LYS  51           HE2      LYS  51  53.833  15.398   1.644
  382    HE3  LYS  51           HE3      LYS  51  55.182  14.846   2.638
  383    HZ1  LYS  51           HZ1      LYS  51  55.933  13.984   0.736
  384    HZ2  LYS  51           HZ2      LYS  51  54.428  14.069  -0.032
  385    HZ3  LYS  51           HZ3      LYS  51  54.789  12.760   0.977
  386    H    HIS  52           H        HIS  52  50.537  10.914   6.031
  387    HA   HIS  52           HA       HIS  52  49.178  10.875   7.926
  388    HD1  HIS  52           HD1      HIS  52  50.332  10.151  10.745
  389    HD2  HIS  52           HD2      HIS  52  49.877  14.276  10.529
  390    HE1  HIS  52           HE1      HIS  52  49.479  10.892  13.008
  391    HB2  HIS  52           HB2      HIS  52  51.468  11.278   8.669
  392    HB3  HIS  52           HB3      HIS  52  51.243  13.014   8.484
  Start of MODEL   18
    1    H1   GLY   1           1H       GLY   1  29.711 -17.248   5.614
    2    H2   GLY   1           2H       GLY   1  28.239 -17.720   6.301
    3    H3   GLY   1           3H       GLY   1  28.647 -16.081   6.223
    4    HA2  GLY   1           HA2      GLY   1  28.565 -17.550   3.703
    5    HA3  GLY   1           HA3      GLY   1  27.027 -17.215   4.483
    6    H    SER   2           H        SER   2  30.064 -15.396   4.055
    7    HA   SER   2           HA       SER   2  28.494 -13.027   3.389
    8    HG   SER   2           HG       SER   2  30.112 -13.802   5.656
    9    HB2  SER   2           HB2      SER   2  31.483 -13.261   3.790
   10    HB3  SER   2           HB3      SER   2  30.537 -11.774   3.724
   11    HA   PRO   3           HA       PRO   3  29.605 -13.881  -0.883
   12    HB2  PRO   3           HB2      PRO   3  27.438 -12.790  -1.987
   13    HB3  PRO   3           HB3      PRO   3  27.338 -14.323  -1.112
   14    HG2  PRO   3           HG2      PRO   3  26.471 -11.608  -0.277
   15    HG3  PRO   3           HG3      PRO   3  25.782 -13.186   0.135
   16    HD2  PRO   3           HD2      PRO   3  27.549 -11.625   1.713
   17    HD3  PRO   3           HD3      PRO   3  27.023 -13.290   2.028
   18    HA   PRO   4           HA       PRO   4  31.449 -10.059  -2.127
   19    HB2  PRO   4           HB2      PRO   4  31.275 -10.266  -4.843
   20    HB3  PRO   4           HB3      PRO   4  32.444 -11.168  -3.872
   21    HG2  PRO   4           HG2      PRO   4  29.811 -12.065  -4.982
   22    HG3  PRO   4           HG3      PRO   4  31.360 -12.929  -4.937
   23    HD2  PRO   4           HD2      PRO   4  29.388 -13.440  -3.174
   24    HD3  PRO   4           HD3      PRO   4  31.102 -13.533  -2.720
   25    H    GLU   5           H        GLU   5  29.152  -9.303  -1.181
   26    HA   GLU   5           HA       GLU   5  28.175  -7.380  -3.117
   27    HB2  GLU   5           HB2      GLU   5  25.827  -7.951  -2.827
   28    HB3  GLU   5           HB3      GLU   5  26.712  -9.322  -3.483
   29    HG2  GLU   5           HG2      GLU   5  25.992 -10.597  -1.833
   30    HG3  GLU   5           HG3      GLU   5  26.744  -9.524  -0.653
   31    H    ALA   6           H        ALA   6  29.712  -6.910  -0.895
   32    HA   ALA   6           HA       ALA   6  29.614  -5.063   0.555
   33    HB1  ALA   6           HB1      ALA   6  27.163  -4.754  -0.102
   34    HB2  ALA   6           HB2      ALA   6  27.649  -4.238   1.513
   35    HB3  ALA   6           HB3      ALA   6  26.793  -5.765   1.295
   36    H    ASP   7           H        ASP   7  31.103  -6.604   1.434
   37    HA   ASP   7           HA       ASP   7  30.077  -8.082   3.758
   38    HB2  ASP   7           HB2      ASP   7  32.810  -8.366   2.495
   39    HB3  ASP   7           HB3      ASP   7  32.034  -9.456   3.641
   40    HA   PRO   8           HA       PRO   8  31.721  -5.513   6.934
   41    HB2  PRO   8           HB2      PRO   8  33.836  -7.629   7.191
   42    HB3  PRO   8           HB3      PRO   8  32.941  -6.785   8.461
   43    HG2  PRO   8           HG2      PRO   8  32.283  -9.278   7.614
   44    HG3  PRO   8           HG3      PRO   8  31.093  -8.126   8.238
   45    HD2  PRO   8           HD2      PRO   8  31.419  -9.136   5.523
   46    HD3  PRO   8           HD3      PRO   8  30.087  -8.182   6.203
   47    H    ARG   9           H        ARG   9  34.302  -7.195   5.149
   48    HA   ARG   9           HA       ARG   9  36.263  -5.265   5.269
   49    HE   ARG   9           HE       ARG   9  37.377 -10.370   4.789
   50    HB2  ARG   9           HB2      ARG   9  35.652  -7.176   3.005
   51    HB3  ARG   9           HB3      ARG   9  37.183  -6.328   3.237
   52    HG2  ARG   9           HG2      ARG   9  37.725  -8.309   4.196
   53    HG3  ARG   9           HG3      ARG   9  37.045  -7.503   5.610
   54    HD2  ARG   9           HD2      ARG   9  35.187  -8.809   5.632
   55    HD3  ARG   9           HD3      ARG   9  35.158  -8.982   3.877
   56   HH11  ARG   9          HH11      ARG   9  33.915 -10.515   5.142
   57   HH12  ARG   9          HH12      ARG   9  33.882 -12.231   5.376
   58   HH21  ARG   9          HH21      ARG   9  37.344 -12.627   5.094
   59   HH22  ARG   9          HH22      ARG   9  35.831 -13.432   5.348
   60    H    LEU  10           H        LEU  10  34.079  -5.793   2.507
   61    HA   LEU  10           HA       LEU  10  34.867  -3.361   1.279
   62    HG   LEU  10           HG       LEU  10  34.050  -6.328  -0.896
   63    HB2  LEU  10           HB2      LEU  10  32.677  -5.316   0.614
   64    HB3  LEU  10           HB3      LEU  10  33.060  -3.916  -0.369
   65   HD11  LEU  10          HD11      LEU  10  35.089  -5.195  -2.495
   66   HD12  LEU  10          HD12      LEU  10  36.169  -4.419  -1.334
   67   HD13  LEU  10          HD13      LEU  10  34.587  -3.717  -1.677
   68   HD21  LEU  10          HD21      LEU  10  36.354  -6.514  -0.072
   69   HD22  LEU  10          HD22      LEU  10  35.182  -6.601   1.242
   70   HD23  LEU  10          HD23      LEU  10  36.091  -5.114   0.970
   71    H    ILE  11           H        ILE  11  32.460  -4.198   3.549
   72    HA   ILE  11           HA       ILE  11  30.863  -1.823   2.995
   73    HB   ILE  11           HB       ILE  11  29.975  -4.126   3.895
   74   HG12  ILE  11          HG12      ILE  11  28.761  -1.956   5.479
   75   HG13  ILE  11          HG13      ILE  11  28.948  -1.605   3.763
   76   HG21  ILE  11          HG21      ILE  11  30.290  -4.677   6.037
   77   HG22  ILE  11          HG22      ILE  11  30.059  -3.020   6.594
   78   HG23  ILE  11          HG23      ILE  11  31.633  -3.534   5.987
   79   HD11  ILE  11          HD11      ILE  11  27.076  -2.721   3.398
   80   HD12  ILE  11          HD12      ILE  11  27.004  -3.236   5.083
   81   HD13  ILE  11          HD13      ILE  11  27.900  -4.196   3.905
   82    H    GLU  12           H        GLU  12  33.501  -2.845   4.770
   83    HA   GLU  12           HA       GLU  12  33.436  -0.584   6.642
   84    HB2  GLU  12           HB2      GLU  12  33.970  -2.829   7.555
   85    HB3  GLU  12           HB3      GLU  12  35.388  -2.891   6.517
   86    HG2  GLU  12           HG2      GLU  12  36.524  -1.990   8.189
   87    HG3  GLU  12           HG3      GLU  12  35.646  -0.493   7.878
   88    H    SER  13           H        SER  13  35.747  -2.169   4.454
   89    HA   SER  13           HA       SER  13  37.327   0.251   4.297
   90    HG   SER  13           HG       SER  13  38.595  -3.387   4.280
   91    HB2  SER  13           HB2      SER  13  38.269  -1.859   2.586
   92    HB3  SER  13           HB3      SER  13  39.028  -1.157   4.013
   93    H    LEU  14           H        LEU  14  35.334  -1.704   2.009
   94    HA   LEU  14           HA       LEU  14  36.198  -0.122  -0.217
   95    HG   LEU  14           HG       LEU  14  35.586  -2.093  -2.355
   96    HB2  LEU  14           HB2      LEU  14  35.041  -2.487  -0.209
   97    HB3  LEU  14           HB3      LEU  14  33.573  -1.538  -0.298
   98   HD11  LEU  14          HD11      LEU  14  33.058  -0.994  -3.208
   99   HD12  LEU  14          HD12      LEU  14  32.837  -2.291  -2.035
  100   HD13  LEU  14          HD13      LEU  14  33.758  -2.584  -3.511
  101   HD21  LEU  14          HD21      LEU  14  34.526   0.693  -1.954
  102   HD22  LEU  14          HD22      LEU  14  35.084   0.094  -3.515
  103   HD23  LEU  14          HD23      LEU  14  36.201   0.181  -2.154
  104    H    SER  15           H        SER  15  32.957  -0.301   1.356
  105    HA   SER  15           HA       SER  15  31.737   1.822   0.251
  106    HG   SER  15           HG       SER  15  29.559   1.852   1.523
  107    HB2  SER  15           HB2      SER  15  31.670   0.590   2.907
  108    HB3  SER  15           HB3      SER  15  31.196   2.289   2.930
  109    H    GLN  16           H        GLN  16  33.595   2.259   3.256
  110    HA   GLN  16           HA       GLN  16  33.786   4.976   3.294
  111    HB2  GLN  16           HB2      GLN  16  34.769   4.170   5.170
  112    HB3  GLN  16           HB3      GLN  16  35.424   2.764   4.348
  113    HG2  GLN  16           HG2      GLN  16  37.143   4.278   5.282
  114    HG3  GLN  16           HG3      GLN  16  37.293   4.017   3.545
  115   HE21  GLN  16          HE21      GLN  16  38.085   5.813   2.717
  116   HE22  GLN  16          HE22      GLN  16  37.496   7.411   3.007
  117    H    MET  17           H        MET  17  35.537   2.761   1.218
  118    HA   MET  17           HA       MET  17  37.405   4.721   0.276
  119    HB2  MET  17           HB2      MET  17  38.168   2.515   0.037
  120    HB3  MET  17           HB3      MET  17  36.648   1.954  -0.627
  121    HG2  MET  17           HG2      MET  17  37.836   1.980  -2.535
  122    HG3  MET  17           HG3      MET  17  37.319   3.662  -2.558
  123    HE1  MET  17           HE1      MET  17  41.344   2.072  -1.137
  124    HE2  MET  17           HE2      MET  17  39.737   1.432  -0.790
  125    HE3  MET  17           HE3      MET  17  40.359   2.801   0.131
  126    H    LEU  18           H        LEU  18  34.196   3.663  -0.617
  127    HA   LEU  18           HA       LEU  18  34.261   5.291  -3.053
  128    HG   LEU  18           HG       LEU  18  30.860   4.943  -2.860
  129    HB2  LEU  18           HB2      LEU  18  33.258   3.204  -3.444
  130    HB3  LEU  18           HB3      LEU  18  32.344   3.263  -1.950
  131   HD11  LEU  18          HD11      LEU  18  31.669   6.348  -4.382
  132   HD12  LEU  18          HD12      LEU  18  31.430   5.066  -5.570
  133   HD13  LEU  18          HD13      LEU  18  32.997   5.258  -4.784
  134   HD21  LEU  18          HD21      LEU  18  31.059   2.303  -3.748
  135   HD22  LEU  18          HD22      LEU  18  30.725   3.260  -5.191
  136   HD23  LEU  18          HD23      LEU  18  29.638   3.346  -3.805
  137    H    SER  19           H        SER  19  31.840   4.821  -0.483
  138    HA   SER  19           HA       SER  19  30.539   7.250  -0.874
  139    HG   SER  19           HG       SER  19  28.404   6.475   1.765
  140    HB2  SER  19           HB2      SER  19  29.533   5.291   0.229
  141    HB3  SER  19           HB3      SER  19  30.570   5.562   1.629
  142    H    MET  20           H        MET  20  33.604   7.256   0.036
  143    HA   MET  20           HA       MET  20  33.259   9.335   2.082
  144    HB2  MET  20           HB2      MET  20  34.787   7.477   2.695
  145    HB3  MET  20           HB3      MET  20  35.792   7.870   1.306
  146    HG2  MET  20           HG2      MET  20  35.204   9.995   3.304
  147    HG3  MET  20           HG3      MET  20  36.380   8.745   3.703
  148    HE1  MET  20           HE1      MET  20  37.539  12.504   2.011
  149    HE2  MET  20           HE2      MET  20  37.420  11.820   3.633
  150    HE3  MET  20           HE3      MET  20  35.962  12.083   2.677
  151    H    GLY  21           H        GLY  21  34.095   8.680  -1.158
  152    HA2  GLY  21           HA2      GLY  21  33.973  10.570  -2.690
  153    HA3  GLY  21           HA3      GLY  21  34.879  11.501  -1.505
  154    H    PHE  22           H        PHE  22  36.047   8.270  -1.845
  155    HA   PHE  22           HA       PHE  22  38.136   9.250  -3.668
  156    HD1  PHE  22           HD2      PHE  22  38.480  10.750  -2.398
  157    HD2  PHE  22           HD1      PHE  22  39.877   7.956   0.490
  158    HE1  PHE  22           HE2      PHE  22  39.035  12.604  -0.878
  159    HE2  PHE  22           HE1      PHE  22  40.435   9.804   2.015
  160    HZ   PHE  22           HZ       PHE  22  40.014  12.131   1.332
  161    HB2  PHE  22           HB2      PHE  22  38.428   7.278  -1.384
  162    HB3  PHE  22           HB3      PHE  22  39.713   7.787  -2.478
  163    H    SER  23           H        SER  23  39.413   6.958  -4.264
  164    HA   SER  23           HA       SER  23  37.581   4.841  -4.778
  165    HG   SER  23           HG       SER  23  35.924   6.273  -6.270
  166    HB2  SER  23           HB2      SER  23  38.594   6.348  -7.201
  167    HB3  SER  23           HB3      SER  23  37.481   4.980  -7.185
  168    H    ASP  24           H        ASP  24  39.290   4.271  -7.327
  169    HA   ASP  24           HA       ASP  24  41.725   3.433  -5.895
  170    HB2  ASP  24           HB2      ASP  24  41.757   1.461  -7.467
  171    HB3  ASP  24           HB3      ASP  24  40.434   1.455  -6.299
  172    H    GLU  25           H        GLU  25  43.453   4.490  -6.647
  173    HA   GLU  25           HA       GLU  25  43.585   6.183  -8.759
  174    HB2  GLU  25           HB2      GLU  25  45.385   6.021  -7.137
  175    HB3  GLU  25           HB3      GLU  25  45.821   4.432  -7.753
  176    HG2  GLU  25           HG2      GLU  25  47.032   5.285  -9.410
  177    HG3  GLU  25           HG3      GLU  25  45.796   6.471  -9.821
  178    H    GLY  26           H        GLY  26  45.284   3.135  -9.023
  179    HA2  GLY  26           HA2      GLY  26  44.374   2.971 -11.825
  180    HA3  GLY  26           HA3      GLY  26  45.977   2.493 -11.283
  181    H    GLY  27           H        GLY  27  43.080   1.771  -9.458
  182    HA2  GLY  27           HA2      GLY  27  41.910  -0.228  -9.224
  183    HA3  GLY  27           HA3      GLY  27  42.878  -0.916 -10.521
  184    H    TRP  28           H        TRP  28  43.979   0.612  -7.548
  185    HA   TRP  28           HA       TRP  28  45.507  -1.794  -6.945
  186    HD1  TRP  28           HD1      TRP  28  46.326   2.699  -7.249
  187    HE1  TRP  28           HE1      TRP  28  45.167   4.552  -5.892
  188    HE3  TRP  28           HE3      TRP  28  44.484  -0.108  -3.415
  189    HZ2  TRP  28           HZ2      TRP  28  43.679   4.791  -3.520
  190    HZ3  TRP  28           HZ3      TRP  28  43.209   1.000  -1.636
  191    HH2  TRP  28           HH2      TRP  28  42.804   3.402  -1.691
  192    HB2  TRP  28           HB2      TRP  28  46.653  -0.357  -5.254
  193    HB3  TRP  28           HB3      TRP  28  46.813   0.220  -6.912
  194    H    LEU  29           H        LEU  29  42.855   0.131  -5.709
  195    HA   LEU  29           HA       LEU  29  42.663  -0.546  -3.098
  196    HG   LEU  29           HG       LEU  29  39.931  -2.046  -3.352
  197    HB2  LEU  29           HB2      LEU  29  40.856   0.680  -3.673
  198    HB3  LEU  29           HB3      LEU  29  40.683  -0.093  -5.236
  199   HD11  LEU  29          HD11      LEU  29  39.201   0.699  -2.505
  200   HD12  LEU  29          HD12      LEU  29  39.525  -0.739  -1.537
  201   HD13  LEU  29          HD13      LEU  29  37.980  -0.567  -2.370
  202   HD21  LEU  29          HD21      LEU  29  38.453  -0.258  -5.252
  203   HD22  LEU  29          HD22      LEU  29  37.625  -1.478  -4.285
  204   HD23  LEU  29          HD23      LEU  29  38.871  -1.961  -5.437
  205    H    THR  30           H        THR  30  41.167  -2.582  -5.608
  206    HA   THR  30           HA       THR  30  40.546  -4.777  -4.144
  207    HB   THR  30           HB       THR  30  41.670  -4.563  -6.925
  208    HG1  THR  30           HG1      THR  30  39.182  -4.718  -5.732
  209   HG21  THR  30          HG21      THR  30  41.594  -6.969  -5.390
  210   HG22  THR  30          HG22      THR  30  42.092  -6.725  -7.064
  211   HG23  THR  30          HG23      THR  30  40.399  -7.050  -6.685
  212    H    ARG  31           H        ARG  31  43.750  -3.713  -5.086
  213    HA   ARG  31           HA       ARG  31  45.017  -6.100  -4.026
  214    HE   ARG  31           HE       ARG  31  49.559  -2.790  -4.225
  215    HB2  ARG  31           HB2      ARG  31  46.706  -5.560  -5.405
  216    HB3  ARG  31           HB3      ARG  31  45.628  -4.353  -6.072
  217    HG2  ARG  31           HG2      ARG  31  46.601  -2.632  -4.769
  218    HG3  ARG  31           HG3      ARG  31  47.493  -3.792  -3.781
  219    HD2  ARG  31           HD2      ARG  31  48.627  -4.497  -5.959
  220    HD3  ARG  31           HD3      ARG  31  47.947  -3.024  -6.648
  221   HH11  ARG  31          HH11      ARG  31  49.294  -2.351  -7.681
  222   HH12  ARG  31          HH12      ARG  31  50.640  -1.267  -7.767
  223   HH21  ARG  31          HH21      ARG  31  51.329  -1.371  -4.344
  224   HH22  ARG  31          HH22      ARG  31  51.796  -0.711  -5.877
  225    H    LEU  32           H        LEU  32  45.309  -2.581  -3.465
  226    HA   LEU  32           HA       LEU  32  46.908  -2.542  -1.255
  227    HG   LEU  32           HG       LEU  32  45.954   1.013  -0.805
  228    HB2  LEU  32           HB2      LEU  32  45.952  -0.597  -2.507
  229    HB3  LEU  32           HB3      LEU  32  44.451  -0.824  -1.626
  230   HD11  LEU  32          HD11      LEU  32  45.623   0.485   1.565
  231   HD12  LEU  32          HD12      LEU  32  45.235  -1.177   1.128
  232   HD13  LEU  32          HD13      LEU  32  44.195   0.142   0.589
  233   HD21  LEU  32          HD21      LEU  32  47.664  -1.336  -0.042
  234   HD22  LEU  32          HD22      LEU  32  47.824   0.266   0.678
  235   HD23  LEU  32          HD23      LEU  32  48.097   0.044  -1.051
  236    H    LEU  33           H        LEU  33  43.359  -2.277  -0.940
  237    HA   LEU  33           HA       LEU  33  43.076  -2.765   1.715
  238    HG   LEU  33           HG       LEU  33  40.762  -2.028   1.979
  239    HB2  LEU  33           HB2      LEU  33  41.418  -3.333  -0.667
  240    HB3  LEU  33           HB3      LEU  33  40.967  -4.182   0.804
  241   HD11  LEU  33          HD11      LEU  33  40.620  -0.040   0.227
  242   HD12  LEU  33          HD12      LEU  33  41.832  -1.021  -0.596
  243   HD13  LEU  33          HD13      LEU  33  42.121  -0.461   1.052
  244   HD21  LEU  33          HD21      LEU  33  39.188  -2.307  -0.573
  245   HD22  LEU  33          HD22      LEU  33  38.772  -1.203   0.738
  246   HD23  LEU  33          HD23      LEU  33  38.774  -2.945   1.018
  247    H    GLN  34           H        GLN  34  42.644  -5.377  -0.641
  248    HA   GLN  34           HA       GLN  34  42.761  -7.557   0.991
  249    HB2  GLN  34           HB2      GLN  34  43.545  -7.024  -1.808
  250    HB3  GLN  34           HB3      GLN  34  44.128  -8.532  -1.115
  251    HG2  GLN  34           HG2      GLN  34  42.145  -9.193  -2.055
  252    HG3  GLN  34           HG3      GLN  34  41.644  -8.838  -0.403
  253   HE21  GLN  34          HE21      GLN  34  40.862  -6.570  -0.054
  254   HE22  GLN  34          HE22      GLN  34  39.867  -5.882  -1.288
  255    H    THR  35           H        THR  35  45.557  -5.997  -0.556
  256    HA   THR  35           HA       THR  35  47.503  -7.545   0.852
  257    HB   THR  35           HB       THR  35  47.876  -4.934  -0.628
  258    HG1  THR  35           HG1      THR  35  46.949  -6.980  -1.705
  259   HG21  THR  35          HG21      THR  35  49.728  -6.722   0.685
  260   HG22  THR  35          HG22      THR  35  49.987  -5.112   0.015
  261   HG23  THR  35          HG23      THR  35  50.089  -6.529  -1.029
  262    H    LYS  36           H        LYS  36  45.462  -5.346   1.988
  263    HA   LYS  36           HA       LYS  36  47.304  -4.463   4.091
  264    HB2  LYS  36           HB2      LYS  36  45.229  -2.778   2.688
  265    HB3  LYS  36           HB3      LYS  36  45.971  -2.321   4.215
  266    HG2  LYS  36           HG2      LYS  36  48.001  -3.015   2.316
  267    HG3  LYS  36           HG3      LYS  36  46.912  -1.809   1.630
  268    HD2  LYS  36           HD2      LYS  36  48.110  -0.296   2.753
  269    HD3  LYS  36           HD3      LYS  36  47.319  -0.911   4.206
  270    HE2  LYS  36           HE2      LYS  36  49.840  -2.122   3.107
  271    HE3  LYS  36           HE3      LYS  36  49.861  -0.773   4.242
  272    HZ1  LYS  36           HZ1      LYS  36  49.783  -2.318   5.820
  273    HZ2  LYS  36           HZ2      LYS  36  49.391  -3.551   4.731
  274    HZ3  LYS  36           HZ3      LYS  36  48.169  -2.582   5.383
  275    H    ASN  37           H        ASN  37  45.283  -6.650   3.780
  276    HA   ASN  37           HA       ASN  37  43.741  -7.709   5.077
  277    HB2  ASN  37           HB2      ASN  37  45.135  -7.318   6.965
  278    HB3  ASN  37           HB3      ASN  37  44.715  -5.605   7.016
  279   HD21  ASN  37          HD21      ASN  37  42.951  -4.960   8.117
  280   HD22  ASN  37          HD22      ASN  37  41.922  -6.018   9.015
  281    H    TYR  38           H        TYR  38  42.936  -5.631   3.237
  282    HA   TYR  38           HA       TYR  38  41.105  -4.441   2.625
  283    HD1  TYR  38           HD2      TYR  38  41.222  -8.019   3.988
  284    HD2  TYR  38           HD1      TYR  38  38.421  -5.969   1.529
  285    HE1  TYR  38           HE2      TYR  38  41.190  -9.931   2.441
  286    HE2  TYR  38           HE1      TYR  38  38.378  -7.875  -0.023
  287    HH   TYR  38           HH       TYR  38  38.875 -10.459   0.221
  288    HB2  TYR  38           HB2      TYR  38  39.836  -6.078   4.827
  289    HB3  TYR  38           HB3      TYR  38  38.942  -5.113   3.659
  290    H    ASP  39           H        ASP  39  42.692  -2.857   3.925
  291    HA   ASP  39           HA       ASP  39  40.969  -1.474   5.877
  292    HB2  ASP  39           HB2      ASP  39  42.838  -0.797   7.151
  293    HB3  ASP  39           HB3      ASP  39  43.055  -2.519   6.844
  294    H    ILE  40           H        ILE  40  40.733   0.684   5.790
  295    HA   ILE  40           HA       ILE  40  41.481   1.934   3.270
  296    HB   ILE  40           HB       ILE  40  40.002   3.804   4.095
  297   HG12  ILE  40          HG12      ILE  40  40.284   2.842   6.542
  298   HG13  ILE  40          HG13      ILE  40  38.803   3.663   6.060
  299   HG21  ILE  40          HG21      ILE  40  39.214   1.099   3.309
  300   HG22  ILE  40          HG22      ILE  40  38.753   2.660   2.629
  301   HG23  ILE  40          HG23      ILE  40  37.924   2.041   4.057
  302   HD11  ILE  40          HD11      ILE  40  39.004   1.165   7.207
  303   HD12  ILE  40          HD12      ILE  40  38.702   0.823   5.503
  304   HD13  ILE  40          HD13      ILE  40  37.584   1.842   6.410
  305    H    GLY  41           H        GLY  41  42.227   1.932   6.627
  306    HA2  GLY  41           HA2      GLY  41  43.216   4.371   7.191
  307    HA3  GLY  41           HA3      GLY  41  44.000   2.905   7.739
  308    H    ALA  42           H        ALA  42  44.868   1.901   5.358
  309    HA   ALA  42           HA       ALA  42  47.013   3.775   4.725
  310    HB1  ALA  42           HB1      ALA  42  46.881   0.945   5.033
  311    HB2  ALA  42           HB2      ALA  42  48.299   1.956   4.760
  312    HB3  ALA  42           HB3      ALA  42  47.402   1.306   3.387
  313    H    ALA  43           H        ALA  43  44.145   2.458   3.425
  314    HA   ALA  43           HA       ALA  43  44.581   2.553   0.691
  315    HB1  ALA  43           HB1      ALA  43  42.169   3.135   0.497
  316    HB2  ALA  43           HB2      ALA  43  42.125   3.377   2.243
  317    HB3  ALA  43           HB3      ALA  43  42.473   1.780   1.583
  318    H    LEU  44           H        LEU  44  43.235   5.174   2.692
  319    HA   LEU  44           HA       LEU  44  43.178   7.275   1.022
  320    HG   LEU  44           HG       LEU  44  42.072   8.832   2.178
  321    HB2  LEU  44           HB2      LEU  44  43.683   6.955   3.874
  322    HB3  LEU  44           HB3      LEU  44  44.432   8.405   3.220
  323   HD11  LEU  44          HD11      LEU  44  41.448   6.453   3.182
  324   HD12  LEU  44          HD12      LEU  44  40.269   7.757   3.040
  325   HD13  LEU  44          HD13      LEU  44  41.054   7.443   4.587
  326   HD21  LEU  44          HD21      LEU  44  42.639   9.165   5.121
  327   HD22  LEU  44          HD22      LEU  44  41.415  10.046   4.207
  328   HD23  LEU  44          HD23      LEU  44  43.125  10.265   3.833
  329    H    ASP  45           H        ASP  45  46.075   6.570   2.946
  330    HA   ASP  45           HA       ASP  45  47.903   8.256   1.994
  331    HB2  ASP  45           HB2      ASP  45  48.323   6.371   3.592
  332    HB3  ASP  45           HB3      ASP  45  48.498   5.301   2.203
  333    H    THR  46           H        THR  46  46.818   5.404   0.201
  334    HA   THR  46           HA       THR  46  48.545   6.137  -2.028
  335    HB   THR  46           HB       THR  46  48.202   3.966  -2.887
  336    HG1  THR  46           HG1      THR  46  46.026   3.679  -2.725
  337   HG21  THR  46          HG21      THR  46  49.654   3.599  -1.145
  338   HG22  THR  46          HG22      THR  46  48.349   2.473  -0.773
  339   HG23  THR  46          HG23      THR  46  48.456   4.012   0.081
  340    H    ILE  47           H        ILE  47  45.374   6.822  -1.171
  341    HA   ILE  47           HA       ILE  47  44.396   6.715  -3.928
  342    HB   ILE  47           HB       ILE  47  42.535   7.898  -2.037
  343   HG12  ILE  47          HG12      ILE  47  43.495   5.083  -1.515
  344   HG13  ILE  47          HG13      ILE  47  43.754   6.464  -0.468
  345   HG21  ILE  47          HG21      ILE  47  41.085   6.914  -3.410
  346   HG22  ILE  47          HG22      ILE  47  41.823   5.330  -3.160
  347   HG23  ILE  47          HG23      ILE  47  42.471   6.422  -4.385
  348   HD11  ILE  47          HD11      ILE  47  41.952   5.104   0.371
  349   HD12  ILE  47          HD12      ILE  47  41.105   5.251  -1.166
  350   HD13  ILE  47          HD13      ILE  47  41.336   6.672  -0.151
  351    H    GLN  48           H        GLN  48  45.155   9.124  -1.466
  352    HA   GLN  48           HA       GLN  48  45.500  11.134  -3.455
  353    HB2  GLN  48           HB2      GLN  48  42.942  11.073  -1.922
  354    HB3  GLN  48           HB3      GLN  48  43.649  12.626  -2.344
  355    HG2  GLN  48           HG2      GLN  48  42.567  12.447  -4.268
  356    HG3  GLN  48           HG3      GLN  48  43.750  11.218  -4.709
  357   HE21  GLN  48          HE21      GLN  48  41.097  11.354  -5.667
  358   HE22  GLN  48          HE22      GLN  48  40.260   9.939  -5.116
  359    H    TYR  49           H        TYR  49  45.852  10.096  -0.218
  360    HA   TYR  49           HA       TYR  49  47.246  12.602   0.372
  361    HD1  TYR  49           HD1      TYR  49  43.731  11.180   0.482
  362    HD2  TYR  49           HD2      TYR  49  45.318  14.642   2.379
  363    HE1  TYR  49           HE1      TYR  49  41.755  12.462  -0.223
  364    HE2  TYR  49           HE2      TYR  49  43.346  15.934   1.680
  365    HH   TYR  49           HH       TYR  49  41.137  14.816  -0.630
  366    HB2  TYR  49           HB2      TYR  49  45.527  11.104   2.359
  367    HB3  TYR  49           HB3      TYR  49  46.408  12.602   2.653
  368    H    SER  50           H        SER  50  48.180  12.025   2.830
  369    HA   SER  50           HA       SER  50  49.317   9.445   3.134
  370    HG   SER  50           HG       SER  50  51.696  12.245   1.661
  371    HB2  SER  50           HB2      SER  50  51.755  10.463   2.749
  372    HB3  SER  50           HB3      SER  50  50.847   9.708   1.439
  373    H    LYS  51           H        LYS  51  48.017  11.438   4.727
  374    HA   LYS  51           HA       LYS  51  49.834  11.479   6.957
  375    HB2  LYS  51           HB2      LYS  51  49.585  13.798   5.301
  376    HB3  LYS  51           HB3      LYS  51  48.828  14.139   6.851
  377    HG2  LYS  51           HG2      LYS  51  51.091  13.029   7.728
  378    HG3  LYS  51           HG3      LYS  51  51.666  13.668   6.186
  379    HD2  LYS  51           HD2      LYS  51  51.738  15.728   7.022
  380    HD3  LYS  51           HD3      LYS  51  50.038  15.631   7.491
  381    HE2  LYS  51           HE2      LYS  51  50.831  15.816   9.582
  382    HE3  LYS  51           HE3      LYS  51  51.203  14.101   9.408
  383    HZ1  LYS  51           HZ1      LYS  51  52.977  16.277   9.743
  384    HZ2  LYS  51           HZ2      LYS  51  53.326  15.480   8.293
  385    HZ3  LYS  51           HZ3      LYS  51  53.315  14.618   9.749
  386    H    HIS  52           H        HIS  52  48.726  12.220   8.946
  387    HA   HIS  52           HA       HIS  52  45.804  12.091   8.694
  388    HD1  HIS  52           HD1      HIS  52  44.855   9.552   8.185
  389    HD2  HIS  52           HD2      HIS  52  44.636  10.265  12.272
  390    HE1  HIS  52           HE1      HIS  52  42.584   8.723   8.930
  391    HB2  HIS  52           HB2      HIS  52  47.230   9.969   9.580
  392    HB3  HIS  52           HB3      HIS  52  46.976  10.823  11.098
  Start of MODEL   19
    1    H1   GLY   1           1H       GLY   1  28.127 -18.433   1.706
    2    H2   GLY   1           2H       GLY   1  27.329 -16.946   1.578
    3    H3   GLY   1           3H       GLY   1  27.032 -17.954   2.904
    4    HA2  GLY   1           HA2      GLY   1  28.714 -17.117   4.049
    5    HA3  GLY   1           HA3      GLY   1  29.804 -17.419   2.705
    6    H    SER   2           H        SER   2  30.942 -15.525   2.793
    7    HA   SER   2           HA       SER   2  29.397 -13.056   2.350
    8    HG   SER   2           HG       SER   2  31.042 -12.807   5.518
    9    HB2  SER   2           HB2      SER   2  32.196 -13.144   3.468
   10    HB3  SER   2           HB3      SER   2  31.037 -11.816   3.525
   11    HA   PRO   3           HA       PRO   3  31.726 -13.293  -1.491
   12    HB2  PRO   3           HB2      PRO   3  29.848 -12.029  -2.992
   13    HB3  PRO   3           HB3      PRO   3  29.766 -13.743  -2.582
   14    HG2  PRO   3           HG2      PRO   3  28.141 -11.511  -1.597
   15    HG3  PRO   3           HG3      PRO   3  27.811 -13.247  -1.546
   16    HD2  PRO   3           HD2      PRO   3  28.790 -11.549   0.561
   17    HD3  PRO   3           HD3      PRO   3  28.405 -13.279   0.631
   18    HA   PRO   4           HA       PRO   4  33.433  -9.229  -1.716
   19    HB2  PRO   4           HB2      PRO   4  34.192  -9.055  -4.298
   20    HB3  PRO   4           HB3      PRO   4  34.978 -10.151  -3.156
   21    HG2  PRO   4           HG2      PRO   4  32.909 -10.742  -5.232
   22    HG3  PRO   4           HG3      PRO   4  34.351 -11.674  -4.788
   23    HD2  PRO   4           HD2      PRO   4  31.827 -12.280  -3.924
   24    HD3  PRO   4           HD3      PRO   4  33.301 -12.689  -3.025
   25    H    GLU   5           H        GLU   5  30.630  -9.091  -1.798
   26    HA   GLU   5           HA       GLU   5  30.299  -6.641  -3.312
   27    HB2  GLU   5           HB2      GLU   5  29.667  -8.486  -4.882
   28    HB3  GLU   5           HB3      GLU   5  28.375  -8.921  -3.771
   29    HG2  GLU   5           HG2      GLU   5  27.657  -6.444  -4.042
   30    HG3  GLU   5           HG3      GLU   5  28.650  -6.504  -5.498
   31    H    ALA   6           H        ALA   6  30.380  -6.290  -0.859
   32    HA   ALA   6           HA       ALA   6  28.988  -5.031   0.585
   33    HB1  ALA   6           HB1      ALA   6  26.986  -5.461  -0.827
   34    HB2  ALA   6           HB2      ALA   6  26.673  -5.497   0.908
   35    HB3  ALA   6           HB3      ALA   6  26.793  -7.006   0.002
   36    H    ASP   7           H        ASP   7  30.912  -6.812   1.160
   37    HA   ASP   7           HA       ASP   7  29.863  -8.566   3.256
   38    HB2  ASP   7           HB2      ASP   7  31.379  -9.850   2.074
   39    HB3  ASP   7           HB3      ASP   7  32.382  -8.467   1.649
   40    HA   PRO   8           HA       PRO   8  30.748  -6.163   6.826
   41    HB2  PRO   8           HB2      PRO   8  33.051  -8.051   7.192
   42    HB3  PRO   8           HB3      PRO   8  31.904  -7.443   8.391
   43    HG2  PRO   8           HG2      PRO   8  31.664  -9.888   7.234
   44    HG3  PRO   8           HG3      PRO   8  30.276  -8.941   7.792
   45    HD2  PRO   8           HD2      PRO   8  31.049  -9.621   5.070
   46    HD3  PRO   8           HD3      PRO   8  29.551  -8.872   5.646
   47    H    ARG   9           H        ARG   9  33.784  -7.311   5.332
   48    HA   ARG   9           HA       ARG   9  35.307  -5.043   5.975
   49    HE   ARG   9           HE       ARG   9  36.452 -10.342   3.944
   50    HB2  ARG   9           HB2      ARG   9  35.750  -6.913   3.649
   51    HB3  ARG   9           HB3      ARG   9  36.955  -5.919   4.461
   52    HG2  ARG   9           HG2      ARG   9  36.840  -7.239   6.434
   53    HG3  ARG   9           HG3      ARG   9  35.430  -8.116   5.833
   54    HD2  ARG   9           HD2      ARG   9  37.524  -8.340   3.917
   55    HD3  ARG   9           HD3      ARG   9  38.176  -8.744   5.503
   56   HH11  ARG   9          HH11      ARG   9  37.009  -9.371   7.244
   57   HH12  ARG   9          HH12      ARG   9  36.346 -10.822   7.917
   58   HH21  ARG   9          HH21      ARG   9  35.576 -12.249   4.818
   59   HH22  ARG   9          HH22      ARG   9  35.532 -12.463   6.536
   60    H    LEU  10           H        LEU  10  33.239  -5.708   3.255
   61    HA   LEU  10           HA       LEU  10  34.147  -3.378   1.802
   62    HG   LEU  10           HG       LEU  10  33.528  -6.482  -0.216
   63    HB2  LEU  10           HB2      LEU  10  32.066  -5.453   1.175
   64    HB3  LEU  10           HB3      LEU  10  32.392  -4.078   0.142
   65   HD11  LEU  10          HD11      LEU  10  34.710  -5.458  -1.840
   66   HD12  LEU  10          HD12      LEU  10  35.363  -4.236  -0.748
   67   HD13  LEU  10          HD13      LEU  10  33.723  -4.071  -1.378
   68   HD21  LEU  10          HD21      LEU  10  35.812  -6.475   0.613
   69   HD22  LEU  10          HD22      LEU  10  34.673  -6.430   1.958
   70   HD23  LEU  10          HD23      LEU  10  35.518  -4.961   1.468
   71    H    ILE  11           H        ILE  11  31.318  -4.474   3.580
   72    HA   ILE  11           HA       ILE  11  29.842  -2.062   3.069
   73    HB   ILE  11           HB       ILE  11  28.340  -2.824   4.901
   74   HG12  ILE  11          HG12      ILE  11  30.490  -4.896   5.193
   75   HG13  ILE  11          HG13      ILE  11  29.660  -3.971   6.440
   76   HG21  ILE  11          HG21      ILE  11  27.492  -4.813   3.745
   77   HG22  ILE  11          HG22      ILE  11  28.998  -4.918   2.832
   78   HG23  ILE  11          HG23      ILE  11  27.929  -3.532   2.614
   79   HD11  ILE  11          HD11      ILE  11  28.854  -6.465   5.067
   80   HD12  ILE  11          HD12      ILE  11  27.583  -5.342   5.548
   81   HD13  ILE  11          HD13      ILE  11  28.689  -5.994   6.758
   82    H    GLU  12           H        GLU  12  32.284  -3.136   5.148
   83    HA   GLU  12           HA       GLU  12  31.992  -0.856   6.972
   84    HB2  GLU  12           HB2      GLU  12  32.384  -3.100   7.954
   85    HB3  GLU  12           HB3      GLU  12  33.934  -3.166   7.125
   86    HG2  GLU  12           HG2      GLU  12  34.933  -1.812   8.606
   87    HG3  GLU  12           HG3      GLU  12  33.511  -0.786   8.791
   88    H    SER  13           H        SER  13  34.625  -2.451   5.163
   89    HA   SER  13           HA       SER  13  36.169   0.000   5.221
   90    HG   SER  13           HG       SER  13  37.127  -3.722   5.272
   91    HB2  SER  13           HB2      SER  13  37.283  -2.280   3.746
   92    HB3  SER  13           HB3      SER  13  37.990  -1.308   5.036
   93    H    LEU  14           H        LEU  14  34.430  -1.875   2.738
   94    HA   LEU  14           HA       LEU  14  35.744  -0.514   0.589
   95    HG   LEU  14           HG       LEU  14  33.663  -0.214  -1.287
   96    HB2  LEU  14           HB2      LEU  14  34.784  -2.575  -0.034
   97    HB3  LEU  14           HB3      LEU  14  33.237  -2.161   0.653
   98   HD11  LEU  14          HD11      LEU  14  35.293  -2.394  -1.925
   99   HD12  LEU  14          HD12      LEU  14  34.826  -1.056  -2.976
  100   HD13  LEU  14          HD13      LEU  14  33.871  -2.539  -2.959
  101   HD21  LEU  14          HD21      LEU  14  31.743  -2.108  -0.543
  102   HD22  LEU  14          HD22      LEU  14  32.060  -2.393  -2.254
  103   HD23  LEU  14          HD23      LEU  14  31.561  -0.793  -1.704
  104    H    SER  15           H        SER  15  32.384  -0.216   1.804
  105    HA   SER  15           HA       SER  15  31.578   1.982   0.419
  106    HG   SER  15           HG       SER  15  28.968   1.089   2.245
  107    HB2  SER  15           HB2      SER  15  30.939   0.852   3.021
  108    HB3  SER  15           HB3      SER  15  30.806   2.610   3.041
  109    H    GLN  16           H        GLN  16  33.258   2.159   3.542
  110    HA   GLN  16           HA       GLN  16  33.778   4.775   3.827
  111    HB2  GLN  16           HB2      GLN  16  34.679   2.700   5.143
  112    HB3  GLN  16           HB3      GLN  16  36.089   2.881   4.108
  113    HG2  GLN  16           HG2      GLN  16  34.976   4.925   6.004
  114    HG3  GLN  16           HG3      GLN  16  36.457   3.994   6.206
  115   HE21  GLN  16          HE21      GLN  16  37.393   4.186   3.553
  116   HE22  GLN  16          HE22      GLN  16  37.866   5.824   3.259
  117    H    MET  17           H        MET  17  35.297   2.623   1.507
  118    HA   MET  17           HA       MET  17  37.186   4.588   0.607
  119    HB2  MET  17           HB2      MET  17  37.961   2.393   0.400
  120    HB3  MET  17           HB3      MET  17  36.447   1.820  -0.287
  121    HG2  MET  17           HG2      MET  17  38.143   1.876  -1.984
  122    HG3  MET  17           HG3      MET  17  36.913   3.090  -2.333
  123    HE1  MET  17           HE1      MET  17  40.604   2.365  -2.063
  124    HE2  MET  17           HE2      MET  17  40.306   2.667  -0.351
  125    HE3  MET  17           HE3      MET  17  41.308   3.780  -1.281
  126    H    LEU  18           H        LEU  18  33.949   3.576  -0.331
  127    HA   LEU  18           HA       LEU  18  34.166   5.159  -2.795
  128    HG   LEU  18           HG       LEU  18  30.911   5.136  -2.694
  129    HB2  LEU  18           HB2      LEU  18  33.103   3.151  -3.283
  130    HB3  LEU  18           HB3      LEU  18  32.202   3.146  -1.778
  131   HD11  LEU  18          HD11      LEU  18  32.053   5.999  -4.472
  132   HD12  LEU  18          HD12      LEU  18  30.920   4.945  -5.317
  133   HD13  LEU  18          HD13      LEU  18  32.580   4.417  -5.047
  134   HD21  LEU  18          HD21      LEU  18  29.611   3.266  -2.671
  135   HD22  LEU  18          HD22      LEU  18  30.748   2.324  -3.634
  136   HD23  LEU  18          HD23      LEU  18  29.712   3.519  -4.414
  137    H    SER  19           H        SER  19  31.533   4.765  -0.439
  138    HA   SER  19           HA       SER  19  30.272   7.160  -0.879
  139    HG   SER  19           HG       SER  19  28.219   6.547   1.892
  140    HB2  SER  19           HB2      SER  19  29.431   5.146   0.390
  141    HB3  SER  19           HB3      SER  19  30.296   5.775   1.793
  142    H    MET  20           H        MET  20  33.346   7.185   0.236
  143    HA   MET  20           HA       MET  20  32.898   9.394   2.106
  144    HB2  MET  20           HB2      MET  20  35.173   7.541   1.590
  145    HB3  MET  20           HB3      MET  20  35.545   9.154   2.178
  146    HG2  MET  20           HG2      MET  20  33.408   7.870   3.672
  147    HG3  MET  20           HG3      MET  20  34.923   6.973   3.721
  148    HE1  MET  20           HE1      MET  20  33.961   9.503   6.833
  149    HE2  MET  20           HE2      MET  20  34.664   7.886   6.794
  150    HE3  MET  20           HE3      MET  20  33.188   8.227   5.891
  151    H    GLY  21           H        GLY  21  33.930   8.594  -1.057
  152    HA2  GLY  21           HA2      GLY  21  33.787  10.387  -2.720
  153    HA3  GLY  21           HA3      GLY  21  34.579  11.435  -1.548
  154    H    PHE  22           H        PHE  22  35.651   8.129  -1.943
  155    HA   PHE  22           HA       PHE  22  37.871   9.013  -3.619
  156    HD1  PHE  22           HD1      PHE  22  36.854   9.772  -0.406
  157    HD2  PHE  22           HD2      PHE  22  40.931   9.369  -1.562
  158    HE1  PHE  22           HE1      PHE  22  37.390  11.872   0.760
  159    HE2  PHE  22           HE2      PHE  22  41.474  11.466  -0.396
  160    HZ   PHE  22           HZ       PHE  22  39.702  12.720   0.766
  161    HB2  PHE  22           HB2      PHE  22  38.141   7.449  -1.040
  162    HB3  PHE  22           HB3      PHE  22  39.449   7.747  -2.186
  163    H    SER  23           H        SER  23  39.227   6.826  -4.027
  164    HA   SER  23           HA       SER  23  37.677   4.454  -4.135
  165    HG   SER  23           HG       SER  23  35.735   5.118  -5.341
  166    HB2  SER  23           HB2      SER  23  38.057   5.974  -6.731
  167    HB3  SER  23           HB3      SER  23  37.495   4.305  -6.621
  168    H    ASP  24           H        ASP  24  39.325   4.136  -6.932
  169    HA   ASP  24           HA       ASP  24  41.858   3.538  -5.561
  170    HB2  ASP  24           HB2      ASP  24  42.121   1.606  -6.948
  171    HB3  ASP  24           HB3      ASP  24  40.482   1.548  -6.296
  172    H    GLU  25           H        GLU  25  43.450   4.857  -6.237
  173    HA   GLU  25           HA       GLU  25  43.324   6.726  -8.202
  174    HB2  GLU  25           HB2      GLU  25  45.230   6.183  -6.496
  175    HB3  GLU  25           HB3      GLU  25  45.919   5.292  -7.845
  176    HG2  GLU  25           HG2      GLU  25  45.332   7.663  -9.023
  177    HG3  GLU  25           HG3      GLU  25  45.739   8.175  -7.384
  178    H    GLY  26           H        GLY  26  44.456   3.433  -8.581
  179    HA2  GLY  26           HA2      GLY  26  43.965   3.683 -11.477
  180    HA3  GLY  26           HA3      GLY  26  45.424   2.902 -10.870
  181    H    GLY  27           H        GLY  27  45.079   1.008  -9.414
  182    HA2  GLY  27           HA2      GLY  27  42.554  -0.340  -9.464
  183    HA3  GLY  27           HA3      GLY  27  43.702  -1.024 -10.611
  184    H    TRP  28           H        TRP  28  44.541   0.446  -7.559
  185    HA   TRP  28           HA       TRP  28  45.773  -2.063  -6.704
  186    HD1  TRP  28           HD1      TRP  28  46.970   2.224  -7.276
  187    HE1  TRP  28           HE1      TRP  28  45.829   4.295  -6.282
  188    HE3  TRP  28           HE3      TRP  28  44.521   0.035  -3.379
  189    HZ2  TRP  28           HZ2      TRP  28  44.110   4.937  -4.149
  190    HZ3  TRP  28           HZ3      TRP  28  43.147   1.442  -1.901
  191    HH2  TRP  28           HH2      TRP  28  42.944   3.845  -2.282
  192    HB2  TRP  28           HB2      TRP  28  46.791  -0.595  -4.912
  193    HB3  TRP  28           HB3      TRP  28  47.260  -0.206  -6.568
  194    H    LEU  29           H        LEU  29  43.206   0.144  -5.882
  195    HA   LEU  29           HA       LEU  29  42.610  -0.274  -3.298
  196    HG   LEU  29           HG       LEU  29  39.722  -1.714  -4.073
  197    HB2  LEU  29           HB2      LEU  29  41.022   0.989  -4.383
  198    HB3  LEU  29           HB3      LEU  29  40.872  -0.147  -5.713
  199   HD11  LEU  29          HD11      LEU  29  39.617   0.819  -2.443
  200   HD12  LEU  29          HD12      LEU  29  40.500  -0.650  -2.029
  201   HD13  LEU  29          HD13      LEU  29  38.738  -0.671  -2.096
  202   HD21  LEU  29          HD21      LEU  29  38.731   0.230  -5.710
  203   HD22  LEU  29          HD22      LEU  29  37.986   0.642  -4.165
  204   HD23  LEU  29          HD23      LEU  29  37.759  -0.966  -4.853
  205    H    THR  30           H        THR  30  41.167  -2.415  -5.728
  206    HA   THR  30           HA       THR  30  40.248  -4.432  -4.202
  207    HB   THR  30           HB       THR  30  40.676  -5.979  -6.038
  208    HG1  THR  30           HG1      THR  30  42.796  -4.358  -6.449
  209   HG21  THR  30          HG21      THR  30  38.925  -4.791  -6.820
  210   HG22  THR  30          HG22      THR  30  40.122  -4.283  -8.013
  211   HG23  THR  30          HG23      THR  30  39.750  -3.243  -6.638
  212    H    ARG  31           H        ARG  31  43.610  -3.742  -4.885
  213    HA   ARG  31           HA       ARG  31  44.536  -6.115  -3.497
  214    HE   ARG  31           HE       ARG  31  49.710  -3.018  -5.179
  215    HB2  ARG  31           HB2      ARG  31  46.192  -5.856  -4.982
  216    HB3  ARG  31           HB3      ARG  31  45.614  -4.258  -5.425
  217    HG2  ARG  31           HG2      ARG  31  47.024  -3.194  -3.928
  218    HG3  ARG  31           HG3      ARG  31  47.236  -4.642  -2.942
  219    HD2  ARG  31           HD2      ARG  31  48.742  -5.588  -4.429
  220    HD3  ARG  31           HD3      ARG  31  48.183  -4.601  -5.779
  221   HH11  ARG  31          HH11      ARG  31  49.113  -5.091  -2.447
  222   HH12  ARG  31          HH12      ARG  31  50.340  -4.366  -1.461
  223   HH21  ARG  31          HH21      ARG  31  51.330  -2.054  -3.893
  224   HH22  ARG  31          HH22      ARG  31  51.601  -2.637  -2.285
  225    H    LEU  32           H        LEU  32  45.142  -2.598  -3.173
  226    HA   LEU  32           HA       LEU  32  46.489  -2.378  -0.893
  227    HG   LEU  32           HG       LEU  32  44.999   1.068  -0.391
  228    HB2  LEU  32           HB2      LEU  32  45.667  -0.460  -2.082
  229    HB3  LEU  32           HB3      LEU  32  44.007  -0.832  -1.638
  230   HD11  LEU  32          HD11      LEU  32  43.953   0.556   1.600
  231   HD12  LEU  32          HD12      LEU  32  44.461  -1.131   1.557
  232   HD13  LEU  32          HD13      LEU  32  43.193  -0.565   0.470
  233   HD21  LEU  32          HD21      LEU  32  46.772  -1.062   0.791
  234   HD22  LEU  32          HD22      LEU  32  46.630   0.596   1.375
  235   HD23  LEU  32          HD23      LEU  32  47.284   0.280  -0.231
  236    H    LEU  33           H        LEU  33  42.906  -2.555  -0.768
  237    HA   LEU  33           HA       LEU  33  42.655  -2.916   1.974
  238    HG   LEU  33           HG       LEU  33  40.472  -2.389   2.385
  239    HB2  LEU  33           HB2      LEU  33  41.005  -3.409  -0.393
  240    HB3  LEU  33           HB3      LEU  33  40.657  -4.517   0.925
  241   HD11  LEU  33          HD11      LEU  33  40.924  -1.262  -0.256
  242   HD12  LEU  33          HD12      LEU  33  40.994  -0.497   1.331
  243   HD13  LEU  33          HD13      LEU  33  39.449  -0.659   0.498
  244   HD21  LEU  33          HD21      LEU  33  38.149  -2.233   1.937
  245   HD22  LEU  33          HD22      LEU  33  38.613  -3.902   1.605
  246   HD23  LEU  33          HD23      LEU  33  38.362  -2.774   0.272
  247    H    GLN  34           H        GLN  34  42.731  -5.393  -0.533
  248    HA   GLN  34           HA       GLN  34  42.716  -7.718   0.869
  249    HB2  GLN  34           HB2      GLN  34  43.749  -6.834  -1.672
  250    HB3  GLN  34           HB3      GLN  34  44.764  -8.104  -1.004
  251    HG2  GLN  34           HG2      GLN  34  43.218  -9.272  -2.264
  252    HG3  GLN  34           HG3      GLN  34  42.561  -9.377  -0.631
  253   HE21  GLN  34          HE21      GLN  34  41.101  -7.402  -0.116
  254   HE22  GLN  34          HE22      GLN  34  39.911  -7.045  -1.317
  255    H    THR  35           H        THR  35  45.693  -5.903   0.107
  256    HA   THR  35           HA       THR  35  47.325  -7.481   1.846
  257    HB   THR  35           HB       THR  35  48.893  -5.381   1.431
  258    HG1  THR  35           HG1      THR  35  48.266  -4.572  -0.722
  259   HG21  THR  35          HG21      THR  35  48.984  -7.754   0.403
  260   HG22  THR  35          HG22      THR  35  49.841  -6.427  -0.382
  261   HG23  THR  35          HG23      THR  35  48.287  -6.971  -1.015
  262    H    LYS  36           H        LYS  36  45.013  -5.351   2.530
  263    HA   LYS  36           HA       LYS  36  46.265  -4.516   5.059
  264    HB2  LYS  36           HB2      LYS  36  44.986  -2.883   3.032
  265    HB3  LYS  36           HB3      LYS  36  44.173  -2.724   4.582
  266    HG2  LYS  36           HG2      LYS  36  45.718  -1.139   4.938
  267    HG3  LYS  36           HG3      LYS  36  46.743  -2.513   5.360
  268    HD2  LYS  36           HD2      LYS  36  47.107  -2.476   2.701
  269    HD3  LYS  36           HD3      LYS  36  46.790  -0.765   2.978
  270    HE2  LYS  36           HE2      LYS  36  49.149  -2.334   3.576
  271    HE3  LYS  36           HE3      LYS  36  48.948  -0.584   3.508
  272    HZ1  LYS  36           HZ1      LYS  36  48.565  -2.390   5.815
  273    HZ2  LYS  36           HZ2      LYS  36  47.866  -0.851   5.787
  274    HZ3  LYS  36           HZ3      LYS  36  49.547  -1.017   5.698
  275    H    ASN  37           H        ASN  37  44.676  -6.867   4.283
  276    HA   ASN  37           HA       ASN  37  42.864  -8.079   4.946
  277    HB2  ASN  37           HB2      ASN  37  42.406  -8.033   7.327
  278    HB3  ASN  37           HB3      ASN  37  44.143  -7.864   7.073
  279   HD21  ASN  37          HD21      ASN  37  41.304  -6.457   8.339
  280   HD22  ASN  37          HD22      ASN  37  42.022  -5.012   8.960
  281    H    TYR  38           H        TYR  38  42.398  -5.576   3.556
  282    HA   TYR  38           HA       TYR  38  40.576  -4.461   2.776
  283    HD1  TYR  38           HD1      TYR  38  40.329  -8.029   4.282
  284    HD2  TYR  38           HD2      TYR  38  37.939  -5.862   1.507
  285    HE1  TYR  38           HE1      TYR  38  40.282  -9.991   2.798
  286    HE2  TYR  38           HE2      TYR  38  37.883  -7.818   0.018
  287    HH   TYR  38           HH       TYR  38  39.417  -9.880  -0.370
  288    HB2  TYR  38           HB2      TYR  38  39.054  -5.949   4.924
  289    HB3  TYR  38           HB3      TYR  38  38.331  -4.971   3.654
  290    H    ASP  39           H        ASP  39  42.190  -2.954   4.114
  291    HA   ASP  39           HA       ASP  39  40.473  -1.436   5.977
  292    HB2  ASP  39           HB2      ASP  39  43.438  -1.953   6.097
  293    HB3  ASP  39           HB3      ASP  39  42.683  -0.621   6.976
  294    H    ILE  40           H        ILE  40  40.089   0.634   5.521
  295    HA   ILE  40           HA       ILE  40  41.224   1.730   3.107
  296    HB   ILE  40           HB       ILE  40  39.684   3.677   3.665
  297   HG12  ILE  40          HG12      ILE  40  39.602   2.722   6.146
  298   HG13  ILE  40          HG13      ILE  40  38.247   3.608   5.455
  299   HG21  ILE  40          HG21      ILE  40  38.943   2.237   1.990
  300   HG22  ILE  40          HG22      ILE  40  37.603   2.271   3.136
  301   HG23  ILE  40          HG23      ILE  40  38.710   0.898   3.114
  302   HD11  ILE  40          HD11      ILE  40  37.995   1.260   6.697
  303   HD12  ILE  40          HD12      ILE  40  38.242   0.689   5.046
  304   HD13  ILE  40          HD13      ILE  40  36.916   1.792   5.408
  305    H    GLY  41           H        GLY  41  41.460   2.020   6.540
  306    HA2  GLY  41           HA2      GLY  41  42.435   4.445   7.057
  307    HA3  GLY  41           HA3      GLY  41  43.151   3.017   7.777
  308    H    ALA  42           H        ALA  42  44.211   1.878   5.515
  309    HA   ALA  42           HA       ALA  42  46.482   3.638   5.029
  310    HB1  ALA  42           HB1      ALA  42  47.164   1.303   3.829
  311    HB2  ALA  42           HB2      ALA  42  46.074   0.728   5.092
  312    HB3  ALA  42           HB3      ALA  42  47.494   1.684   5.519
  313    H    ALA  43           H        ALA  43  43.728   2.319   3.480
  314    HA   ALA  43           HA       ALA  43  44.476   2.384   0.790
  315    HB1  ALA  43           HB1      ALA  43  41.779   3.091   1.956
  316    HB2  ALA  43           HB2      ALA  43  42.328   1.466   1.550
  317    HB3  ALA  43           HB3      ALA  43  42.102   2.664   0.276
  318    H    LEU  44           H        LEU  44  43.404   4.909   2.956
  319    HA   LEU  44           HA       LEU  44  43.085   7.014   1.155
  320    HG   LEU  44           HG       LEU  44  41.546   8.093   2.425
  321    HB2  LEU  44           HB2      LEU  44  43.706   6.796   4.051
  322    HB3  LEU  44           HB3      LEU  44  43.988   8.351   3.281
  323   HD11  LEU  44          HD11      LEU  44  41.586   5.670   3.402
  324   HD12  LEU  44          HD12      LEU  44  40.125   6.653   3.505
  325   HD13  LEU  44          HD13      LEU  44  41.180   6.491   4.909
  326   HD21  LEU  44          HD21      LEU  44  42.649   9.025   4.967
  327   HD22  LEU  44          HD22      LEU  44  40.912   8.726   5.002
  328   HD23  LEU  44          HD23      LEU  44  41.591   9.844   3.819
  329    H    ASP  45           H        ASP  45  45.907   6.352   3.192
  330    HA   ASP  45           HA       ASP  45  47.733   8.112   2.416
  331    HB2  ASP  45           HB2      ASP  45  48.274   6.363   3.979
  332    HB3  ASP  45           HB3      ASP  45  48.187   5.145   2.710
  333    H    THR  46           H        THR  46  46.539   5.559   0.362
  334    HA   THR  46           HA       THR  46  48.528   6.168  -1.679
  335    HB   THR  46           HB       THR  46  47.733   4.142  -2.816
  336    HG1  THR  46           HG1      THR  46  45.802   3.513  -2.341
  337   HG21  THR  46          HG21      THR  46  49.101   2.914  -1.590
  338   HG22  THR  46          HG22      THR  46  47.982   2.924  -0.227
  339   HG23  THR  46          HG23      THR  46  49.146   4.234  -0.422
  340    H    ILE  47           H        ILE  47  45.011   6.338  -1.285
  341    HA   ILE  47           HA       ILE  47  44.460   6.802  -4.026
  342    HB   ILE  47           HB       ILE  47  42.404   8.108  -2.662
  343   HG12  ILE  47          HG12      ILE  47  42.943   5.509  -1.256
  344   HG13  ILE  47          HG13      ILE  47  43.502   7.044  -0.600
  345   HG21  ILE  47          HG21      ILE  47  41.070   6.421  -3.541
  346   HG22  ILE  47          HG22      ILE  47  42.339   5.205  -3.399
  347   HG23  ILE  47          HG23      ILE  47  42.458   6.467  -4.626
  348   HD11  ILE  47          HD11      ILE  47  40.634   6.425  -1.244
  349   HD12  ILE  47          HD12      ILE  47  41.259   7.844  -0.407
  350   HD13  ILE  47          HD13      ILE  47  41.362   6.256   0.352
  351    H    GLN  48           H        GLN  48  45.193   8.999  -1.404
  352    HA   GLN  48           HA       GLN  48  45.853  11.063  -3.287
  353    HB2  GLN  48           HB2      GLN  48  43.312  11.147  -1.768
  354    HB3  GLN  48           HB3      GLN  48  44.258  12.628  -1.763
  355    HG2  GLN  48           HG2      GLN  48  43.647  13.124  -3.834
  356    HG3  GLN  48           HG3      GLN  48  44.079  11.518  -4.417
  357   HE21  GLN  48          HE21      GLN  48  42.422   9.825  -3.369
  358   HE22  GLN  48          HE22      GLN  48  40.765  10.212  -3.699
  359    H    TYR  49           H        TYR  49  44.888  10.781   0.124
  360    HA   TYR  49           HA       TYR  49  46.794  12.531   1.159
  361    HD1  TYR  49           HD2      TYR  49  43.362  10.414   1.613
  362    HD2  TYR  49           HD1      TYR  49  45.427  13.480   3.721
  363    HE1  TYR  49           HE2      TYR  49  41.247  11.629   1.906
  364    HE2  TYR  49           HE1      TYR  49  43.315  14.702   4.021
  365    HH   TYR  49           HH       TYR  49  40.474  13.528   3.869
  366    HB2  TYR  49           HB2      TYR  49  45.618  10.054   2.455
  367    HB3  TYR  49           HB3      TYR  49  46.478  11.332   3.312
  368    H    SER  50           H        SER  50  48.964  12.392   1.214
  369    HA   SER  50           HA       SER  50  50.194   9.747   1.430
  370    HG   SER  50           HG       SER  50  51.926  11.756  -1.582
  371    HB2  SER  50           HB2      SER  50  51.457   9.873  -0.521
  372    HB3  SER  50           HB3      SER  50  49.920  10.570  -1.038
  373    H    LYS  51           H        LYS  51  49.969  11.950   3.276
  374    HA   LYS  51           HA       LYS  51  52.638  12.098   4.175
  375    HB2  LYS  51           HB2      LYS  51  52.131  13.941   2.183
  376    HB3  LYS  51           HB3      LYS  51  51.878  14.873   3.654
  377    HG2  LYS  51           HG2      LYS  51  54.118  15.208   3.215
  378    HG3  LYS  51           HG3      LYS  51  54.151  13.891   4.389
  379    HD2  LYS  51           HD2      LYS  51  54.262  12.291   2.469
  380    HD3  LYS  51           HD3      LYS  51  54.444  13.681   1.396
  381    HE2  LYS  51           HE2      LYS  51  56.281  13.050   3.700
  382    HE3  LYS  51           HE3      LYS  51  56.594  12.598   2.026
  383    HZ1  LYS  51           HZ1      LYS  51  56.211  15.385   2.974
  384    HZ2  LYS  51           HZ2      LYS  51  56.642  14.904   1.411
  385    HZ3  LYS  51           HZ3      LYS  51  57.715  14.663   2.696
  386    H    HIS  52           H        HIS  52  50.885  11.222   5.724
  387    HA   HIS  52           HA       HIS  52  49.141  12.991   7.043
  388    HD1  HIS  52           HD1      HIS  52  49.410   8.621   6.496
  389    HD2  HIS  52           HD2      HIS  52  46.729  11.699   7.264
  390    HE1  HIS  52           HE1      HIS  52  47.239   7.963   5.381
  391    HB2  HIS  52           HB2      HIS  52  50.402  10.394   7.930
  392    HB3  HIS  52           HB3      HIS  52  49.212  11.262   8.894
  Start of MODEL   20
    1    H1   GLY   1           1H       GLY   1  28.543 -17.818   1.899
    2    H2   GLY   1           2H       GLY   1  30.108 -17.477   2.441
    3    H3   GLY   1           3H       GLY   1  29.733 -19.020   1.858
    4    HA2  GLY   1           HA2      GLY   1  31.012 -17.497   0.308
    5    HA3  GLY   1           HA3      GLY   1  29.606 -18.326  -0.342
    6    H    SER   2           H        SER   2  30.948 -15.275   0.642
    7    HA   SER   2           HA       SER   2  28.527 -13.872  -0.244
    8    HG   SER   2           HG       SER   2  29.170 -11.089   1.460
    9    HB2  SER   2           HB2      SER   2  29.285 -13.144   1.921
   10    HB3  SER   2           HB3      SER   2  30.933 -12.933   1.331
   11    HA   PRO   3           HA       PRO   3  30.691 -12.500  -3.861
   12    HB2  PRO   3           HB2      PRO   3  28.965 -10.659  -4.726
   13    HB3  PRO   3           HB3      PRO   3  28.501 -12.361  -4.616
   14    HG2  PRO   3           HG2      PRO   3  27.751 -10.080  -2.875
   15    HG3  PRO   3           HG3      PRO   3  26.841 -11.549  -3.259
   16    HD2  PRO   3           HD2      PRO   3  28.408 -11.033  -0.936
   17    HD3  PRO   3           HD3      PRO   3  27.604 -12.550  -1.377
   18    HA   PRO   4           HA       PRO   4  33.303  -9.088  -2.710
   19    HB2  PRO   4           HB2      PRO   4  33.680  -8.796  -5.639
   20    HB3  PRO   4           HB3      PRO   4  34.884  -9.041  -4.368
   21    HG2  PRO   4           HG2      PRO   4  34.231 -11.017  -6.040
   22    HG3  PRO   4           HG3      PRO   4  34.570 -11.336  -4.328
   23    HD2  PRO   4           HD2      PRO   4  31.939 -11.182  -5.746
   24    HD3  PRO   4           HD3      PRO   4  32.465 -12.290  -4.461
   25    H    GLU   5           H        GLU   5  31.078  -8.065  -2.243
   26    HA   GLU   5           HA       GLU   5  31.012  -5.450  -3.037
   27    HB2  GLU   5           HB2      GLU   5  29.971  -7.171  -5.101
   28    HB3  GLU   5           HB3      GLU   5  28.695  -6.123  -4.495
   29    HG2  GLU   5           HG2      GLU   5  30.541  -4.269  -4.789
   30    HG3  GLU   5           HG3      GLU   5  31.195  -5.432  -5.941
   31    H    ALA   6           H        ALA   6  30.564  -5.638  -0.766
   32    HA   ALA   6           HA       ALA   6  28.773  -4.804   0.618
   33    HB1  ALA   6           HB1      ALA   6  27.123  -7.057  -0.520
   34    HB2  ALA   6           HB2      ALA   6  27.012  -5.375  -1.039
   35    HB3  ALA   6           HB3      ALA   6  26.594  -5.817   0.617
   36    H    ASP   7           H        ASP   7  31.009  -6.524   0.862
   37    HA   ASP   7           HA       ASP   7  30.108  -8.541   2.791
   38    HB2  ASP   7           HB2      ASP   7  32.475  -8.233   1.045
   39    HB3  ASP   7           HB3      ASP   7  32.816  -8.842   2.662
   40    HA   PRO   8           HA       PRO   8  31.028  -6.423   6.534
   41    HB2  PRO   8           HB2      PRO   8  33.408  -8.256   6.645
   42    HB3  PRO   8           HB3      PRO   8  32.302  -7.782   7.941
   43    HG2  PRO   8           HG2      PRO   8  32.054 -10.136   6.640
   44    HG3  PRO   8           HG3      PRO   8  30.656  -9.241   7.258
   45    HD2  PRO   8           HD2      PRO   8  31.474  -9.709   4.486
   46    HD3  PRO   8           HD3      PRO   8  29.923  -9.117   5.111
   47    H    ARG   9           H        ARG   9  34.117  -7.381   5.063
   48    HA   ARG   9           HA       ARG   9  35.532  -5.070   5.710
   49    HE   ARG   9           HE       ARG   9  37.650  -9.694   6.206
   50    HB2  ARG   9           HB2      ARG   9  35.907  -7.170   3.593
   51    HB3  ARG   9           HB3      ARG   9  37.080  -5.879   3.863
   52    HG2  ARG   9           HG2      ARG   9  37.846  -7.798   5.038
   53    HG3  ARG   9           HG3      ARG   9  37.265  -6.644   6.236
   54    HD2  ARG   9           HD2      ARG   9  35.413  -7.917   6.749
   55    HD3  ARG   9           HD3      ARG   9  35.413  -8.737   5.189
   56   HH11  ARG   9          HH11      ARG   9  34.554  -9.238   7.745
   57   HH12  ARG   9          HH12      ARG   9  34.780 -10.537   8.867
   58   HH21  ARG   9          HH21      ARG   9  37.952 -11.400   7.682
   59   HH22  ARG   9          HH22      ARG   9  36.709 -11.763   8.834
   60    H    LEU  10           H        LEU  10  33.428  -5.678   3.004
   61    HA   LEU  10           HA       LEU  10  34.398  -3.306   1.627
   62    HG   LEU  10           HG       LEU  10  34.165  -5.873  -1.009
   63    HB2  LEU  10           HB2      LEU  10  32.596  -5.554   0.798
   64    HB3  LEU  10           HB3      LEU  10  32.684  -4.071  -0.136
   65   HD11  LEU  10          HD11      LEU  10  36.018  -3.773  -0.019
   66   HD12  LEU  10          HD12      LEU  10  34.636  -3.267  -0.991
   67   HD13  LEU  10          HD13      LEU  10  35.800  -4.417  -1.647
   68   HD21  LEU  10          HD21      LEU  10  34.699  -6.745   1.318
   69   HD22  LEU  10          HD22      LEU  10  35.852  -5.414   1.440
   70   HD23  LEU  10          HD23      LEU  10  36.048  -6.640   0.187
   71    H    ILE  11           H        ILE  11  31.705  -4.452   3.474
   72    HA   ILE  11           HA       ILE  11  29.999  -2.216   2.858
   73    HB   ILE  11           HB       ILE  11  29.216  -4.448   3.862
   74   HG12  ILE  11          HG12      ILE  11  28.060  -2.509   5.697
   75   HG13  ILE  11          HG13      ILE  11  28.211  -1.854   4.070
   76   HG21  ILE  11          HG21      ILE  11  30.488  -3.198   6.278
   77   HG22  ILE  11          HG22      ILE  11  30.720  -4.818   5.620
   78   HG23  ILE  11          HG23      ILE  11  29.199  -4.395   6.404
   79   HD11  ILE  11          HD11      ILE  11  27.171  -4.484   3.870
   80   HD12  ILE  11          HD12      ILE  11  26.397  -2.953   3.461
   81   HD13  ILE  11          HD13      ILE  11  26.249  -3.609   5.092
   82    H    GLU  12           H        GLU  12  32.690  -2.974   4.820
   83    HA   GLU  12           HA       GLU  12  32.475  -0.527   6.407
   84    HB2  GLU  12           HB2      GLU  12  33.683  -3.113   6.834
   85    HB3  GLU  12           HB3      GLU  12  34.879  -1.844   7.032
   86    HG2  GLU  12           HG2      GLU  12  33.761  -2.457   9.132
   87    HG3  GLU  12           HG3      GLU  12  33.532  -0.764   8.700
   88    H    SER  13           H        SER  13  34.939  -2.210   4.416
   89    HA   SER  13           HA       SER  13  36.554   0.135   4.211
   90    HG   SER  13           HG       SER  13  37.768  -1.866   5.076
   91    HB2  SER  13           HB2      SER  13  36.771  -2.311   2.457
   92    HB3  SER  13           HB3      SER  13  38.035  -1.147   2.855
   93    H    LEU  14           H        LEU  14  34.159  -1.381   2.035
   94    HA   LEU  14           HA       LEU  14  34.765   0.499  -0.074
   95    HG   LEU  14           HG       LEU  14  33.478   0.353  -2.016
   96    HB2  LEU  14           HB2      LEU  14  33.643  -1.931  -0.168
   97    HB3  LEU  14           HB3      LEU  14  32.180  -0.976  -0.018
   98   HD11  LEU  14          HD11      LEU  14  34.446  -1.175  -3.533
   99   HD12  LEU  14          HD12      LEU  14  33.941  -2.563  -2.571
  100   HD13  LEU  14          HD13      LEU  14  35.203  -1.488  -1.971
  101   HD21  LEU  14          HD21      LEU  14  31.969  -1.447  -3.400
  102   HD22  LEU  14          HD22      LEU  14  31.345  -0.002  -2.605
  103   HD23  LEU  14          HD23      LEU  14  31.276  -1.561  -1.781
  104    H    SER  15           H        SER  15  31.766  -0.189   1.750
  105    HA   SER  15           HA       SER  15  30.442   2.155   1.260
  106    HG   SER  15           HG       SER  15  28.624   2.376   2.416
  107    HB2  SER  15           HB2      SER  15  30.023  -0.006   2.912
  108    HB3  SER  15           HB3      SER  15  30.147   1.331   4.056
  109    H    GLN  16           H        GLN  16  33.355   1.915   2.909
  110    HA   GLN  16           HA       GLN  16  33.009   4.450   4.339
  111    HB2  GLN  16           HB2      GLN  16  34.132   2.768   5.657
  112    HB3  GLN  16           HB3      GLN  16  35.256   2.423   4.351
  113    HG2  GLN  16           HG2      GLN  16  35.102   5.083   5.740
  114    HG3  GLN  16           HG3      GLN  16  36.169   3.776   6.251
  115   HE21  GLN  16          HE21      GLN  16  36.068   6.549   4.557
  116   HE22  GLN  16          HE22      GLN  16  37.370   6.284   3.453
  117    H    MET  17           H        MET  17  34.722   2.856   1.764
  118    HA   MET  17           HA       MET  17  36.201   5.212   0.990
  119    HB2  MET  17           HB2      MET  17  35.973   2.425  -0.134
  120    HB3  MET  17           HB3      MET  17  36.863   3.695  -0.960
  121    HG2  MET  17           HG2      MET  17  37.512   3.205   1.886
  122    HG3  MET  17           HG3      MET  17  38.017   1.993   0.711
  123    HE1  MET  17           HE1      MET  17  38.620   6.361   0.547
  124    HE2  MET  17           HE2      MET  17  39.596   5.837   1.920
  125    HE3  MET  17           HE3      MET  17  37.881   5.432   1.852
  126    H    LEU  18           H        LEU  18  33.058   4.051   0.482
  127    HA   LEU  18           HA       LEU  18  32.836   5.213  -2.194
  128    HG   LEU  18           HG       LEU  18  30.870   4.420  -3.472
  129    HB2  LEU  18           HB2      LEU  18  31.500   3.154  -0.807
  130    HB3  LEU  18           HB3      LEU  18  30.322   4.437  -1.014
  131   HD11  LEU  18          HD11      LEU  18  32.300   2.938  -4.406
  132   HD12  LEU  18          HD12      LEU  18  31.973   1.693  -3.199
  133   HD13  LEU  18          HD13      LEU  18  33.058   3.030  -2.815
  134   HD21  LEU  18          HD21      LEU  18  29.627   2.110  -2.034
  135   HD22  LEU  18          HD22      LEU  18  29.717   2.123  -3.795
  136   HD23  LEU  18          HD23      LEU  18  28.854   3.406  -2.947
  137    H    SER  19           H        SER  19  30.789   5.443   0.698
  138    HA   SER  19           HA       SER  19  29.664   7.908   0.116
  139    HG   SER  19           HG       SER  19  27.695   7.282   1.314
  140    HB2  SER  19           HB2      SER  19  29.380   6.019   2.112
  141    HB3  SER  19           HB3      SER  19  29.982   7.429   2.984
  142    H    MET  20           H        MET  20  32.828   7.241   1.042
  143    HA   MET  20           HA       MET  20  33.331   9.737   2.412
  144    HB2  MET  20           HB2      MET  20  34.746   7.939   3.071
  145    HB3  MET  20           HB3      MET  20  35.119   7.524   1.403
  146    HG2  MET  20           HG2      MET  20  37.037   8.572   2.247
  147    HG3  MET  20           HG3      MET  20  36.247   9.775   1.229
  148    HE1  MET  20           HE1      MET  20  36.749  11.816   1.748
  149    HE2  MET  20           HE2      MET  20  36.703  12.666   3.292
  150    HE3  MET  20           HE3      MET  20  35.200  12.266   2.460
  151    H    GLY  21           H        GLY  21  33.360   8.448  -0.777
  152    HA2  GLY  21           HA2      GLY  21  33.200   9.768  -2.727
  153    HA3  GLY  21           HA3      GLY  21  33.944  11.104  -1.852
  154    H    PHE  22           H        PHE  22  35.207   7.803  -1.856
  155    HA   PHE  22           HA       PHE  22  37.336   8.648  -3.677
  156    HD1  PHE  22           HD2      PHE  22  38.115  10.290  -3.217
  157    HD2  PHE  22           HD1      PHE  22  38.902   8.765   0.678
  158    HE1  PHE  22           HE2      PHE  22  38.763  12.543  -2.469
  159    HE2  PHE  22           HE1      PHE  22  39.550  11.014   1.432
  160    HZ   PHE  22           HZ       PHE  22  39.481  12.908  -0.141
  161    HB2  PHE  22           HB2      PHE  22  37.694   7.462  -0.919
  162    HB3  PHE  22           HB3      PHE  22  38.975   7.501  -2.131
  163    H    SER  23           H        SER  23  38.854   6.499  -3.763
  164    HA   SER  23           HA       SER  23  37.419   4.053  -3.699
  165    HG   SER  23           HG       SER  23  35.873   5.888  -5.815
  166    HB2  SER  23           HB2      SER  23  37.867   5.364  -6.391
  167    HB3  SER  23           HB3      SER  23  37.494   3.652  -6.194
  168    H    ASP  24           H        ASP  24  39.351   3.737  -6.369
  169    HA   ASP  24           HA       ASP  24  41.769   3.297  -4.753
  170    HB2  ASP  24           HB2      ASP  24  41.974   1.615  -6.965
  171    HB3  ASP  24           HB3      ASP  24  41.592   1.124  -5.317
  172    H    GLU  25           H        GLU  25  43.351   4.688  -5.362
  173    HA   GLU  25           HA       GLU  25  43.314   6.524  -7.309
  174    HB2  GLU  25           HB2      GLU  25  45.217   5.973  -5.647
  175    HB3  GLU  25           HB3      GLU  25  45.870   4.997  -6.956
  176    HG2  GLU  25           HG2      GLU  25  46.593   6.780  -8.088
  177    HG3  GLU  25           HG3      GLU  25  45.128   7.704  -7.759
  178    H    GLY  26           H        GLY  26  44.124   3.162  -7.797
  179    HA2  GLY  26           HA2      GLY  26  43.591   3.508 -10.657
  180    HA3  GLY  26           HA3      GLY  26  45.128   2.793 -10.181
  181    H    GLY  27           H        GLY  27  44.876   0.883  -8.595
  182    HA2  GLY  27           HA2      GLY  27  42.451  -0.628  -8.682
  183    HA3  GLY  27           HA3      GLY  27  43.636  -1.230  -9.836
  184    H    TRP  28           H        TRP  28  44.253   0.229  -6.753
  185    HA   TRP  28           HA       TRP  28  45.672  -2.183  -5.898
  186    HD1  TRP  28           HD1      TRP  28  46.594   2.250  -6.319
  187    HE1  TRP  28           HE1      TRP  28  45.328   4.170  -5.174
  188    HE3  TRP  28           HE3      TRP  28  44.383  -0.355  -2.542
  189    HZ2  TRP  28           HZ2      TRP  28  43.627   4.534  -2.968
  190    HZ3  TRP  28           HZ3      TRP  28  42.948   0.845  -0.949
  191    HH2  TRP  28           HH2      TRP  28  42.567   3.241  -1.163
  192    HB2  TRP  28           HB2      TRP  28  46.662  -0.713  -4.137
  193    HB3  TRP  28           HB3      TRP  28  47.032  -0.210  -5.785
  194    H    LEU  29           H        LEU  29  42.978  -0.111  -5.041
  195    HA   LEU  29           HA       LEU  29  42.441  -0.654  -2.459
  196    HG   LEU  29           HG       LEU  29  39.654  -1.940  -2.811
  197    HB2  LEU  29           HB2      LEU  29  40.877   0.672  -3.539
  198    HB3  LEU  29           HB3      LEU  29  40.626  -0.486  -4.830
  199   HD11  LEU  29          HD11      LEU  29  38.944  -0.813  -0.996
  200   HD12  LEU  29          HD12      LEU  29  38.588   0.651  -1.912
  201   HD13  LEU  29          HD13      LEU  29  40.247   0.293  -1.432
  202   HD21  LEU  29          HD21      LEU  29  37.632  -0.025  -3.543
  203   HD22  LEU  29          HD22      LEU  29  37.798  -1.717  -4.012
  204   HD23  LEU  29          HD23      LEU  29  38.616  -0.460  -4.939
  205    H    THR  30           H        THR  30  41.088  -2.758  -4.991
  206    HA   THR  30           HA       THR  30  40.225  -4.820  -3.449
  207    HB   THR  30           HB       THR  30  39.768  -5.277  -5.634
  208    HG1  THR  30           HG1      THR  30  42.260  -6.598  -5.644
  209   HG21  THR  30          HG21      THR  30  42.309  -3.913  -6.187
  210   HG22  THR  30          HG22      THR  30  40.763  -3.832  -7.031
  211   HG23  THR  30          HG23      THR  30  41.857  -5.184  -7.324
  212    H    ARG  31           H        ARG  31  43.521  -3.928  -4.101
  213    HA   ARG  31           HA       ARG  31  44.582  -6.364  -2.904
  214    HE   ARG  31           HE       ARG  31  46.894  -7.064  -6.247
  215    HB2  ARG  31           HB2      ARG  31  46.268  -4.061  -3.794
  216    HB3  ARG  31           HB3      ARG  31  46.624  -5.779  -3.836
  217    HG2  ARG  31           HG2      ARG  31  44.657  -4.363  -5.619
  218    HG3  ARG  31           HG3      ARG  31  46.291  -4.851  -6.072
  219    HD2  ARG  31           HD2      ARG  31  44.280  -6.832  -5.049
  220    HD3  ARG  31           HD3      ARG  31  44.347  -6.379  -6.752
  221   HH11  ARG  31          HH11      ARG  31  43.871  -8.651  -5.563
  222   HH12  ARG  31          HH12      ARG  31  44.534 -10.247  -5.677
  223   HH21  ARG  31          HH21      ARG  31  47.776  -9.163  -6.406
  224   HH22  ARG  31          HH22      ARG  31  46.754 -10.538  -6.157
  225    H    LEU  32           H        LEU  32  45.239  -2.875  -2.495
  226    HA   LEU  32           HA       LEU  32  46.677  -2.718  -0.275
  227    HG   LEU  32           HG       LEU  32  45.351   0.764   0.309
  228    HB2  LEU  32           HB2      LEU  32  45.771  -0.784  -1.436
  229    HB3  LEU  32           HB3      LEU  32  44.168  -1.122  -0.802
  230   HD11  LEU  32          HD11      LEU  32  43.750  -1.169   1.394
  231   HD12  LEU  32          HD12      LEU  32  44.183   0.362   2.154
  232   HD13  LEU  32          HD13      LEU  32  45.099  -1.099   2.528
  233   HD21  LEU  32          HD21      LEU  32  47.155   0.282   1.864
  234   HD22  LEU  32          HD22      LEU  32  47.610  -0.146   0.216
  235   HD23  LEU  32          HD23      LEU  32  47.153  -1.408   1.360
  236    H    LEU  33           H        LEU  33  43.120  -2.987  -0.077
  237    HA   LEU  33           HA       LEU  33  42.805  -3.226   2.638
  238    HG   LEU  33           HG       LEU  33  40.439  -2.867   2.819
  239    HB2  LEU  33           HB2      LEU  33  41.351  -4.196   0.264
  240    HB3  LEU  33           HB3      LEU  33  40.994  -5.048   1.759
  241   HD11  LEU  33          HD11      LEU  33  41.110  -0.994   1.843
  242   HD12  LEU  33          HD12      LEU  33  39.931  -1.284   0.563
  243   HD13  LEU  33          HD13      LEU  33  41.585  -1.869   0.388
  244   HD21  LEU  33          HD21      LEU  33  38.961  -3.990   0.501
  245   HD22  LEU  33          HD22      LEU  33  38.394  -2.474   1.202
  246   HD23  LEU  33          HD23      LEU  33  38.514  -3.919   2.206
  247    H    GLN  34           H        GLN  34  43.012  -5.969   0.444
  248    HA   GLN  34           HA       GLN  34  43.259  -8.089   2.100
  249    HB2  GLN  34           HB2      GLN  34  44.105  -7.456  -0.573
  250    HB3  GLN  34           HB3      GLN  34  45.251  -8.557   0.184
  251    HG2  GLN  34           HG2      GLN  34  43.852 -10.129  -0.588
  252    HG3  GLN  34           HG3      GLN  34  42.934  -9.741   0.867
  253   HE21  GLN  34          HE21      GLN  34  41.697  -7.453   0.300
  254   HE22  GLN  34          HE22      GLN  34  40.641  -7.628  -1.055
  255    H    THR  35           H        THR  35  46.054  -6.152   1.015
  256    HA   THR  35           HA       THR  35  47.873  -7.435   2.819
  257    HB   THR  35           HB       THR  35  49.211  -5.209   2.083
  258    HG1  THR  35           HG1      THR  35  47.501  -5.688  -0.109
  259   HG21  THR  35          HG21      THR  35  49.587  -7.724   1.521
  260   HG22  THR  35          HG22      THR  35  50.329  -6.466   0.533
  261   HG23  THR  35          HG23      THR  35  48.867  -7.278  -0.025
  262    H    LYS  36           H        LYS  36  45.458  -5.433   3.427
  263    HA   LYS  36           HA       LYS  36  46.762  -4.290   5.798
  264    HB2  LYS  36           HB2      LYS  36  45.550  -2.839   3.643
  265    HB3  LYS  36           HB3      LYS  36  44.600  -2.597   5.098
  266    HG2  LYS  36           HG2      LYS  36  46.055  -0.988   5.592
  267    HG3  LYS  36           HG3      LYS  36  47.179  -2.289   5.993
  268    HD2  LYS  36           HD2      LYS  36  47.925  -2.274   3.610
  269    HD3  LYS  36           HD3      LYS  36  46.924  -0.842   3.360
  270    HE2  LYS  36           HE2      LYS  36  49.562  -0.870   4.167
  271    HE3  LYS  36           HE3      LYS  36  48.451   0.494   4.281
  272    HZ1  LYS  36           HZ1      LYS  36  47.886  -0.161   6.512
  273    HZ2  LYS  36           HZ2      LYS  36  49.565  -0.004   6.391
  274    HZ3  LYS  36           HZ3      LYS  36  48.860  -1.541   6.405
  275    H    ASN  37           H        ASN  37  45.184  -6.726   5.316
  276    HA   ASN  37           HA       ASN  37  43.416  -7.895   6.160
  277    HB2  ASN  37           HB2      ASN  37  42.772  -6.773   8.573
  278    HB3  ASN  37           HB3      ASN  37  44.089  -7.920   8.323
  279   HD21  ASN  37          HD21      ASN  37  43.280  -4.976   9.571
  280   HD22  ASN  37          HD22      ASN  37  44.851  -4.265   9.659
  281    H    TYR  38           H        TYR  38  42.852  -5.704   4.436
  282    HA   TYR  38           HA       TYR  38  41.038  -4.633   3.570
  283    HD1  TYR  38           HD1      TYR  38  40.615  -8.238   5.207
  284    HD2  TYR  38           HD2      TYR  38  38.618  -5.907   2.263
  285    HE1  TYR  38           HE1      TYR  38  40.558 -10.188   3.710
  286    HE2  TYR  38           HE2      TYR  38  38.554  -7.849   0.757
  287    HH   TYR  38           HH       TYR  38  39.473  -9.930   0.393
  288    HB2  TYR  38           HB2      TYR  38  39.603  -6.110   5.782
  289    HB3  TYR  38           HB3      TYR  38  38.784  -5.136   4.563
  290    H    ASP  39           H        ASP  39  42.623  -3.044   4.858
  291    HA   ASP  39           HA       ASP  39  40.908  -1.469   6.673
  292    HB2  ASP  39           HB2      ASP  39  43.881  -1.919   6.653
  293    HB3  ASP  39           HB3      ASP  39  43.190  -0.491   7.421
  294    H    ILE  40           H        ILE  40  40.315   0.483   6.015
  295    HA   ILE  40           HA       ILE  40  41.384   1.536   3.540
  296    HB   ILE  40           HB       ILE  40  39.672   3.349   3.918
  297   HG12  ILE  40          HG12      ILE  40  39.700   2.662   6.497
  298   HG13  ILE  40          HG13      ILE  40  38.288   3.394   5.745
  299   HG21  ILE  40          HG21      ILE  40  37.690   1.663   3.680
  300   HG22  ILE  40          HG22      ILE  40  38.981   0.462   3.627
  301   HG23  ILE  40          HG23      ILE  40  38.933   1.758   2.432
  302   HD11  ILE  40          HD11      ILE  40  38.475   0.441   5.692
  303   HD12  ILE  40          HD12      ILE  40  37.068   1.489   5.865
  304   HD13  ILE  40          HD13      ILE  40  38.138   1.216   7.240
  305    H    GLY  41           H        GLY  41  41.505   2.030   6.960
  306    HA2  GLY  41           HA2      GLY  41  42.310   4.556   7.327
  307    HA3  GLY  41           HA3      GLY  41  43.056   3.230   8.191
  308    H    ALA  42           H        ALA  42  44.220   2.001   5.948
  309    HA   ALA  42           HA       ALA  42  46.445   3.842   5.499
  310    HB1  ALA  42           HB1      ALA  42  47.833   2.044   5.365
  311    HB2  ALA  42           HB2      ALA  42  46.627   1.040   4.560
  312    HB3  ALA  42           HB3      ALA  42  46.544   1.290   6.304
  313    H    ALA  43           H        ALA  43  43.820   2.341   3.907
  314    HA   ALA  43           HA       ALA  43  44.687   2.363   1.246
  315    HB1  ALA  43           HB1      ALA  43  41.937   2.896   2.381
  316    HB2  ALA  43           HB2      ALA  43  42.573   1.352   1.812
  317    HB3  ALA  43           HB3      ALA  43  42.276   2.660   0.667
  318    H    LEU  44           H        LEU  44  43.274   4.867   3.278
  319    HA   LEU  44           HA       LEU  44  42.946   6.970   1.563
  320    HG   LEU  44           HG       LEU  44  41.458   8.175   3.134
  321    HB2  LEU  44           HB2      LEU  44  43.818   6.786   4.411
  322    HB3  LEU  44           HB3      LEU  44  43.864   8.349   3.609
  323   HD11  LEU  44          HD11      LEU  44  40.118   6.399   3.879
  324   HD12  LEU  44          HD12      LEU  44  41.407   5.738   4.886
  325   HD13  LEU  44          HD13      LEU  44  41.517   5.627   3.130
  326   HD21  LEU  44          HD21      LEU  44  41.136   7.716   5.909
  327   HD22  LEU  44          HD22      LEU  44  41.226   9.257   5.055
  328   HD23  LEU  44          HD23      LEU  44  42.695   8.504   5.675
  329    H    ASP  45           H        ASP  45  45.854   6.591   3.555
  330    HA   ASP  45           HA       ASP  45  47.507   8.421   2.475
  331    HB2  ASP  45           HB2      ASP  45  48.318   7.153   4.292
  332    HB3  ASP  45           HB3      ASP  45  48.136   5.634   3.421
  333    H    THR  46           H        THR  46  46.521   5.474   0.885
  334    HA   THR  46           HA       THR  46  48.507   5.865  -1.219
  335    HB   THR  46           HB       THR  46  47.974   3.681  -1.979
  336    HG1  THR  46           HG1      THR  46  45.670   3.964  -1.745
  337   HG21  THR  46          HG21      THR  46  48.691   4.107   0.698
  338   HG22  THR  46          HG22      THR  46  48.984   2.678  -0.294
  339   HG23  THR  46          HG23      THR  46  47.525   2.785   0.691
  340    H    ILE  47           H        ILE  47  45.010   5.980  -0.776
  341    HA   ILE  47           HA       ILE  47  44.326   6.211  -3.515
  342    HB   ILE  47           HB       ILE  47  42.472   7.736  -1.936
  343   HG12  ILE  47          HG12      ILE  47  43.050   4.972  -0.871
  344   HG13  ILE  47          HG13      ILE  47  43.440   6.470  -0.045
  345   HG21  ILE  47          HG21      ILE  47  40.931   6.487  -3.036
  346   HG22  ILE  47          HG22      ILE  47  41.847   4.993  -2.847
  347   HG23  ILE  47          HG23      ILE  47  42.322   6.168  -4.073
  348   HD11  ILE  47          HD11      ILE  47  41.343   5.279   0.692
  349   HD12  ILE  47          HD12      ILE  47  40.641   5.771  -0.849
  350   HD13  ILE  47          HD13      ILE  47  41.181   6.991   0.306
  351    H    GLN  48           H        GLN  48  45.269   8.587  -1.105
  352    HA   GLN  48           HA       GLN  48  46.171  10.464  -2.949
  353    HB2  GLN  48           HB2      GLN  48  44.180  12.148  -2.338
  354    HB3  GLN  48           HB3      GLN  48  44.152  11.129  -3.769
  355    HG2  GLN  48           HG2      GLN  48  43.081   9.663  -1.568
  356    HG3  GLN  48           HG3      GLN  48  42.290  11.229  -1.660
  357   HE21  GLN  48          HE21      GLN  48  40.671   9.259  -2.049
  358   HE22  GLN  48          HE22      GLN  48  40.279   9.025  -3.721
  359    H    TYR  49           H        TYR  49  47.077   9.467  -0.541
  360    HA   TYR  49           HA       TYR  49  47.488  11.918   0.941
  361    HD1  TYR  49           HD2      TYR  49  44.036  10.957   0.969
  362    HD2  TYR  49           HD1      TYR  49  46.535  12.594   3.999
  363    HE1  TYR  49           HE2      TYR  49  42.376  12.724   1.374
  364    HE2  TYR  49           HE1      TYR  49  44.881  14.367   4.413
  365    HH   TYR  49           HH       TYR  49  41.726  14.325   2.914
  366    HB2  TYR  49           HB2      TYR  49  45.878   9.645   2.001
  367    HB3  TYR  49           HB3      TYR  49  47.001  10.433   3.108
  368    H    SER  50           H        SER  50  49.156  10.212  -0.648
  369    HA   SER  50           HA       SER  50  50.794   8.726   1.237
  370    HG   SER  50           HG       SER  50  49.320   7.875  -1.238
  371    HB2  SER  50           HB2      SER  50  51.915   9.003  -1.431
  372    HB3  SER  50           HB3      SER  50  51.457   7.545  -0.553
  373    H    LYS  51           H        LYS  51  50.614  11.618   1.534
  374    HA   LYS  51           HA       LYS  51  53.019  12.366   2.382
  375    HB2  LYS  51           HB2      LYS  51  53.105  12.209  -0.531
  376    HB3  LYS  51           HB3      LYS  51  53.594  13.785   0.075
  377    HG2  LYS  51           HG2      LYS  51  54.784  11.558   1.536
  378    HG3  LYS  51           HG3      LYS  51  55.220  11.606  -0.173
  379    HD2  LYS  51           HD2      LYS  51  55.626  14.148   0.316
  380    HD3  LYS  51           HD3      LYS  51  55.763  13.594   1.987
  381    HE2  LYS  51           HE2      LYS  51  57.303  11.787   0.593
  382    HE3  LYS  51           HE3      LYS  51  57.619  13.308  -0.241
  383    HZ1  LYS  51           HZ1      LYS  51  59.134  13.534   1.390
  384    HZ2  LYS  51           HZ2      LYS  51  58.337  12.483   2.450
  385    HZ3  LYS  51           HZ3      LYS  51  57.814  14.084   2.296
  386    H    HIS  52           H        HIS  52  50.455  13.076   2.923
  387    HA   HIS  52           HA       HIS  52  50.184  15.855   2.018
  388    HD1  HIS  52           HD1      HIS  52  47.518  14.084   0.162
  389    HD2  HIS  52           HD2      HIS  52  47.426  17.595   2.382
  390    HE1  HIS  52           HE1      HIS  52  46.327  15.796  -1.266
  391    HB2  HIS  52           HB2      HIS  52  48.300  13.771   2.557
  392    HB3  HIS  52           HB3      HIS  52  47.998  15.099   3.672
  Start of MODEL   21
    1    H1   GLY   1           1H       GLY   1  29.167 -18.740   1.486
    2    H2   GLY   1           2H       GLY   1  30.297 -17.728   2.235
    3    H3   GLY   1           3H       GLY   1  29.597 -17.270   0.765
    4    HA2  GLY   1           HA2      GLY   1  27.376 -17.406   2.013
    5    HA3  GLY   1           HA3      GLY   1  28.380 -17.339   3.452
    6    H    SER   2           H        SER   2  30.150 -15.528   3.238
    7    HA   SER   2           HA       SER   2  28.701 -13.083   2.488
    8    HG   SER   2           HG       SER   2  28.748 -13.931   5.280
    9    HB2  SER   2           HB2      SER   2  31.116 -12.841   4.171
   10    HB3  SER   2           HB3      SER   2  29.541 -12.065   4.335
   11    HA   PRO   3           HA       PRO   3  32.063 -12.823  -0.518
   12    HB2  PRO   3           HB2      PRO   3  30.549 -12.099  -2.599
   13    HB3  PRO   3           HB3      PRO   3  30.548 -13.761  -2.005
   14    HG2  PRO   3           HG2      PRO   3  28.477 -11.669  -1.745
   15    HG3  PRO   3           HG3      PRO   3  28.307 -13.431  -1.724
   16    HD2  PRO   3           HD2      PRO   3  28.433 -11.632   0.514
   17    HD3  PRO   3           HD3      PRO   3  28.253 -13.392   0.538
   18    HA   PRO   4           HA       PRO   4  32.882  -8.479  -0.670
   19    HB2  PRO   4           HB2      PRO   4  33.230  -8.513  -3.593
   20    HB3  PRO   4           HB3      PRO   4  34.418  -8.187  -2.329
   21    HG2  PRO   4           HG2      PRO   4  34.471 -10.455  -3.772
   22    HG3  PRO   4           HG3      PRO   4  34.947 -10.417  -2.064
   23    HD2  PRO   4           HD2      PRO   4  32.386 -11.353  -3.300
   24    HD3  PRO   4           HD3      PRO   4  33.317 -12.062  -1.963
   25    H    GLU   5           H        GLU   5  30.252  -8.744  -0.487
   26    HA   GLU   5           HA       GLU   5  29.229  -6.726  -2.344
   27    HB2  GLU   5           HB2      GLU   5  27.806  -9.307  -1.669
   28    HB3  GLU   5           HB3      GLU   5  27.106  -7.973  -2.577
   29    HG2  GLU   5           HG2      GLU   5  29.505  -8.587  -3.872
   30    HG3  GLU   5           HG3      GLU   5  28.758 -10.136  -3.484
   31    H    ALA   6           H        ALA   6  30.042  -6.041   0.077
   32    HA   ALA   6           HA       ALA   6  29.107  -4.540   1.610
   33    HB1  ALA   6           HB1      ALA   6  26.613  -6.156   1.866
   34    HB2  ALA   6           HB2      ALA   6  26.825  -5.074   0.489
   35    HB3  ALA   6           HB3      ALA   6  26.872  -4.432   2.131
   36    H    ASP   7           H        ASP   7  30.885  -6.440   2.171
   37    HA   ASP   7           HA       ASP   7  29.918  -7.849   4.554
   38    HB2  ASP   7           HB2      ASP   7  32.061  -8.321   2.605
   39    HB3  ASP   7           HB3      ASP   7  32.585  -8.509   4.276
   40    HA   PRO   8           HA       PRO   8  31.456  -5.210   7.723
   41    HB2  PRO   8           HB2      PRO   8  33.637  -7.263   7.974
   42    HB3  PRO   8           HB3      PRO   8  32.742  -6.425   9.248
   43    HG2  PRO   8           HG2      PRO   8  32.111  -8.934   8.447
   44    HG3  PRO   8           HG3      PRO   8  30.898  -7.787   9.037
   45    HD2  PRO   8           HD2      PRO   8  31.275  -8.842   6.342
   46    HD3  PRO   8           HD3      PRO   8  29.909  -7.917   6.995
   47    H    ARG   9           H        ARG   9  34.194  -6.780   6.058
   48    HA   ARG   9           HA       ARG   9  35.923  -4.599   6.151
   49    HE   ARG   9           HE       ARG   9  37.405 -10.179   4.958
   50    HB2  ARG   9           HB2      ARG   9  35.794  -6.836   4.123
   51    HB3  ARG   9           HB3      ARG   9  37.173  -5.765   4.375
   52    HG2  ARG   9           HG2      ARG   9  37.352  -6.602   6.694
   53    HG3  ARG   9           HG3      ARG   9  36.046  -7.738   6.352
   54    HD2  ARG   9           HD2      ARG   9  37.887  -8.069   4.274
   55    HD3  ARG   9           HD3      ARG   9  38.857  -7.930   5.740
   56   HH11  ARG   9          HH11      ARG   9  37.877  -8.208   7.791
   57   HH12  ARG   9          HH12      ARG   9  37.562  -9.500   8.900
   58   HH21  ARG   9          HH21      ARG   9  36.991 -11.887   6.408
   59   HH22  ARG   9          HH22      ARG   9  37.059 -11.594   8.114
   60    H    LEU  10           H        LEU  10  33.877  -5.679   3.431
   61    HA   LEU  10           HA       LEU  10  34.577  -3.446   1.831
   62    HG   LEU  10           HG       LEU  10  33.796  -6.906   1.063
   63    HB2  LEU  10           HB2      LEU  10  32.247  -5.330   1.495
   64    HB3  LEU  10           HB3      LEU  10  32.879  -4.244   0.272
   65   HD11  LEU  10          HD11      LEU  10  33.097  -6.629  -1.147
   66   HD12  LEU  10          HD12      LEU  10  34.857  -6.662  -1.247
   67   HD13  LEU  10          HD13      LEU  10  33.997  -5.125  -1.341
   68   HD21  LEU  10          HD21      LEU  10  35.782  -4.653   0.818
   69   HD22  LEU  10          HD22      LEU  10  36.203  -6.337   0.507
   70   HD23  LEU  10          HD23      LEU  10  35.640  -5.851   2.105
   71    H    ILE  11           H        ILE  11  32.201  -3.988   4.228
   72    HA   ILE  11           HA       ILE  11  30.619  -1.683   3.425
   73    HB   ILE  11           HB       ILE  11  29.782  -3.879   4.650
   74   HG12  ILE  11          HG12      ILE  11  28.146  -2.344   4.039
   75   HG13  ILE  11          HG13      ILE  11  27.989  -2.378   5.792
   76   HG21  ILE  11          HG21      ILE  11  31.414  -2.971   6.620
   77   HG22  ILE  11          HG22      ILE  11  30.047  -4.057   6.869
   78   HG23  ILE  11          HG23      ILE  11  29.857  -2.324   7.133
   79   HD11  ILE  11          HD11      ILE  11  29.235  -0.324   5.978
   80   HD12  ILE  11          HD12      ILE  11  27.884  -0.111   4.866
   81   HD13  ILE  11          HD13      ILE  11  29.521  -0.309   4.238
   82    H    GLU  12           H        GLU  12  33.319  -2.480   5.220
   83    HA   GLU  12           HA       GLU  12  33.286  -0.039   6.835
   84    HB2  GLU  12           HB2      GLU  12  33.920  -1.912   8.130
   85    HB3  GLU  12           HB3      GLU  12  35.003  -2.510   6.883
   86    HG2  GLU  12           HG2      GLU  12  36.685  -1.102   7.465
   87    HG3  GLU  12           HG3      GLU  12  35.587   0.151   8.042
   88    H    SER  13           H        SER  13  35.605  -1.781   4.761
   89    HA   SER  13           HA       SER  13  37.016   0.707   4.249
   90    HG   SER  13           HG       SER  13  37.776  -2.898   4.748
   91    HB2  SER  13           HB2      SER  13  38.599  -0.952   3.018
   92    HB3  SER  13           HB3      SER  13  38.546  -0.945   4.781
   93    H    LEU  14           H        LEU  14  35.098  -1.677   2.377
   94    HA   LEU  14           HA       LEU  14  35.893  -0.498  -0.118
   95    HG   LEU  14           HG       LEU  14  34.503  -1.052  -2.052
   96    HB2  LEU  14           HB2      LEU  14  34.901  -2.861   0.223
   97    HB3  LEU  14           HB3      LEU  14  33.347  -2.055   0.204
   98   HD11  LEU  14          HD11      LEU  14  35.854  -3.547  -1.368
   99   HD12  LEU  14          HD12      LEU  14  36.296  -2.297  -2.531
  100   HD13  LEU  14          HD13      LEU  14  35.134  -3.546  -2.978
  101   HD21  LEU  14          HD21      LEU  14  33.054  -3.640  -2.257
  102   HD22  LEU  14          HD22      LEU  14  32.811  -2.132  -3.138
  103   HD23  LEU  14          HD23      LEU  14  32.238  -2.284  -1.477
  104    H    SER  15           H        SER  15  32.676  -0.503   1.501
  105    HA   SER  15           HA       SER  15  31.488   1.495   0.085
  106    HG   SER  15           HG       SER  15  29.473   0.704   0.896
  107    HB2  SER  15           HB2      SER  15  31.372   0.774   3.005
  108    HB3  SER  15           HB3      SER  15  30.461   2.155   2.396
  109    H    GLN  16           H        GLN  16  33.345   1.962   3.075
  110    HA   GLN  16           HA       GLN  16  33.561   4.673   3.163
  111    HB2  GLN  16           HB2      GLN  16  34.565   3.158   4.836
  112    HB3  GLN  16           HB3      GLN  16  35.810   2.710   3.678
  113    HG2  GLN  16           HG2      GLN  16  35.373   5.501   4.698
  114    HG3  GLN  16           HG3      GLN  16  36.537   4.363   5.376
  115   HE21  GLN  16          HE21      GLN  16  36.767   7.005   3.927
  116   HE22  GLN  16          HE22      GLN  16  37.926   6.703   2.681
  117    H    MET  17           H        MET  17  35.213   2.429   1.047
  118    HA   MET  17           HA       MET  17  37.076   4.217  -0.089
  119    HB2  MET  17           HB2      MET  17  36.676   1.555  -0.302
  120    HB3  MET  17           HB3      MET  17  35.942   2.082  -1.810
  121    HG2  MET  17           HG2      MET  17  38.242   1.497  -2.183
  122    HG3  MET  17           HG3      MET  17  38.025   3.232  -2.405
  123    HE1  MET  17           HE1      MET  17  41.034   3.102  -2.109
  124    HE2  MET  17           HE2      MET  17  41.134   4.274  -0.794
  125    HE3  MET  17           HE3      MET  17  39.900   4.452  -2.040
  126    H    LEU  18           H        LEU  18  33.727   3.395  -0.840
  127    HA   LEU  18           HA       LEU  18  33.711   5.278  -3.082
  128    HG   LEU  18           HG       LEU  18  32.022   2.365  -4.337
  129    HB2  LEU  18           HB2      LEU  18  31.434   3.597  -2.036
  130    HB3  LEU  18           HB3      LEU  18  31.513   4.428  -3.577
  131   HD11  LEU  18          HD11      LEU  18  34.099   3.809  -4.532
  132   HD12  LEU  18          HD12      LEU  18  34.325   2.068  -4.703
  133   HD13  LEU  18          HD13      LEU  18  34.750   2.868  -3.190
  134   HD21  LEU  18          HD21      LEU  18  33.635   1.206  -2.241
  135   HD22  LEU  18          HD22      LEU  18  32.147   0.613  -2.980
  136   HD23  LEU  18          HD23      LEU  18  32.071   1.752  -1.637
  137    H    SER  19           H        SER  19  31.673   4.643  -0.225
  138    HA   SER  19           HA       SER  19  30.212   6.965  -0.175
  139    HG   SER  19           HG       SER  19  29.054   4.462   1.348
  140    HB2  SER  19           HB2      SER  19  31.020   4.963   1.853
  141    HB3  SER  19           HB3      SER  19  30.424   6.503   2.472
  142    H    MET  20           H        MET  20  33.561   6.767   0.270
  143    HA   MET  20           HA       MET  20  33.688   9.194   1.890
  144    HB2  MET  20           HB2      MET  20  35.270   7.375   2.404
  145    HB3  MET  20           HB3      MET  20  35.928   7.493   0.777
  146    HG2  MET  20           HG2      MET  20  37.187   8.626   2.697
  147    HG3  MET  20           HG3      MET  20  36.951   9.527   1.201
  148    HE1  MET  20           HE1      MET  20  35.663   8.700   4.624
  149    HE2  MET  20           HE2      MET  20  34.025   9.143   4.144
  150    HE3  MET  20           HE3      MET  20  34.934  10.182   5.241
  151    H    GLY  21           H        GLY  21  34.007   8.053  -1.355
  152    HA2  GLY  21           HA2      GLY  21  33.625   9.570  -3.180
  153    HA3  GLY  21           HA3      GLY  21  34.427  10.827  -2.244
  154    H    PHE  22           H        PHE  22  35.767   7.577  -2.485
  155    HA   PHE  22           HA       PHE  22  37.706   8.522  -4.457
  156    HD1  PHE  22           HD2      PHE  22  38.704  10.290  -3.794
  157    HD2  PHE  22           HD1      PHE  22  38.981   8.355  -0.015
  158    HE1  PHE  22           HE2      PHE  22  39.030  12.472  -2.706
  159    HE2  PHE  22           HE1      PHE  22  39.300  10.535   1.079
  160    HZ   PHE  22           HZ       PHE  22  39.328  12.597  -0.267
  161    HB2  PHE  22           HB2      PHE  22  38.427   7.114  -1.875
  162    HB3  PHE  22           HB3      PHE  22  39.551   7.587  -3.150
  163    H    SER  23           H        SER  23  39.271   6.363  -4.707
  164    HA   SER  23           HA       SER  23  37.790   3.936  -4.649
  165    HG   SER  23           HG       SER  23  36.009   5.202  -7.438
  166    HB2  SER  23           HB2      SER  23  38.212   5.328  -7.302
  167    HB3  SER  23           HB3      SER  23  37.786   3.624  -7.150
  168    H    ASP  24           H        ASP  24  39.643   3.722  -7.392
  169    HA   ASP  24           HA       ASP  24  42.052   2.982  -5.868
  170    HB2  ASP  24           HB2      ASP  24  42.444   1.215  -7.497
  171    HB3  ASP  24           HB3      ASP  24  40.824   1.039  -6.824
  172    H    GLU  25           H        GLU  25  43.715   4.321  -6.292
  173    HA   GLU  25           HA       GLU  25  43.779   6.331  -8.132
  174    HB2  GLU  25           HB2      GLU  25  45.480   6.118  -6.396
  175    HB3  GLU  25           HB3      GLU  25  46.150   4.710  -7.211
  176    HG2  GLU  25           HG2      GLU  25  46.449   6.332  -9.212
  177    HG3  GLU  25           HG3      GLU  25  46.285   7.589  -7.988
  178    H    GLY  26           H        GLY  26  45.469   3.283  -8.597
  179    HA2  GLY  26           HA2      GLY  26  44.859   3.466 -11.476
  180    HA3  GLY  26           HA3      GLY  26  46.486   3.082 -10.917
  181    H    GLY  27           H        GLY  27  43.499   1.937  -9.453
  182    HA2  GLY  27           HA2      GLY  27  42.503  -0.160  -9.507
  183    HA3  GLY  27           HA3      GLY  27  43.679  -0.656 -10.717
  184    H    TRP  28           H        TRP  28  44.362   0.738  -7.576
  185    HA   TRP  28           HA       TRP  28  45.892  -1.666  -6.936
  186    HD1  TRP  28           HD1      TRP  28  46.632   2.921  -6.888
  187    HE1  TRP  28           HE1      TRP  28  45.444   4.591  -5.331
  188    HE3  TRP  28           HE3      TRP  28  44.873  -0.324  -3.373
  189    HZ2  TRP  28           HZ2      TRP  28  43.968   4.532  -2.942
  190    HZ3  TRP  28           HZ3      TRP  28  43.581   0.559  -1.479
  191    HH2  TRP  28           HH2      TRP  28  43.133   2.949  -1.281
  192    HB2  TRP  28           HB2      TRP  28  47.029  -0.324  -5.231
  193    HB3  TRP  28           HB3      TRP  28  47.143   0.413  -6.828
  194    H    LEU  29           H        LEU  29  43.173   0.234  -5.742
  195    HA   LEU  29           HA       LEU  29  42.908  -0.651  -3.176
  196    HG   LEU  29           HG       LEU  29  40.038  -1.995  -4.540
  197    HB2  LEU  29           HB2      LEU  29  41.048   0.518  -3.387
  198    HB3  LEU  29           HB3      LEU  29  41.159   0.450  -5.131
  199   HD11  LEU  29          HD11      LEU  29  38.913  -2.009  -2.632
  200   HD12  LEU  29          HD12      LEU  29  38.247  -0.405  -2.938
  201   HD13  LEU  29          HD13      LEU  29  39.828  -0.572  -2.172
  202   HD21  LEU  29          HD21      LEU  29  37.848  -0.612  -5.020
  203   HD22  LEU  29          HD22      LEU  29  39.063  -0.881  -6.270
  204   HD23  LEU  29          HD23      LEU  29  39.016   0.653  -5.399
  205    H    THR  30           H        THR  30  41.482  -2.417  -5.941
  206    HA   THR  30           HA       THR  30  40.699  -4.689  -4.650
  207    HB   THR  30           HB       THR  30  40.898  -5.870  -6.721
  208    HG1  THR  30           HG1      THR  30  42.967  -5.543  -7.344
  209   HG21  THR  30          HG21      THR  30  39.922  -3.176  -6.725
  210   HG22  THR  30          HG22      THR  30  39.314  -4.594  -7.580
  211   HG23  THR  30          HG23      THR  30  40.575  -3.598  -8.308
  212    H    ARG  31           H        ARG  31  43.912  -3.584  -5.235
  213    HA   ARG  31           HA       ARG  31  45.119  -6.117  -4.421
  214    HE   ARG  31           HE       ARG  31  47.478  -5.686  -8.289
  215    HB2  ARG  31           HB2      ARG  31  46.774  -3.706  -4.955
  216    HB3  ARG  31           HB3      ARG  31  47.069  -5.383  -5.379
  217    HG2  ARG  31           HG2      ARG  31  44.978  -3.706  -6.734
  218    HG3  ARG  31           HG3      ARG  31  46.646  -3.812  -7.295
  219    HD2  ARG  31           HD2      ARG  31  45.035  -6.290  -6.823
  220    HD3  ARG  31           HD3      ARG  31  44.864  -5.382  -8.326
  221   HH11  ARG  31          HH11      ARG  31  45.005  -8.017  -7.496
  222   HH12  ARG  31          HH12      ARG  31  45.962  -9.380  -7.968
  223   HH21  ARG  31          HH21      ARG  31  48.738  -7.480  -8.913
  224   HH22  ARG  31          HH22      ARG  31  48.081  -9.076  -8.771
  225    H    LEU  32           H        LEU  32  45.722  -2.709  -3.588
  226    HA   LEU  32           HA       LEU  32  47.124  -2.944  -1.290
  227    HG   LEU  32           HG       LEU  32  46.384   0.671  -0.644
  228    HB2  LEU  32           HB2      LEU  32  46.404  -0.849  -2.478
  229    HB3  LEU  32           HB3      LEU  32  44.861  -0.985  -1.654
  230   HD11  LEU  32          HD11      LEU  32  45.498   0.298   1.364
  231   HD12  LEU  32          HD12      LEU  32  46.217  -1.308   1.500
  232   HD13  LEU  32          HD13      LEU  32  44.723  -1.083   0.588
  233   HD21  LEU  32          HD21      LEU  32  48.133  -1.728  -0.360
  234   HD22  LEU  32          HD22      LEU  32  48.218  -0.428   0.824
  235   HD23  LEU  32          HD23      LEU  32  48.537  -0.092  -0.877
  236    H    LEU  33           H        LEU  33  43.637  -2.300  -1.101
  237    HA   LEU  33           HA       LEU  33  43.195  -2.878   1.525
  238    HG   LEU  33           HG       LEU  33  41.267  -1.641   1.740
  239    HB2  LEU  33           HB2      LEU  33  41.546  -3.008  -0.928
  240    HB3  LEU  33           HB3      LEU  33  40.907  -3.844   0.479
  241   HD11  LEU  33          HD11      LEU  33  42.426  -0.121   0.573
  242   HD12  LEU  33          HD12      LEU  33  40.892   0.196  -0.236
  243   HD13  LEU  33          HD13      LEU  33  42.067  -0.891  -0.973
  244   HD21  LEU  33          HD21      LEU  33  39.191  -0.687   0.290
  245   HD22  LEU  33          HD22      LEU  33  39.053  -1.957   1.506
  246   HD23  LEU  33          HD23      LEU  33  39.188  -2.380  -0.201
  247    H    GLN  34           H        GLN  34  42.449  -5.222  -1.026
  248    HA   GLN  34           HA       GLN  34  41.914  -7.458   0.327
  249    HB2  GLN  34           HB2      GLN  34  42.651  -6.832  -2.254
  250    HB3  GLN  34           HB3      GLN  34  43.815  -8.065  -1.786
  251    HG2  GLN  34           HG2      GLN  34  42.204  -9.442  -2.548
  252    HG3  GLN  34           HG3      GLN  34  41.581  -9.238  -0.912
  253   HE21  GLN  34          HE21      GLN  34  40.341  -6.943  -0.852
  254   HE22  GLN  34          HE22      GLN  34  39.080  -6.845  -2.029
  255    H    THR  35           H        THR  35  45.077  -6.003   0.197
  256    HA   THR  35           HA       THR  35  46.359  -8.372   1.319
  257    HB   THR  35           HB       THR  35  48.414  -7.230   1.110
  258    HG1  THR  35           HG1      THR  35  48.498  -4.962   0.801
  259   HG21  THR  35          HG21      THR  35  48.379  -7.299  -1.094
  260   HG22  THR  35          HG22      THR  35  47.653  -5.691  -1.119
  261   HG23  THR  35          HG23      THR  35  46.624  -7.123  -1.098
  262    H    LYS  36           H        LYS  36  46.324  -4.988   2.322
  263    HA   LYS  36           HA       LYS  36  46.827  -5.564   5.046
  264    HB2  LYS  36           HB2      LYS  36  45.903  -3.079   3.629
  265    HB3  LYS  36           HB3      LYS  36  46.117  -3.124   5.373
  266    HG2  LYS  36           HG2      LYS  36  48.159  -2.343   4.764
  267    HG3  LYS  36           HG3      LYS  36  48.488  -4.076   4.704
  268    HD2  LYS  36           HD2      LYS  36  48.766  -4.061   2.476
  269    HD3  LYS  36           HD3      LYS  36  47.397  -2.978   2.220
  270    HE2  LYS  36           HE2      LYS  36  50.154  -2.163   3.134
  271    HE3  LYS  36           HE3      LYS  36  49.498  -1.947   1.511
  272    HZ1  LYS  36           HZ1      LYS  36  47.634  -0.699   2.840
  273    HZ2  LYS  36           HZ2      LYS  36  49.067   0.086   2.409
  274    HZ3  LYS  36           HZ3      LYS  36  48.869  -0.502   3.981
  275    H    ASN  37           H        ASN  37  44.501  -7.068   4.219
  276    HA   ASN  37           HA       ASN  37  42.407  -7.610   4.843
  277    HB2  ASN  37           HB2      ASN  37  41.868  -7.353   7.180
  278    HB3  ASN  37           HB3      ASN  37  43.585  -7.726   7.039
  279   HD21  ASN  37          HD21      ASN  37  45.097  -6.169   7.552
  280   HD22  ASN  37          HD22      ASN  37  44.691  -4.725   8.410
  281    H    TYR  38           H        TYR  38  42.037  -5.857   3.071
  282    HA   TYR  38           HA       TYR  38  40.967  -3.944   2.339
  283    HD1  TYR  38           HD2      TYR  38  40.266  -7.195   3.980
  284    HD2  TYR  38           HD1      TYR  38  37.965  -5.354   0.912
  285    HE1  TYR  38           HE2      TYR  38  40.119  -9.351   2.808
  286    HE2  TYR  38           HE1      TYR  38  37.812  -7.504  -0.271
  287    HH   TYR  38           HH       TYR  38  38.809  -9.608  -0.406
  288    HB2  TYR  38           HB2      TYR  38  38.848  -4.933   4.251
  289    HB3  TYR  38           HB3      TYR  38  38.611  -4.085   2.725
  290    H    ASP  39           H        ASP  39  42.570  -2.672   3.569
  291    HA   ASP  39           HA       ASP  39  41.317  -1.220   5.810
  292    HB2  ASP  39           HB2      ASP  39  44.061  -2.144   5.300
  293    HB3  ASP  39           HB3      ASP  39  43.952  -0.483   5.887
  294    H    ILE  40           H        ILE  40  40.781   0.840   5.541
  295    HA   ILE  40           HA       ILE  40  41.371   2.159   3.051
  296    HB   ILE  40           HB       ILE  40  39.976   3.986   3.933
  297   HG12  ILE  40          HG12      ILE  40  40.724   3.165   6.401
  298   HG13  ILE  40          HG13      ILE  40  39.318   4.176   6.100
  299   HG21  ILE  40          HG21      ILE  40  38.958   1.178   3.936
  300   HG22  ILE  40          HG22      ILE  40  38.711   2.460   2.751
  301   HG23  ILE  40          HG23      ILE  40  37.867   2.517   4.298
  302   HD11  ILE  40          HD11      ILE  40  37.836   2.426   6.421
  303   HD12  ILE  40          HD12      ILE  40  39.082   2.125   7.633
  304   HD13  ILE  40          HD13      ILE  40  39.067   1.197   6.134
  305    H    GLY  41           H        GLY  41  42.461   2.075   6.298
  306    HA2  GLY  41           HA2      GLY  41  43.563   4.442   6.838
  307    HA3  GLY  41           HA3      GLY  41  44.393   2.950   7.206
  308    H    ALA  42           H        ALA  42  45.050   2.020   4.801
  309    HA   ALA  42           HA       ALA  42  47.043   3.957   3.906
  310    HB1  ALA  42           HB1      ALA  42  48.065   1.934   4.512
  311    HB2  ALA  42           HB2      ALA  42  48.025   1.913   2.748
  312    HB3  ALA  42           HB3      ALA  42  46.850   0.974   3.668
  313    H    ALA  43           H        ALA  43  44.118   2.559   2.929
  314    HA   ALA  43           HA       ALA  43  44.376   2.463   0.153
  315    HB1  ALA  43           HB1      ALA  43  42.458   1.619   1.616
  316    HB2  ALA  43           HB2      ALA  43  42.031   2.340   0.065
  317    HB3  ALA  43           HB3      ALA  43  41.841   3.270   1.551
  318    H    LEU  44           H        LEU  44  43.530   5.100   2.332
  319    HA   LEU  44           HA       LEU  44  43.105   6.994   0.204
  320    HG   LEU  44           HG       LEU  44  40.968   8.035   1.409
  321    HB2  LEU  44           HB2      LEU  44  43.239   7.198   3.201
  322    HB3  LEU  44           HB3      LEU  44  43.129   8.628   2.185
  323   HD11  LEU  44          HD11      LEU  44  39.880   5.917   1.957
  324   HD12  LEU  44          HD12      LEU  44  41.349   5.369   2.764
  325   HD13  LEU  44          HD13      LEU  44  41.355   5.664   1.025
  326   HD21  LEU  44          HD21      LEU  44  40.194   7.157   3.992
  327   HD22  LEU  44          HD22      LEU  44  40.096   8.778   3.306
  328   HD23  LEU  44          HD23      LEU  44  41.544   8.277   4.180
  329    H    ASP  45           H        ASP  45  45.555   6.558   2.751
  330    HA   ASP  45           HA       ASP  45  47.263   8.596   2.313
  331    HB2  ASP  45           HB2      ASP  45  47.661   6.844   3.979
  332    HB3  ASP  45           HB3      ASP  45  48.069   5.707   2.698
  333    H    THR  46           H        THR  46  46.653   5.953   0.154
  334    HA   THR  46           HA       THR  46  48.871   6.709  -1.582
  335    HB   THR  46           HB       THR  46  48.431   4.669  -2.787
  336    HG1  THR  46           HG1      THR  46  46.318   4.343  -2.873
  337   HG21  THR  46          HG21      THR  46  48.101   3.109  -0.580
  338   HG22  THR  46          HG22      THR  46  48.741   4.601   0.111
  339   HG23  THR  46          HG23      THR  46  49.638   3.758  -1.152
  340    H    ILE  47           H        ILE  47  45.375   6.894  -1.449
  341    HA   ILE  47           HA       ILE  47  45.399   8.083  -4.152
  342    HB   ILE  47           HB       ILE  47  44.192   5.945  -4.038
  343   HG12  ILE  47          HG12      ILE  47  42.736   8.490  -4.659
  344   HG13  ILE  47          HG13      ILE  47  43.403   7.291  -5.766
  345   HG21  ILE  47          HG21      ILE  47  42.453   5.499  -2.613
  346   HG22  ILE  47          HG22      ILE  47  42.002   7.197  -2.467
  347   HG23  ILE  47          HG23      ILE  47  43.404   6.584  -1.595
  348   HD11  ILE  47          HD11      ILE  47  41.497   5.901  -4.322
  349   HD12  ILE  47          HD12      ILE  47  41.340   6.513  -5.972
  350   HD13  ILE  47          HD13      ILE  47  40.768   7.481  -4.613
  351    H    GLN  48           H        GLN  48  45.768  10.177  -3.241
  352    HA   GLN  48           HA       GLN  48  44.991  12.277  -2.762
  353    HB2  GLN  48           HB2      GLN  48  42.263  11.019  -2.424
  354    HB3  GLN  48           HB3      GLN  48  42.620  12.725  -2.668
  355    HG2  GLN  48           HG2      GLN  48  42.909  12.490  -4.892
  356    HG3  GLN  48           HG3      GLN  48  43.598  10.875  -4.743
  357   HE21  GLN  48          HE21      GLN  48  41.668   9.515  -3.426
  358   HE22  GLN  48          HE22      GLN  48  40.231   9.433  -4.391
  359    H    TYR  49           H        TYR  49  46.329  11.318  -0.899
  360    HA   TYR  49           HA       TYR  49  45.584  12.441   1.477
  361    HD1  TYR  49           HD1      TYR  49  44.750  12.752   3.341
  362    HD2  TYR  49           HD2      TYR  49  42.016  10.006   1.590
  363    HE1  TYR  49           HE1      TYR  49  42.877  13.993   4.336
  364    HE2  TYR  49           HE2      TYR  49  40.136  11.237   2.580
  365    HH   TYR  49           HH       TYR  49  40.152  13.034   4.949
  366    HB2  TYR  49           HB2      TYR  49  44.262   9.863   1.037
  367    HB3  TYR  49           HB3      TYR  49  45.134   9.947   2.565
  368    H    SER  50           H        SER  50  47.188  12.315   2.966
  369    HA   SER  50           HA       SER  50  49.128  10.160   2.884
  370    HG   SER  50           HG       SER  50  49.993  13.635   3.063
  371    HB2  SER  50           HB2      SER  50  51.061  11.667   2.486
  372    HB3  SER  50           HB3      SER  50  49.972  11.583   1.101
  373    H    LYS  51           H        LYS  51  47.267  11.474   4.813
  374    HA   LYS  51           HA       LYS  51  49.258  12.198   6.863
  375    HB2  LYS  51           HB2      LYS  51  47.121  13.725   5.982
  376    HB3  LYS  51           HB3      LYS  51  46.516  12.990   7.461
  377    HG2  LYS  51           HG2      LYS  51  47.569  14.563   8.605
  378    HG3  LYS  51           HG3      LYS  51  49.101  13.875   8.062
  379    HD2  LYS  51           HD2      LYS  51  49.331  16.034   7.325
  380    HD3  LYS  51           HD3      LYS  51  48.597  15.289   5.903
  381    HE2  LYS  51           HE2      LYS  51  46.632  16.386   6.177
  382    HE3  LYS  51           HE3      LYS  51  46.740  16.359   7.936
  383    HZ1  LYS  51           HZ1      LYS  51  46.986  18.586   6.707
  384    HZ2  LYS  51           HZ2      LYS  51  48.556  18.061   6.359
  385    HZ3  LYS  51           HZ3      LYS  51  48.060  18.236   7.967
  386    H    HIS  52           H        HIS  52  49.363   9.791   7.063
  387    HA   HIS  52           HA       HIS  52  47.306   8.152   7.877
  388    HD1  HIS  52           HD1      HIS  52  51.171   5.903   7.127
  389    HD2  HIS  52           HD2      HIS  52  47.037   6.304   7.022
  390    HE1  HIS  52           HE1      HIS  52  50.326   4.130   5.533
  391    HB2  HIS  52           HB2      HIS  52  50.235   8.144   8.154
  392    HB3  HIS  52           HB3      HIS  52  49.389   7.204   9.379
  Start of MODEL   22
    1    H1   GLY   1           1H       GLY   1  29.297 -15.820   5.907
    2    H2   GLY   1           2H       GLY   1  28.030 -16.131   6.983
    3    H3   GLY   1           3H       GLY   1  29.624 -16.480   7.429
    4    HA2  GLY   1           HA2      GLY   1  28.305 -14.232   8.096
    5    HA3  GLY   1           HA3      GLY   1  30.053 -14.408   8.080
    6    H    SER   2           H        SER   2  31.007 -14.121   5.772
    7    HA   SER   2           HA       SER   2  29.831 -11.657   4.680
    8    HG   SER   2           HG       SER   2  32.658 -13.701   4.488
    9    HB2  SER   2           HB2      SER   2  32.215 -11.433   3.671
   10    HB3  SER   2           HB3      SER   2  31.997 -11.121   5.393
   11    HA   PRO   3           HA       PRO   3  29.095 -14.483   1.210
   12    HB2  PRO   3           HB2      PRO   3  26.867 -13.297   0.319
   13    HB3  PRO   3           HB3      PRO   3  26.853 -14.315   1.766
   14    HG2  PRO   3           HG2      PRO   3  26.892 -11.333   1.548
   15    HG3  PRO   3           HG3      PRO   3  25.967 -12.362   2.655
   16    HD2  PRO   3           HD2      PRO   3  28.314 -11.076   3.317
   17    HD3  PRO   3           HD3      PRO   3  27.702 -12.526   4.131
   18    HA   PRO   4           HA       PRO   4  31.110 -12.074  -1.911
   19    HB2  PRO   4           HB2      PRO   4  30.274 -13.482  -4.112
   20    HB3  PRO   4           HB3      PRO   4  31.583 -14.003  -3.046
   21    HG2  PRO   4           HG2      PRO   4  28.721 -14.868  -3.098
   22    HG3  PRO   4           HG3      PRO   4  30.184 -15.846  -2.871
   23    HD2  PRO   4           HD2      PRO   4  28.618 -15.121  -0.804
   24    HD3  PRO   4           HD3      PRO   4  30.381 -15.260  -0.642
   25    H    GLU   5           H        GLU   5  29.588 -10.291  -1.379
   26    HA   GLU   5           HA       GLU   5  28.537  -9.063  -3.573
   27    HB2  GLU   5           HB2      GLU   5  26.062  -9.341  -3.258
   28    HB3  GLU   5           HB3      GLU   5  26.889 -10.764  -3.872
   29    HG2  GLU   5           HG2      GLU   5  26.445 -11.986  -2.032
   30    HG3  GLU   5           HG3      GLU   5  26.596 -10.604  -0.945
   31    H    ALA   6           H        ALA   6  29.890  -8.083  -1.538
   32    HA   ALA   6           HA       ALA   6  29.776  -5.983  -0.508
   33    HB1  ALA   6           HB1      ALA   6  26.908  -6.507   0.216
   34    HB2  ALA   6           HB2      ALA   6  27.383  -5.764  -1.311
   35    HB3  ALA   6           HB3      ALA   6  27.782  -4.974   0.215
   36    H    ASP   7           H        ASP   7  31.207  -7.357   0.727
   37    HA   ASP   7           HA       ASP   7  30.082  -8.260   3.285
   38    HB2  ASP   7           HB2      ASP   7  32.164  -9.538   3.554
   39    HB3  ASP   7           HB3      ASP   7  31.344  -9.959   2.056
   40    HA   PRO   8           HA       PRO   8  31.666  -5.167   5.959
   41    HB2  PRO   8           HB2      PRO   8  33.698  -7.254   6.696
   42    HB3  PRO   8           HB3      PRO   8  32.806  -6.147   7.748
   43    HG2  PRO   8           HG2      PRO   8  32.051  -8.721   7.387
   44    HG3  PRO   8           HG3      PRO   8  30.891  -7.418   7.690
   45    HD2  PRO   8           HD2      PRO   8  31.317  -8.974   5.257
   46    HD3  PRO   8           HD3      PRO   8  29.983  -7.877   5.661
   47    H    ARG   9           H        ARG   9  34.287  -7.170   4.585
   48    HA   ARG   9           HA       ARG   9  36.293  -5.310   4.503
   49    HE   ARG   9           HE       ARG   9  39.091  -9.875   2.922
   50    HB2  ARG   9           HB2      ARG   9  35.628  -7.468   2.495
   51    HB3  ARG   9           HB3      ARG   9  37.155  -6.594   2.540
   52    HG2  ARG   9           HG2      ARG   9  37.801  -7.575   4.554
   53    HG3  ARG   9           HG3      ARG   9  36.155  -8.086   4.934
   54    HD2  ARG   9           HD2      ARG   9  36.471 -10.034   3.915
   55    HD3  ARG   9           HD3      ARG   9  36.971  -9.223   2.432
   56   HH11  ARG   9          HH11      ARG   9  37.343  -9.539   5.916
   57   HH12  ARG   9          HH12      ARG   9  38.668 -10.066   6.900
   58   HH21  ARG   9          HH21      ARG   9  40.845 -10.563   4.211
   59   HH22  ARG   9          HH22      ARG   9  40.657 -10.647   5.931
   60    H    LEU  10           H        LEU  10  33.848  -5.889   1.990
   61    HA   LEU  10           HA       LEU  10  34.763  -3.513   0.575
   62    HG   LEU  10           HG       LEU  10  34.310  -7.003  -0.258
   63    HB2  LEU  10           HB2      LEU  10  32.654  -5.414  -0.387
   64    HB3  LEU  10           HB3      LEU  10  33.638  -4.310  -1.331
   65   HD11  LEU  10          HD11      LEU  10  34.398  -7.425  -2.425
   66   HD12  LEU  10          HD12      LEU  10  35.732  -6.284  -2.590
   67   HD13  LEU  10          HD13      LEU  10  34.069  -5.730  -2.787
   68   HD21  LEU  10          HD21      LEU  10  36.748  -5.845  -1.037
   69   HD22  LEU  10          HD22      LEU  10  36.296  -6.445   0.557
   70   HD23  LEU  10          HD23      LEU  10  36.039  -4.753   0.147
   71    H    ILE  11           H        ILE  11  32.138  -4.476   2.597
   72    HA   ILE  11           HA       ILE  11  30.573  -2.184   1.669
   73    HB   ILE  11           HB       ILE  11  29.326  -4.282   1.970
   74   HG12  ILE  11          HG12      ILE  11  28.498  -2.334   4.122
   75   HG13  ILE  11          HG13      ILE  11  28.329  -1.973   2.407
   76   HG21  ILE  11          HG21      ILE  11  29.612  -5.619   3.721
   77   HG22  ILE  11          HG22      ILE  11  29.238  -4.315   4.848
   78   HG23  ILE  11          HG23      ILE  11  30.890  -4.534   4.269
   79   HD11  ILE  11          HD11      ILE  11  26.275  -2.818   2.739
   80   HD12  ILE  11          HD12      ILE  11  26.777  -3.788   4.125
   81   HD13  ILE  11          HD13      ILE  11  27.105  -4.353   2.486
   82    H    GLU  12           H        GLU  12  32.486  -3.312   4.241
   83    HA   GLU  12           HA       GLU  12  31.758  -1.064   5.980
   84    HB2  GLU  12           HB2      GLU  12  32.315  -3.601   6.660
   85    HB3  GLU  12           HB3      GLU  12  33.929  -2.919   6.785
   86    HG2  GLU  12           HG2      GLU  12  33.404  -2.235   8.818
   87    HG3  GLU  12           HG3      GLU  12  32.268  -1.102   8.088
   88    H    SER  13           H        SER  13  34.820  -2.525   4.857
   89    HA   SER  13           HA       SER  13  36.251  -0.105   5.357
   90    HG   SER  13           HG       SER  13  36.646  -3.023   6.109
   91    HB2  SER  13           HB2      SER  13  37.127  -2.633   3.956
   92    HB3  SER  13           HB3      SER  13  38.193  -1.322   4.452
   93    H    LEU  14           H        LEU  14  35.208  -1.766   2.343
   94    HA   LEU  14           HA       LEU  14  36.528   0.186   0.716
   95    HG   LEU  14           HG       LEU  14  36.410  -0.026  -1.544
   96    HB2  LEU  14           HB2      LEU  14  35.899  -2.202   0.060
   97    HB3  LEU  14           HB3      LEU  14  34.296  -1.567  -0.246
   98   HD11  LEU  14          HD11      LEU  14  36.713  -2.821  -1.590
   99   HD12  LEU  14          HD12      LEU  14  37.545  -1.622  -2.579
  100   HD13  LEU  14          HD13      LEU  14  36.051  -2.358  -3.158
  101   HD21  LEU  14          HD21      LEU  14  33.665  -0.864  -1.966
  102   HD22  LEU  14          HD22      LEU  14  34.640  -1.008  -3.428
  103   HD23  LEU  14          HD23      LEU  14  34.527   0.540  -2.592
  104    H    SER  15           H        SER  15  33.030  -0.393   1.318
  105    HA   SER  15           HA       SER  15  31.921   1.667  -0.026
  106    HG   SER  15           HG       SER  15  29.257   1.979   1.967
  107    HB2  SER  15           HB2      SER  15  30.940   0.002   1.812
  108    HB3  SER  15           HB3      SER  15  31.088   1.432   2.834
  109    H    GLN  16           H        GLN  16  33.079   2.011   3.320
  110    HA   GLN  16           HA       GLN  16  32.840   4.663   3.711
  111    HB2  GLN  16           HB2      GLN  16  34.227   4.417   5.486
  112    HB3  GLN  16           HB3      GLN  16  34.099   2.714   5.081
  113    HG2  GLN  16           HG2      GLN  16  36.381   3.141   5.451
  114    HG3  GLN  16           HG3      GLN  16  36.187   2.998   3.706
  115   HE21  GLN  16          HE21      GLN  16  37.227   4.451   2.578
  116   HE22  GLN  16          HE22      GLN  16  37.632   6.054   3.074
  117    H    MET  17           H        MET  17  35.074   3.135   1.516
  118    HA   MET  17           HA       MET  17  36.507   5.626   1.030
  119    HB2  MET  17           HB2      MET  17  37.754   3.489   1.097
  120    HB3  MET  17           HB3      MET  17  36.828   2.920  -0.286
  121    HG2  MET  17           HG2      MET  17  37.743   5.126  -1.384
  122    HG3  MET  17           HG3      MET  17  38.990   4.953  -0.151
  123    HE1  MET  17           HE1      MET  17  38.698   3.056  -4.112
  124    HE2  MET  17           HE2      MET  17  37.627   4.226  -3.340
  125    HE3  MET  17           HE3      MET  17  37.314   2.499  -3.170
  126    H    LEU  18           H        LEU  18  33.911   3.790  -0.272
  127    HA   LEU  18           HA       LEU  18  34.037   4.987  -2.899
  128    HG   LEU  18           HG       LEU  18  31.133   4.793  -3.415
  129    HB2  LEU  18           HB2      LEU  18  33.215   2.772  -2.812
  130    HB3  LEU  18           HB3      LEU  18  32.092   3.157  -1.522
  131   HD11  LEU  18          HD11      LEU  18  31.363   2.686  -5.306
  132   HD12  LEU  18          HD12      LEU  18  32.988   3.166  -4.812
  133   HD13  LEU  18          HD13      LEU  18  31.872   4.367  -5.462
  134   HD21  LEU  18          HD21      LEU  18  29.685   3.320  -2.315
  135   HD22  LEU  18          HD22      LEU  18  30.559   1.897  -2.881
  136   HD23  LEU  18          HD23      LEU  18  29.588   2.842  -4.010
  137    H    SER  19           H        SER  19  31.341   4.927  -0.555
  138    HA   SER  19           HA       SER  19  30.128   7.232  -1.657
  139    HG   SER  19           HG       SER  19  28.972   7.400   1.541
  140    HB2  SER  19           HB2      SER  19  28.596   5.770  -0.731
  141    HB3  SER  19           HB3      SER  19  29.589   5.467   0.695
  142    H    MET  20           H        MET  20  32.887   7.377  -0.080
  143    HA   MET  20           HA       MET  20  32.109   9.676   1.593
  144    HB2  MET  20           HB2      MET  20  34.493   7.852   1.687
  145    HB3  MET  20           HB3      MET  20  34.526   9.428   2.457
  146    HG2  MET  20           HG2      MET  20  32.314   8.598   3.575
  147    HG3  MET  20           HG3      MET  20  32.953   7.006   3.174
  148    HE1  MET  20           HE1      MET  20  32.209   8.382   5.983
  149    HE2  MET  20           HE2      MET  20  33.064   9.911   5.786
  150    HE3  MET  20           HE3      MET  20  33.588   8.758   7.015
  151    H    GLY  21           H        GLY  21  33.738   8.689  -1.233
  152    HA2  GLY  21           HA2      GLY  21  34.187  10.315  -2.951
  153    HA3  GLY  21           HA3      GLY  21  34.606  11.469  -1.687
  154    H    PHE  22           H        PHE  22  35.620   8.095  -2.215
  155    HA   PHE  22           HA       PHE  22  38.363   9.040  -2.623
  156    HD1  PHE  22           HD2      PHE  22  39.153  10.138  -1.256
  157    HD2  PHE  22           HD1      PHE  22  37.686   7.367   1.621
  158    HE1  PHE  22           HE2      PHE  22  39.477  11.812   0.516
  159    HE2  PHE  22           HE1      PHE  22  38.005   9.038   3.398
  160    HZ   PHE  22           HZ       PHE  22  38.902  11.265   2.847
  161    HB2  PHE  22           HB2      PHE  22  37.478   6.898  -0.673
  162    HB3  PHE  22           HB3      PHE  22  39.149   7.121  -1.187
  163    H    SER  23           H        SER  23  39.545   7.770  -4.044
  164    HA   SER  23           HA       SER  23  38.228   5.383  -5.064
  165    HG   SER  23           HG       SER  23  37.038   8.086  -7.084
  166    HB2  SER  23           HB2      SER  23  39.120   7.677  -6.830
  167    HB3  SER  23           HB3      SER  23  38.550   6.112  -7.412
  168    H    ASP  24           H        ASP  24  39.765   4.440  -6.913
  169    HA   ASP  24           HA       ASP  24  42.392   4.229  -5.648
  170    HB2  ASP  24           HB2      ASP  24  42.658   2.186  -6.882
  171    HB3  ASP  24           HB3      ASP  24  41.038   2.191  -6.180
  172    H    GLU  25           H        GLU  25  43.959   5.466  -6.370
  173    HA   GLU  25           HA       GLU  25  44.181   7.261  -8.247
  174    HB2  GLU  25           HB2      GLU  25  46.143   6.788  -6.990
  175    HB3  GLU  25           HB3      GLU  25  46.275   5.178  -7.685
  176    HG2  GLU  25           HG2      GLU  25  46.469   7.618  -9.404
  177    HG3  GLU  25           HG3      GLU  25  47.864   7.018  -8.508
  178    H    GLY  26           H        GLY  26  44.424   3.858  -8.995
  179    HA2  GLY  26           HA2      GLY  26  43.479   4.366 -11.680
  180    HA3  GLY  26           HA3      GLY  26  45.139   3.793 -11.584
  181    H    GLY  27           H        GLY  27  45.078   1.886  -9.647
  182    HA2  GLY  27           HA2      GLY  27  42.877   0.106  -9.800
  183    HA3  GLY  27           HA3      GLY  27  44.105  -0.355 -10.971
  184    H    TRP  28           H        TRP  28  44.691   1.135  -7.891
  185    HA   TRP  28           HA       TRP  28  46.273  -1.205  -7.112
  186    HD1  TRP  28           HD1      TRP  28  46.996   3.361  -7.268
  187    HE1  TRP  28           HE1      TRP  28  45.676   5.111  -5.925
  188    HE3  TRP  28           HE3      TRP  28  45.015   0.352  -3.676
  189    HZ2  TRP  28           HZ2      TRP  28  44.001   5.211  -3.678
  190    HZ3  TRP  28           HZ3      TRP  28  43.565   1.335  -1.957
  191    HH2  TRP  28           HH2      TRP  28  43.064   3.717  -1.956
  192    HB2  TRP  28           HB2      TRP  28  47.288   0.244  -5.381
  193    HB3  TRP  28           HB3      TRP  28  47.507   0.875  -7.011
  194    H    LEU  29           H        LEU  29  43.485   0.677  -6.116
  195    HA   LEU  29           HA       LEU  29  43.098  -0.068  -3.527
  196    HG   LEU  29           HG       LEU  29  40.230  -1.466  -4.306
  197    HB2  LEU  29           HB2      LEU  29  41.422   1.286  -4.265
  198    HB3  LEU  29           HB3      LEU  29  41.244   0.433  -5.784
  199   HD11  LEU  29          HD11      LEU  29  40.932   0.197  -2.288
  200   HD12  LEU  29          HD12      LEU  29  39.654  -1.016  -2.182
  201   HD13  LEU  29          HD13      LEU  29  39.250   0.665  -2.538
  202   HD21  LEU  29          HD21      LEU  29  38.362  -0.809  -5.313
  203   HD22  LEU  29          HD22      LEU  29  39.167   0.702  -5.737
  204   HD23  LEU  29          HD23      LEU  29  38.230   0.591  -4.246
  205    H    THR  30           H        THR  30  41.809  -1.979  -6.256
  206    HA   THR  30           HA       THR  30  40.972  -4.192  -4.903
  207    HB   THR  30           HB       THR  30  41.202  -5.438  -6.905
  208    HG1  THR  30           HG1      THR  30  43.058  -5.388  -7.846
  209   HG21  THR  30          HG21      THR  30  39.887  -4.184  -8.160
  210   HG22  THR  30          HG22      THR  30  41.186  -3.036  -8.482
  211   HG23  THR  30          HG23      THR  30  40.187  -2.854  -7.040
  212    H    ARG  31           H        ARG  31  44.204  -3.109  -5.384
  213    HA   ARG  31           HA       ARG  31  45.372  -5.599  -4.378
  214    HE   ARG  31           HE       ARG  31  45.611  -7.591  -7.804
  215    HB2  ARG  31           HB2      ARG  31  46.423  -3.190  -5.779
  216    HB3  ARG  31           HB3      ARG  31  47.521  -4.054  -4.712
  217    HG2  ARG  31           HG2      ARG  31  47.549  -4.695  -7.160
  218    HG3  ARG  31           HG3      ARG  31  47.405  -6.012  -5.995
  219    HD2  ARG  31           HD2      ARG  31  44.941  -5.965  -6.347
  220    HD3  ARG  31           HD3      ARG  31  45.189  -4.767  -7.617
  221   HH11  ARG  31          HH11      ARG  31  46.637  -4.495  -9.025
  222   HH12  ARG  31          HH12      ARG  31  47.183  -5.128 -10.542
  223   HH21  ARG  31          HH21      ARG  31  46.325  -8.435  -9.800
  224   HH22  ARG  31          HH22      ARG  31  47.006  -7.369 -10.983
  225    H    LEU  32           H        LEU  32  45.900  -2.141  -3.715
  226    HA   LEU  32           HA       LEU  32  47.211  -2.072  -1.407
  227    HG   LEU  32           HG       LEU  32  45.598   1.316  -0.712
  228    HB2  LEU  32           HB2      LEU  32  46.375  -0.084  -2.476
  229    HB3  LEU  32           HB3      LEU  32  44.719  -0.528  -2.102
  230   HD11  LEU  32          HD11      LEU  32  44.377   0.689   1.080
  231   HD12  LEU  32          HD12      LEU  32  45.161  -0.887   1.208
  232   HD13  LEU  32          HD13      LEU  32  43.916  -0.615  -0.013
  233   HD21  LEU  32          HD21      LEU  32  47.926   0.294  -0.624
  234   HD22  LEU  32          HD22      LEU  32  47.302  -0.720   0.678
  235   HD23  LEU  32          HD23      LEU  32  47.306   1.035   0.849
  236    H    LEU  33           H        LEU  33  43.670  -2.357  -1.438
  237    HA   LEU  33           HA       LEU  33  43.424  -2.847   1.326
  238    HG   LEU  33           HG       LEU  33  41.481  -1.996   1.884
  239    HB2  LEU  33           HB2      LEU  33  41.711  -2.688  -1.009
  240    HB3  LEU  33           HB3      LEU  33  41.171  -3.932   0.102
  241   HD11  LEU  33          HD11      LEU  33  41.527  -0.640  -0.732
  242   HD12  LEU  33          HD12      LEU  33  42.175  -0.133   0.827
  243   HD13  LEU  33          HD13      LEU  33  40.455   0.052   0.484
  244   HD21  LEU  33          HD21      LEU  33  39.350  -2.676   1.942
  245   HD22  LEU  33          HD22      LEU  33  39.266  -2.885   0.194
  246   HD23  LEU  33          HD23      LEU  33  39.033  -1.287   0.903
  247    H    GLN  34           H        GLN  34  43.128  -5.081  -1.430
  248    HA   GLN  34           HA       GLN  34  42.551  -7.442  -0.316
  249    HB2  GLN  34           HB2      GLN  34  43.713  -6.625  -2.691
  250    HB3  GLN  34           HB3      GLN  34  44.839  -7.810  -2.056
  251    HG2  GLN  34           HG2      GLN  34  43.535  -9.326  -3.022
  252    HG3  GLN  34           HG3      GLN  34  42.428  -9.042  -1.677
  253   HE21  GLN  34          HE21      GLN  34  41.344  -6.644  -2.261
  254   HE22  GLN  34          HE22      GLN  34  40.463  -6.718  -3.746
  255    H    THR  35           H        THR  35  45.519  -5.749   0.304
  256    HA   THR  35           HA       THR  35  46.826  -8.105   1.404
  257    HB   THR  35           HB       THR  35  47.689  -5.213   1.622
  258    HG1  THR  35           HG1      THR  35  47.854  -7.046  -0.452
  259   HG21  THR  35          HG21      THR  35  48.744  -7.325   2.945
  260   HG22  THR  35          HG22      THR  35  49.643  -5.883   2.466
  261   HG23  THR  35          HG23      THR  35  49.697  -7.331   1.460
  262    H    LYS  36           H        LYS  36  46.184  -4.930   2.809
  263    HA   LYS  36           HA       LYS  36  46.189  -5.862   5.481
  264    HB2  LYS  36           HB2      LYS  36  45.034  -3.286   4.408
  265    HB3  LYS  36           HB3      LYS  36  45.440  -3.619   6.086
  266    HG2  LYS  36           HG2      LYS  36  47.407  -2.687   5.653
  267    HG3  LYS  36           HG3      LYS  36  47.787  -4.154   4.748
  268    HD2  LYS  36           HD2      LYS  36  46.836  -3.096   2.720
  269    HD3  LYS  36           HD3      LYS  36  46.590  -1.614   3.645
  270    HE2  LYS  36           HE2      LYS  36  48.761  -2.011   2.175
  271    HE3  LYS  36           HE3      LYS  36  48.807  -1.106   3.687
  272    HZ1  LYS  36           HZ1      LYS  36  49.490  -3.149   4.820
  273    HZ2  LYS  36           HZ2      LYS  36  50.589  -2.710   3.610
  274    HZ3  LYS  36           HZ3      LYS  36  49.498  -3.975   3.343
  275    H    ASN  37           H        ASN  37  44.319  -7.474   4.070
  276    HA   ASN  37           HA       ASN  37  42.188  -8.265   4.122
  277    HB2  ASN  37           HB2      ASN  37  41.229  -7.350   6.607
  278    HB3  ASN  37           HB3      ASN  37  41.967  -8.913   6.255
  279   HD21  ASN  37          HD21      ASN  37  42.285  -5.934   7.852
  280   HD22  ASN  37          HD22      ASN  37  43.872  -6.173   8.489
  281    H    TYR  38           H        TYR  38  42.291  -6.045   2.662
  282    HA   TYR  38           HA       TYR  38  41.051  -4.363   1.779
  283    HD1  TYR  38           HD2      TYR  38  38.828  -4.890  -0.144
  284    HD2  TYR  38           HD1      TYR  38  39.431  -7.921   2.779
  285    HE1  TYR  38           HE2      TYR  38  38.655  -6.607  -1.897
  286    HE2  TYR  38           HE1      TYR  38  39.260  -9.646   1.035
  287    HH   TYR  38           HH       TYR  38  39.564  -9.081  -2.146
  288    HB2  TYR  38           HB2      TYR  38  38.891  -5.661   3.439
  289    HB3  TYR  38           HB3      TYR  38  38.597  -4.407   2.238
  290    H    ASP  39           H        ASP  39  42.637  -3.325   3.447
  291    HA   ASP  39           HA       ASP  39  41.276  -2.000   5.627
  292    HB2  ASP  39           HB2      ASP  39  43.658  -2.956   5.679
  293    HB3  ASP  39           HB3      ASP  39  44.121  -1.506   4.788
  294    H    ILE  40           H        ILE  40  41.172   0.163   5.927
  295    HA   ILE  40           HA       ILE  40  40.941   1.771   3.491
  296    HB   ILE  40           HB       ILE  40  40.021   3.469   5.320
  297   HG12  ILE  40          HG12      ILE  40  40.553   1.498   7.034
  298   HG13  ILE  40          HG13      ILE  40  39.182   2.578   7.254
  299   HG21  ILE  40          HG21      ILE  40  38.433   3.123   3.784
  300   HG22  ILE  40          HG22      ILE  40  37.764   1.988   4.957
  301   HG23  ILE  40          HG23      ILE  40  38.797   1.401   3.654
  302   HD11  ILE  40          HD11      ILE  40  39.028  -0.106   7.343
  303   HD12  ILE  40          HD12      ILE  40  38.643   0.181   5.646
  304   HD13  ILE  40          HD13      ILE  40  37.682   0.948   6.909
  305    H    GLY  41           H        GLY  41  42.516   1.582   6.586
  306    HA2  GLY  41           HA2      GLY  41  43.791   3.926   6.887
  307    HA3  GLY  41           HA3      GLY  41  44.522   2.399   7.308
  308    H    ALA  42           H        ALA  42  44.605   1.416   4.640
  309    HA   ALA  42           HA       ALA  42  46.947   2.880   3.725
  310    HB1  ALA  42           HB1      ALA  42  47.695   0.954   2.767
  311    HB2  ALA  42           HB2      ALA  42  46.074   0.416   2.333
  312    HB3  ALA  42           HB3      ALA  42  46.641   0.247   3.992
  313    H    ALA  43           H        ALA  43  43.717   2.074   2.840
  314    HA   ALA  43           HA       ALA  43  43.725   2.828   0.132
  315    HB1  ALA  43           HB1      ALA  43  41.463   2.577   0.208
  316    HB2  ALA  43           HB2      ALA  43  41.309   3.437   1.739
  317    HB3  ALA  43           HB3      ALA  43  41.857   1.761   1.720
  318    H    LEU  44           H        LEU  44  42.560   4.701   2.936
  319    HA   LEU  44           HA       LEU  44  42.492   7.159   1.544
  320    HG   LEU  44           HG       LEU  44  42.517   7.203   5.758
  321    HB2  LEU  44           HB2      LEU  44  42.258   8.185   3.783
  322    HB3  LEU  44           HB3      LEU  44  41.107   6.907   3.467
  323   HD11  LEU  44          HD11      LEU  44  40.697   5.830   5.842
  324   HD12  LEU  44          HD12      LEU  44  42.004   4.655   5.981
  325   HD13  LEU  44          HD13      LEU  44  41.195   4.895   4.433
  326   HD21  LEU  44          HD21      LEU  44  44.176   5.400   5.851
  327   HD22  LEU  44          HD22      LEU  44  44.655   6.685   4.748
  328   HD23  LEU  44          HD23      LEU  44  44.015   5.169   4.112
  329    H    ASP  45           H        ASP  45  45.059   5.343   2.541
  330    HA   ASP  45           HA       ASP  45  46.826   7.509   3.283
  331    HB2  ASP  45           HB2      ASP  45  47.206   5.462   4.432
  332    HB3  ASP  45           HB3      ASP  45  47.248   4.547   2.929
  333    H    THR  46           H        THR  46  46.390   5.334   0.519
  334    HA   THR  46           HA       THR  46  48.503   6.744  -0.928
  335    HB   THR  46           HB       THR  46  48.383   4.966  -2.553
  336    HG1  THR  46           HG1      THR  46  46.233   4.523  -2.663
  337   HG21  THR  46          HG21      THR  46  48.510   4.183   0.305
  338   HG22  THR  46          HG22      THR  46  49.751   4.123  -0.947
  339   HG23  THR  46          HG23      THR  46  48.467   2.914  -0.919
  340    H    ILE  47           H        ILE  47  45.059   6.632  -0.776
  341    HA   ILE  47           HA       ILE  47  44.527   7.383  -3.459
  342    HB   ILE  47           HB       ILE  47  42.297   7.920  -2.787
  343   HG12  ILE  47          HG12      ILE  47  43.317   7.785   0.054
  344   HG13  ILE  47          HG13      ILE  47  42.816   9.243  -0.792
  345   HG21  ILE  47          HG21      ILE  47  42.160   5.686  -2.850
  346   HG22  ILE  47          HG22      ILE  47  42.053   5.803  -1.093
  347   HG23  ILE  47          HG23      ILE  47  43.605   5.486  -1.862
  348   HD11  ILE  47          HD11      ILE  47  41.043   6.915  -0.095
  349   HD12  ILE  47          HD12      ILE  47  40.541   8.378  -0.940
  350   HD13  ILE  47          HD13      ILE  47  41.092   8.472   0.732
  351    H    GLN  48           H        GLN  48  45.079   9.267  -0.530
  352    HA   GLN  48           HA       GLN  48  45.759  11.576  -2.131
  353    HB2  GLN  48           HB2      GLN  48  43.428  11.659  -0.203
  354    HB3  GLN  48           HB3      GLN  48  44.204  13.084  -0.875
  355    HG2  GLN  48           HG2      GLN  48  42.646  12.978  -2.450
  356    HG3  GLN  48           HG3      GLN  48  43.583  11.646  -3.117
  357   HE21  GLN  48          HE21      GLN  48  42.435   9.904  -3.543
  358   HE22  GLN  48          HE22      GLN  48  41.008   9.387  -2.703
  359    H    TYR  49           H        TYR  49  44.823  10.710   1.172
  360    HA   TYR  49           HA       TYR  49  46.798  12.377   2.388
  361    HD1  TYR  49           HD1      TYR  49  43.200  11.107   2.071
  362    HD2  TYR  49           HD2      TYR  49  45.148  13.450   5.040
  363    HE1  TYR  49           HE1      TYR  49  41.316  12.683   2.053
  364    HE2  TYR  49           HE2      TYR  49  43.267  15.035   5.031
  365    HH   TYR  49           HH       TYR  49  40.370  14.446   3.976
  366    HB2  TYR  49           HB2      TYR  49  45.046  10.193   3.527
  367    HB3  TYR  49           HB3      TYR  49  46.002  11.313   4.485
  368    H    SER  50           H        SER  50  48.703  11.412   1.202
  369    HA   SER  50           HA       SER  50  49.559   8.871   2.398
  370    HG   SER  50           HG       SER  50  51.833  10.121  -0.574
  371    HB2  SER  50           HB2      SER  50  50.969   8.541   0.536
  372    HB3  SER  50           HB3      SER  50  49.491   9.211  -0.155
  373    H    LYS  51           H        LYS  51  49.628  11.172   3.978
  374    HA   LYS  51           HA       LYS  51  52.244  11.117   4.974
  375    HB2  LYS  51           HB2      LYS  51  52.134  12.708   2.735
  376    HB3  LYS  51           HB3      LYS  51  51.891  13.872   4.030
  377    HG2  LYS  51           HG2      LYS  51  54.117  13.943   4.124
  378    HG3  LYS  51           HG3      LYS  51  53.986  12.406   4.981
  379    HD2  LYS  51           HD2      LYS  51  54.035  11.329   2.652
  380    HD3  LYS  51           HD3      LYS  51  54.610  12.898   2.086
  381    HE2  LYS  51           HE2      LYS  51  55.923  10.994   4.001
  382    HE3  LYS  51           HE3      LYS  51  56.557  11.648   2.491
  383    HZ1  LYS  51           HZ1      LYS  51  55.953  13.376   4.817
  384    HZ2  LYS  51           HZ2      LYS  51  56.916  13.729   3.471
  385    HZ3  LYS  51           HZ3      LYS  51  57.457  12.621   4.628
  386    H    HIS  52           H        HIS  52  50.405  10.708   6.557
  387    HA   HIS  52           HA       HIS  52  49.886  13.214   7.986
  388    HD1  HIS  52           HD1      HIS  52  46.028  12.904   9.392
  389    HD2  HIS  52           HD2      HIS  52  48.271  14.822   6.471
  390    HE1  HIS  52           HE1      HIS  52  45.221  15.299   9.338
  391    HB2  HIS  52           HB2      HIS  52  47.891  11.783   6.629
  392    HB3  HIS  52           HB3      HIS  52  47.678  11.379   8.329
  Start of MODEL   23
    1    H1   GLY   1           1H       GLY   1  30.391 -16.776   4.856
    2    H2   GLY   1           2H       GLY   1  30.052 -17.836   6.130
    3    H3   GLY   1           3H       GLY   1  30.618 -16.275   6.456
    4    HA2  GLY   1           HA2      GLY   1  27.983 -17.033   5.325
    5    HA3  GLY   1           HA3      GLY   1  28.288 -16.304   6.894
    6    H    SER   2           H        SER   2  30.432 -14.883   4.875
    7    HA   SER   2           HA       SER   2  28.892 -12.453   4.746
    8    HG   SER   2           HG       SER   2  30.142 -10.979   5.228
    9    HB2  SER   2           HB2      SER   2  31.680 -13.207   4.568
   10    HB3  SER   2           HB3      SER   2  31.249 -12.098   3.267
   11    HA   PRO   3           HA       PRO   3  27.590 -13.485   0.572
   12    HB2  PRO   3           HB2      PRO   3  25.360 -12.021   0.565
   13    HB3  PRO   3           HB3      PRO   3  25.471 -13.507   1.516
   14    HG2  PRO   3           HG2      PRO   3  25.601 -10.672   2.411
   15    HG3  PRO   3           HG3      PRO   3  24.920 -12.082   3.237
   16    HD2  PRO   3           HD2      PRO   3  27.455 -10.935   3.685
   17    HD3  PRO   3           HD3      PRO   3  26.886 -12.503   4.284
   18    HA   PRO   4           HA       PRO   4  29.417 -10.051  -1.569
   19    HB2  PRO   4           HB2      PRO   4  28.389 -10.584  -4.055
   20    HB3  PRO   4           HB3      PRO   4  29.780 -11.425  -3.361
   21    HG2  PRO   4           HG2      PRO   4  26.915 -12.281  -3.486
   22    HG3  PRO   4           HG3      PRO   4  28.384 -13.238  -3.758
   23    HD2  PRO   4           HD2      PRO   4  27.015 -13.358  -1.443
   24    HD3  PRO   4           HD3      PRO   4  28.784 -13.497  -1.495
   25    H    GLU   5           H        GLU   5  27.814  -8.756  -0.210
   26    HA   GLU   5           HA       GLU   5  26.398  -6.986  -1.937
   27    HB2  GLU   5           HB2      GLU   5  24.852  -9.063  -1.487
   28    HB3  GLU   5           HB3      GLU   5  24.590  -8.281   0.066
   29    HG2  GLU   5           HG2      GLU   5  24.055  -6.187  -1.368
   30    HG3  GLU   5           HG3      GLU   5  23.832  -7.358  -2.667
   31    H    ALA   6           H        ALA   6  28.467  -6.636  -0.157
   32    HA   ALA   6           HA       ALA   6  28.939  -4.735   1.146
   33    HB1  ALA   6           HB1      ALA   6  26.411  -4.995   2.700
   34    HB2  ALA   6           HB2      ALA   6  26.360  -4.271   1.092
   35    HB3  ALA   6           HB3      ALA   6  27.378  -3.563   2.346
   36    H    ASP   7           H        ASP   7  30.402  -6.443   1.729
   37    HA   ASP   7           HA       ASP   7  29.792  -7.762   4.277
   38    HB2  ASP   7           HB2      ASP   7  31.874  -8.342   2.163
   39    HB3  ASP   7           HB3      ASP   7  31.809  -9.165   3.719
   40    HA   PRO   8           HA       PRO   8  32.501  -5.352   6.763
   41    HB2  PRO   8           HB2      PRO   8  34.138  -7.369   7.808
   42    HB3  PRO   8           HB3      PRO   8  32.610  -6.807   8.488
   43    HG2  PRO   8           HG2      PRO   8  33.159  -9.174   6.758
   44    HG3  PRO   8           HG3      PRO   8  32.017  -9.004   8.104
   45    HD2  PRO   8           HD2      PRO   8  31.176  -8.978   5.568
   46    HD3  PRO   8           HD3      PRO   8  30.438  -7.915   6.785
   47    H    ARG   9           H        ARG   9  33.612  -7.001   4.076
   48    HA   ARG   9           HA       ARG   9  36.395  -6.193   4.368
   49    HE   ARG   9           HE       ARG   9  36.982  -9.700   0.734
   50    HB2  ARG   9           HB2      ARG   9  35.034  -7.664   2.101
   51    HB3  ARG   9           HB3      ARG   9  36.768  -7.410   2.281
   52    HG2  ARG   9           HG2      ARG   9  36.631  -8.695   4.432
   53    HG3  ARG   9           HG3      ARG   9  34.972  -9.106   3.990
   54    HD2  ARG   9           HD2      ARG   9  37.526 -10.089   2.902
   55    HD3  ARG   9           HD3      ARG   9  35.969 -10.901   3.053
   56   HH11  ARG   9          HH11      ARG   9  34.027  -9.874   2.572
   57   HH12  ARG   9          HH12      ARG   9  33.005  -9.637   1.194
   58   HH21  ARG   9          HH21      ARG   9  35.644  -9.385  -1.084
   59   HH22  ARG   9          HH22      ARG   9  33.925  -9.356  -0.883
   60    H    LEU  10           H        LEU  10  33.770  -5.825   1.986
   61    HA   LEU  10           HA       LEU  10  35.038  -3.396   0.964
   62    HG   LEU  10           HG       LEU  10  34.130  -6.138  -1.470
   63    HB2  LEU  10           HB2      LEU  10  32.742  -5.047  -0.095
   64    HB3  LEU  10           HB3      LEU  10  33.343  -3.586  -0.854
   65   HD11  LEU  10          HD11      LEU  10  35.067  -3.411  -2.014
   66   HD12  LEU  10          HD12      LEU  10  34.634  -4.710  -3.125
   67   HD13  LEU  10          HD13      LEU  10  36.226  -4.694  -2.365
   68   HD21  LEU  10          HD21      LEU  10  36.100  -4.963   0.469
   69   HD22  LEU  10          HD22      LEU  10  36.596  -6.083  -0.798
   70   HD23  LEU  10          HD23      LEU  10  35.430  -6.594   0.422
   71    H    ILE  11           H        ILE  11  32.663  -4.347   3.133
   72    HA   ILE  11           HA       ILE  11  30.951  -2.052   2.711
   73    HB   ILE  11           HB       ILE  11  30.202  -4.368   3.608
   74   HG12  ILE  11          HG12      ILE  11  29.333  -1.837   5.022
   75   HG13  ILE  11          HG13      ILE  11  28.745  -2.392   3.458
   76   HG21  ILE  11          HG21      ILE  11  30.661  -3.301   6.327
   77   HG22  ILE  11          HG22      ILE  11  32.054  -3.993   5.495
   78   HG23  ILE  11          HG23      ILE  11  30.607  -4.969   5.753
   79   HD11  ILE  11          HD11      ILE  11  27.482  -2.851   5.771
   80   HD12  ILE  11          HD12      ILE  11  28.480  -4.302   5.681
   81   HD13  ILE  11          HD13      ILE  11  27.366  -3.914   4.369
   82    H    GLU  12           H        GLU  12  33.617  -3.029   4.624
   83    HA   GLU  12           HA       GLU  12  33.466  -0.643   6.310
   84    HB2  GLU  12           HB2      GLU  12  33.983  -2.838   7.358
   85    HB3  GLU  12           HB3      GLU  12  35.448  -2.926   6.391
   86    HG2  GLU  12           HG2      GLU  12  34.999  -0.555   8.135
   87    HG3  GLU  12           HG3      GLU  12  35.519  -2.077   8.858
   88    H    SER  13           H        SER  13  35.995  -2.342   4.465
   89    HA   SER  13           HA       SER  13  37.628  -0.031   4.247
   90    HG   SER  13           HG       SER  13  39.452  -1.050   4.663
   91    HB2  SER  13           HB2      SER  13  37.966  -2.774   3.928
   92    HB3  SER  13           HB3      SER  13  38.260  -2.104   2.324
   93    H    LEU  14           H        LEU  14  35.515  -1.697   1.854
   94    HA   LEU  14           HA       LEU  14  36.372   0.096  -0.217
   95    HG   LEU  14           HG       LEU  14  34.884   0.075  -2.248
   96    HB2  LEU  14           HB2      LEU  14  35.489  -2.275  -0.553
   97    HB3  LEU  14           HB3      LEU  14  33.894  -1.579  -0.378
   98   HD11  LEU  14          HD11      LEU  14  36.845  -1.865  -2.114
   99   HD12  LEU  14          HD12      LEU  14  36.581  -0.729  -3.438
  100   HD13  LEU  14          HD13      LEU  14  35.869  -2.342  -3.504
  101   HD21  LEU  14          HD21      LEU  14  33.434  -2.536  -2.467
  102   HD22  LEU  14          HD22      LEU  14  33.781  -1.563  -3.897
  103   HD23  LEU  14          HD23      LEU  14  32.799  -0.896  -2.593
  104    H    SER  15           H        SER  15  33.154  -0.317   1.330
  105    HA   SER  15           HA       SER  15  31.804   1.782   0.273
  106    HG   SER  15           HG       SER  15  29.671   2.097   2.846
  107    HB2  SER  15           HB2      SER  15  30.712   0.486   1.965
  108    HB3  SER  15           HB3      SER  15  31.920   0.925   3.173
  109    H    GLN  16           H        GLN  16  33.910   2.029   3.085
  110    HA   GLN  16           HA       GLN  16  34.027   4.601   3.704
  111    HB2  GLN  16           HB2      GLN  16  35.539   2.776   4.567
  112    HB3  GLN  16           HB3      GLN  16  36.566   3.053   3.167
  113    HG2  GLN  16           HG2      GLN  16  35.940   5.003   5.365
  114    HG3  GLN  16           HG3      GLN  16  37.476   4.192   5.072
  115   HE21  GLN  16          HE21      GLN  16  37.887   4.473   2.462
  116   HE22  GLN  16          HE22      GLN  16  37.987   6.136   2.000
  117    H    MET  17           H        MET  17  35.432   3.255   0.737
  118    HA   MET  17           HA       MET  17  36.283   5.934  -0.082
  119    HB2  MET  17           HB2      MET  17  36.783   3.244  -1.374
  120    HB3  MET  17           HB3      MET  17  37.416   4.776  -1.952
  121    HG2  MET  17           HG2      MET  17  38.009   3.767   0.798
  122    HG3  MET  17           HG3      MET  17  38.966   3.294  -0.600
  123    HE1  MET  17           HE1      MET  17  40.404   4.120   1.464
  124    HE2  MET  17           HE2      MET  17  39.964   5.642   2.237
  125    HE3  MET  17           HE3      MET  17  41.351   5.573   1.151
  126    H    LEU  18           H        LEU  18  33.792   3.684  -0.544
  127    HA   LEU  18           HA       LEU  18  32.966   4.361  -3.169
  128    HG   LEU  18           HG       LEU  18  30.293   3.311  -3.457
  129    HB2  LEU  18           HB2      LEU  18  32.354   2.383  -1.473
  130    HB3  LEU  18           HB3      LEU  18  30.982   3.431  -1.169
  131   HD11  LEU  18          HD11      LEU  18  32.960   2.031  -3.855
  132   HD12  LEU  18          HD12      LEU  18  32.188   3.324  -4.773
  133   HD13  LEU  18          HD13      LEU  18  31.630   1.661  -4.953
  134   HD21  LEU  18          HD21      LEU  18  29.252   1.435  -2.898
  135   HD22  LEU  18          HD22      LEU  18  30.542   1.017  -1.771
  136   HD23  LEU  18          HD23      LEU  18  30.651   0.521  -3.459
  137    H    SER  19           H        SER  19  31.389   5.125  -0.055
  138    HA   SER  19           HA       SER  19  29.811   7.204  -1.260
  139    HG   SER  19           HG       SER  19  29.199   8.048   2.139
  140    HB2  SER  19           HB2      SER  19  28.496   6.915   0.528
  141    HB3  SER  19           HB3      SER  19  29.582   5.615   1.019
  142    H    MET  20           H        MET  20  32.923   7.293  -0.745
  143    HA   MET  20           HA       MET  20  32.923  10.007   0.401
  144    HB2  MET  20           HB2      MET  20  34.683   7.717   0.785
  145    HB3  MET  20           HB3      MET  20  35.564   9.173   0.351
  146    HG2  MET  20           HG2      MET  20  33.522   9.162   2.544
  147    HG3  MET  20           HG3      MET  20  35.196   8.691   2.827
  148    HE1  MET  20           HE1      MET  20  34.809  11.973   4.559
  149    HE2  MET  20           HE2      MET  20  33.794  10.542   4.383
  150    HE3  MET  20           HE3      MET  20  33.290  12.074   3.669
  151    H    GLY  21           H        GLY  21  33.397   8.149  -2.395
  152    HA2  GLY  21           HA2      GLY  21  33.651   9.019  -4.547
  153    HA3  GLY  21           HA3      GLY  21  34.241  10.525  -3.847
  154    H    PHE  22           H        PHE  22  35.424   7.258  -3.124
  155    HA   PHE  22           HA       PHE  22  37.891   7.877  -4.562
  156    HD1  PHE  22           HD2      PHE  22  38.837   9.686  -3.765
  157    HD2  PHE  22           HD1      PHE  22  37.808   8.119   0.055
  158    HE1  PHE  22           HE2      PHE  22  39.007  11.940  -2.798
  159    HE2  PHE  22           HE1      PHE  22  37.975  10.370   1.029
  160    HZ   PHE  22           HZ       PHE  22  38.574  12.286  -0.398
  161    HB2  PHE  22           HB2      PHE  22  37.762   6.728  -1.764
  162    HB3  PHE  22           HB3      PHE  22  39.222   7.024  -2.702
  163    H    SER  23           H        SER  23  38.764   6.167  -5.567
  164    HA   SER  23           HA       SER  23  37.738   3.519  -4.957
  165    HG   SER  23           HG       SER  23  35.715   5.184  -6.837
  166    HB2  SER  23           HB2      SER  23  37.634   4.816  -7.690
  167    HB3  SER  23           HB3      SER  23  37.438   3.083  -7.430
  168    H    ASP  24           H        ASP  24  39.226   3.311  -7.916
  169    HA   ASP  24           HA       ASP  24  41.787   2.700  -6.650
  170    HB2  ASP  24           HB2      ASP  24  41.643   2.121  -9.496
  171    HB3  ASP  24           HB3      ASP  24  41.981   1.034  -8.150
  172    H    GLU  25           H        GLU  25  43.298   4.239  -6.687
  173    HA   GLU  25           HA       GLU  25  43.072   6.423  -8.603
  174    HB2  GLU  25           HB2      GLU  25  43.594   6.690  -6.098
  175    HB3  GLU  25           HB3      GLU  25  45.217   6.158  -6.511
  176    HG2  GLU  25           HG2      GLU  25  45.566   8.031  -7.919
  177    HG3  GLU  25           HG3      GLU  25  43.865   8.489  -7.840
  178    H    GLY  26           H        GLY  26  43.879   3.717  -9.432
  179    HA2  GLY  26           HA2      GLY  26  45.464   3.969 -11.494
  180    HA3  GLY  26           HA3      GLY  26  46.669   4.106 -10.218
  181    H    GLY  27           H        GLY  27  44.339   2.084  -9.038
  182    HA2  GLY  27           HA2      GLY  27  43.985  -0.258  -9.619
  183    HA3  GLY  27           HA3      GLY  27  45.660  -0.296 -10.154
  184    H    TRP  28           H        TRP  28  45.410   1.563  -7.361
  185    HA   TRP  28           HA       TRP  28  46.879  -0.339  -5.879
  186    HD1  TRP  28           HD1      TRP  28  45.699   4.084  -6.075
  187    HE1  TRP  28           HE1      TRP  28  43.609   5.140  -5.047
  188    HE3  TRP  28           HE3      TRP  28  44.491   0.506  -2.665
  189    HZ2  TRP  28           HZ2      TRP  28  41.688   4.564  -3.076
  190    HZ3  TRP  28           HZ3      TRP  28  42.531   0.823  -1.234
  191    HH2  TRP  28           HH2      TRP  28  41.148   2.823  -1.439
  192    HB2  TRP  28           HB2      TRP  28  46.809   1.210  -4.012
  193    HB3  TRP  28           HB3      TRP  28  47.172   2.068  -5.507
  194    H    LEU  29           H        LEU  29  43.526   0.868  -5.306
  195    HA   LEU  29           HA       LEU  29  42.859  -0.552  -3.122
  196    HG   LEU  29           HG       LEU  29  40.451  -2.123  -4.524
  197    HB2  LEU  29           HB2      LEU  29  41.130   0.715  -3.898
  198    HB3  LEU  29           HB3      LEU  29  41.310   0.172  -5.555
  199   HD11  LEU  29          HD11      LEU  29  38.988  -1.892  -2.681
  200   HD12  LEU  29          HD12      LEU  29  39.112  -0.132  -2.709
  201   HD13  LEU  29          HD13      LEU  29  40.495  -1.107  -2.210
  202   HD21  LEU  29          HD21      LEU  29  38.525  -1.693  -5.612
  203   HD22  LEU  29          HD22      LEU  29  39.368  -0.229  -6.109
  204   HD23  LEU  29          HD23      LEU  29  38.251  -0.181  -4.747
  205    H    THR  30           H        THR  30  42.102  -2.022  -6.284
  206    HA   THR  30           HA       THR  30  41.623  -4.560  -5.530
  207    HB   THR  30           HB       THR  30  41.519  -4.216  -7.828
  208    HG1  THR  30           HG1      THR  30  43.970  -5.605  -7.530
  209   HG21  THR  30          HG21      THR  30  43.581  -2.428  -7.509
  210   HG22  THR  30          HG22      THR  30  42.820  -2.884  -9.034
  211   HG23  THR  30          HG23      THR  30  44.289  -3.701  -8.501
  212    H    ARG  31           H        ARG  31  44.728  -2.974  -5.457
  213    HA   ARG  31           HA       ARG  31  46.095  -5.439  -4.663
  214    HE   ARG  31           HE       ARG  31  49.625  -3.616  -8.049
  215    HB2  ARG  31           HB2      ARG  31  47.436  -2.767  -4.930
  216    HB3  ARG  31           HB3      ARG  31  48.123  -4.373  -5.133
  217    HG2  ARG  31           HG2      ARG  31  47.285  -4.610  -7.263
  218    HG3  ARG  31           HG3      ARG  31  45.999  -3.433  -7.001
  219    HD2  ARG  31           HD2      ARG  31  47.593  -2.439  -8.460
  220    HD3  ARG  31           HD3      ARG  31  47.756  -1.660  -6.892
  221   HH11  ARG  31          HH11      ARG  31  48.925  -1.159  -5.648
  222   HH12  ARG  31          HH12      ARG  31  50.571  -1.031  -5.136
  223   HH21  ARG  31          HH21      ARG  31  51.776  -3.432  -7.364
  224   HH22  ARG  31          HH22      ARG  31  52.185  -2.315  -6.105
  225    H    LEU  32           H        LEU  32  46.136  -2.059  -3.524
  226    HA   LEU  32           HA       LEU  32  47.301  -2.229  -1.122
  227    HG   LEU  32           HG       LEU  32  46.162   1.178  -0.628
  228    HB2  LEU  32           HB2      LEU  32  46.074  -0.327  -2.380
  229    HB3  LEU  32           HB3      LEU  32  44.706  -0.767  -1.374
  230   HD11  LEU  32          HD11      LEU  32  44.756   0.681   1.028
  231   HD12  LEU  32          HD12      LEU  32  46.191  -0.006   1.795
  232   HD13  LEU  32          HD13      LEU  32  45.070  -1.052   0.921
  233   HD21  LEU  32          HD21      LEU  32  47.968  -1.085   0.196
  234   HD22  LEU  32          HD22      LEU  32  48.148   0.614   0.642
  235   HD23  LEU  32          HD23      LEU  32  48.314   0.121  -1.045
  236    H    LEU  33           H        LEU  33  43.735  -2.289  -1.160
  237    HA   LEU  33           HA       LEU  33  43.383  -3.265   1.397
  238    HG   LEU  33           HG       LEU  33  41.034  -2.647   1.884
  239    HB2  LEU  33           HB2      LEU  33  41.750  -3.030  -1.027
  240    HB3  LEU  33           HB3      LEU  33  41.217  -4.290   0.076
  241   HD11  LEU  33          HD11      LEU  33  41.221  -0.228   1.307
  242   HD12  LEU  33          HD12      LEU  33  41.967  -0.706  -0.218
  243   HD13  LEU  33          HD13      LEU  33  42.755  -1.099   1.310
  244   HD21  LEU  33          HD21      LEU  33  39.022  -2.968   0.720
  245   HD22  LEU  33          HD22      LEU  33  39.592  -2.068  -0.686
  246   HD23  LEU  33          HD23      LEU  33  39.216  -1.217   0.812
  247    H    GLN  34           H        GLN  34  42.842  -5.226  -1.512
  248    HA   GLN  34           HA       GLN  34  42.554  -7.697  -0.569
  249    HB2  GLN  34           HB2      GLN  34  43.685  -6.541  -2.956
  250    HB3  GLN  34           HB3      GLN  34  44.448  -8.084  -2.587
  251    HG2  GLN  34           HG2      GLN  34  42.685  -8.699  -3.942
  252    HG3  GLN  34           HG3      GLN  34  42.032  -8.952  -2.325
  253   HE21  GLN  34          HE21      GLN  34  41.079  -6.754  -1.440
  254   HE22  GLN  34          HE22      GLN  34  39.952  -6.000  -2.511
  255    H    THR  35           H        THR  35  45.562  -5.912  -0.485
  256    HA   THR  35           HA       THR  35  47.088  -8.202   0.442
  257    HB   THR  35           HB       THR  35  47.795  -5.295   0.025
  258    HG1  THR  35           HG1      THR  35  47.668  -6.493  -1.863
  259   HG21  THR  35          HG21      THR  35  49.716  -7.475   0.789
  260   HG22  THR  35          HG22      THR  35  49.107  -6.257   1.909
  261   HG23  THR  35          HG23      THR  35  50.072  -5.770   0.516
  262    H    LYS  36           H        LYS  36  46.484  -4.963   1.745
  263    HA   LYS  36           HA       LYS  36  47.172  -5.679   4.411
  264    HB2  LYS  36           HB2      LYS  36  45.787  -3.259   3.262
  265    HB3  LYS  36           HB3      LYS  36  46.202  -3.416   4.964
  266    HG2  LYS  36           HG2      LYS  36  48.035  -2.290   4.257
  267    HG3  LYS  36           HG3      LYS  36  48.593  -3.935   3.939
  268    HD2  LYS  36           HD2      LYS  36  47.927  -3.741   1.614
  269    HD3  LYS  36           HD3      LYS  36  47.273  -2.129   1.913
  270    HE2  LYS  36           HE2      LYS  36  50.161  -2.947   2.203
  271    HE3  LYS  36           HE3      LYS  36  49.480  -2.027   0.862
  272    HZ1  LYS  36           HZ1      LYS  36  50.516  -1.016   3.199
  273    HZ2  LYS  36           HZ2      LYS  36  48.844  -0.824   3.357
  274    HZ3  LYS  36           HZ3      LYS  36  49.647  -0.162   2.025
  275    H    ASN  37           H        ASN  37  45.168  -7.477   3.512
  276    HA   ASN  37           HA       ASN  37  43.163  -8.389   4.023
  277    HB2  ASN  37           HB2      ASN  37  42.505  -8.141   6.457
  278    HB3  ASN  37           HB3      ASN  37  44.127  -8.761   6.158
  279   HD21  ASN  37          HD21      ASN  37  42.276  -6.436   7.733
  280   HD22  ASN  37          HD22      ASN  37  43.563  -5.438   8.309
  281    H    TYR  38           H        TYR  38  42.780  -6.199   2.518
  282    HA   TYR  38           HA       TYR  38  41.269  -4.596   1.916
  283    HD1  TYR  38           HD1      TYR  38  41.411  -7.784   2.231
  284    HD2  TYR  38           HD2      TYR  38  37.752  -6.016   0.989
  285    HE1  TYR  38           HE1      TYR  38  41.208  -9.471   0.454
  286    HE2  TYR  38           HE2      TYR  38  37.529  -7.698  -0.791
  287    HH   TYR  38           HH       TYR  38  39.614 -10.463  -0.974
  288    HB2  TYR  38           HB2      TYR  38  39.542  -6.243   3.775
  289    HB3  TYR  38           HB3      TYR  38  38.926  -5.012   2.679
  290    H    ASP  39           H        ASP  39  42.768  -3.191   3.285
  291    HA   ASP  39           HA       ASP  39  41.143  -1.907   5.380
  292    HB2  ASP  39           HB2      ASP  39  42.855  -1.826   6.902
  293    HB3  ASP  39           HB3      ASP  39  43.252  -3.338   6.087
  294    H    ILE  40           H        ILE  40  40.973   0.250   5.350
  295    HA   ILE  40           HA       ILE  40  42.108   1.607   3.068
  296    HB   ILE  40           HB       ILE  40  40.681   3.506   3.743
  297   HG12  ILE  40          HG12      ILE  40  40.766   2.556   6.243
  298   HG13  ILE  40          HG13      ILE  40  39.459   3.585   5.672
  299   HG21  ILE  40          HG21      ILE  40  39.754   2.000   2.172
  300   HG22  ILE  40          HG22      ILE  40  38.487   2.340   3.349
  301   HG23  ILE  40          HG23      ILE  40  39.374   0.818   3.424
  302   HD11  ILE  40          HD11      ILE  40  39.161   0.646   5.378
  303   HD12  ILE  40          HD12      ILE  40  37.942   1.887   5.667
  304   HD13  ILE  40          HD13      ILE  40  38.990   1.359   6.982
  305    H    GLY  41           H        GLY  41  42.746   1.164   6.366
  306    HA2  GLY  41           HA2      GLY  41  43.765   3.507   7.265
  307    HA3  GLY  41           HA3      GLY  41  44.502   1.957   7.629
  308    H    ALA  42           H        ALA  42  45.106   1.364   4.932
  309    HA   ALA  42           HA       ALA  42  47.437   3.090   4.559
  310    HB1  ALA  42           HB1      ALA  42  48.147   0.856   4.753
  311    HB2  ALA  42           HB2      ALA  42  48.182   1.192   3.021
  312    HB3  ALA  42           HB3      ALA  42  46.846   0.270   3.714
  313    H    ALA  43           H        ALA  43  44.520   1.976   3.089
  314    HA   ALA  43           HA       ALA  43  44.983   2.692   0.423
  315    HB1  ALA  43           HB1      ALA  43  42.331   2.950   1.812
  316    HB2  ALA  43           HB2      ALA  43  43.029   1.394   1.365
  317    HB3  ALA  43           HB3      ALA  43  42.645   2.580   0.122
  318    H    LEU  44           H        LEU  44  44.411   4.626   3.221
  319    HA   LEU  44           HA       LEU  44  43.480   6.960   1.894
  320    HG   LEU  44           HG       LEU  44  42.138   7.828   3.414
  321    HB2  LEU  44           HB2      LEU  44  44.358   6.217   4.602
  322    HB3  LEU  44           HB3      LEU  44  44.658   7.894   4.172
  323   HD11  LEU  44          HD11      LEU  44  41.944   5.868   5.656
  324   HD12  LEU  44          HD12      LEU  44  42.164   5.296   4.003
  325   HD13  LEU  44          HD13      LEU  44  40.760   6.279   4.417
  326   HD21  LEU  44          HD21      LEU  44  41.497   8.469   5.755
  327   HD22  LEU  44          HD22      LEU  44  42.887   9.330   5.095
  328   HD23  LEU  44          HD23      LEU  44  43.129   8.019   6.251
  329    H    ASP  45           H        ASP  45  46.648   6.118   3.286
  330    HA   ASP  45           HA       ASP  45  48.049   8.351   2.391
  331    HB2  ASP  45           HB2      ASP  45  49.071   6.871   3.977
  332    HB3  ASP  45           HB3      ASP  45  48.976   5.511   2.859
  333    H    THR  46           H        THR  46  46.909   5.610   0.643
  334    HA   THR  46           HA       THR  46  48.681   5.875  -1.590
  335    HB   THR  46           HB       THR  46  47.316   4.211  -2.680
  336    HG1  THR  46           HG1      THR  46  45.266   4.204  -2.327
  337   HG21  THR  46          HG21      THR  46  48.431   3.807  -0.125
  338   HG22  THR  46          HG22      THR  46  48.164   2.625  -1.407
  339   HG23  THR  46          HG23      THR  46  46.917   2.905  -0.192
  340    H    ILE  47           H        ILE  47  45.132   6.359  -1.420
  341    HA   ILE  47           HA       ILE  47  44.996   7.732  -3.852
  342    HB   ILE  47           HB       ILE  47  42.797   8.655  -2.809
  343   HG12  ILE  47          HG12      ILE  47  42.908   6.362  -0.952
  344   HG13  ILE  47          HG13      ILE  47  43.883   7.754  -0.488
  345   HG21  ILE  47          HG21      ILE  47  42.771   6.938  -4.462
  346   HG22  ILE  47          HG22      ILE  47  41.716   6.427  -3.146
  347   HG23  ILE  47          HG23      ILE  47  43.332   5.743  -3.298
  348   HD11  ILE  47          HD11      ILE  47  40.995   8.024  -1.236
  349   HD12  ILE  47          HD12      ILE  47  42.016   9.149  -0.339
  350   HD13  ILE  47          HD13      ILE  47  41.511   7.630   0.403
  351    H    GLN  48           H        GLN  48  43.582   9.663  -1.363
  352    HA   GLN  48           HA       GLN  48  45.703  11.667  -1.729
  353    HB2  GLN  48           HB2      GLN  48  42.957  12.673  -1.342
  354    HB3  GLN  48           HB3      GLN  48  44.244  13.270  -2.380
  355    HG2  GLN  48           HG2      GLN  48  42.618  12.555  -3.869
  356    HG3  GLN  48           HG3      GLN  48  43.768  11.218  -3.837
  357   HE21  GLN  48          HE21      GLN  48  41.840  10.121  -4.744
  358   HE22  GLN  48          HE22      GLN  48  40.727   9.400  -3.628
  359    H    TYR  49           H        TYR  49  45.579   9.931   0.470
  360    HA   TYR  49           HA       TYR  49  45.050  11.881   2.601
  361    HD1  TYR  49           HD1      TYR  49  43.403  11.954   4.680
  362    HD2  TYR  49           HD2      TYR  49  41.921   9.525   1.518
  363    HE1  TYR  49           HE1      TYR  49  41.221  13.074   4.851
  364    HE2  TYR  49           HE2      TYR  49  39.735  10.637   1.678
  365    HH   TYR  49           HH       TYR  49  38.700  12.305   4.196
  366    HB2  TYR  49           HB2      TYR  49  44.033   9.081   2.396
  367    HB3  TYR  49           HB3      TYR  49  44.469   9.706   3.988
  368    H    SER  50           H        SER  50  47.477  11.885   1.779
  369    HA   SER  50           HA       SER  50  49.047   9.923   3.282
  370    HG   SER  50           HG       SER  50  50.369   9.846   0.133
  371    HB2  SER  50           HB2      SER  50  49.579  11.693   0.946
  372    HB3  SER  50           HB3      SER  50  50.936  11.321   2.009
  373    H    LYS  51           H        LYS  51  47.865  11.432   5.062
  374    HA   LYS  51           HA       LYS  51  50.028  12.919   6.239
  375    HB2  LYS  51           HB2      LYS  51  48.139  14.345   4.733
  376    HB3  LYS  51           HB3      LYS  51  47.685  14.601   6.413
  377    HG2  LYS  51           HG2      LYS  51  50.321  15.024   6.606
  378    HG3  LYS  51           HG3      LYS  51  50.066  15.511   4.930
  379    HD2  LYS  51           HD2      LYS  51  48.245  17.015   5.700
  380    HD3  LYS  51           HD3      LYS  51  48.649  16.590   7.365
  381    HE2  LYS  51           HE2      LYS  51  49.707  18.677   6.818
  382    HE3  LYS  51           HE3      LYS  51  50.947  17.433   6.969
  383    HZ1  LYS  51           HZ1      LYS  51  51.402  17.488   4.758
  384    HZ2  LYS  51           HZ2      LYS  51  50.897  19.089   4.949
  385    HZ3  LYS  51           HZ3      LYS  51  49.834  17.940   4.312
  386    H    HIS  52           H        HIS  52  49.520  13.566   8.472
  387    HA   HIS  52           HA       HIS  52  47.763  11.576   9.667
  388    HD1  HIS  52           HD1      HIS  52  49.128  15.098   9.843
  389    HD2  HIS  52           HD2      HIS  52  52.120  12.917  11.728
  390    HE1  HIS  52           HE1      HIS  52  51.117  16.646  10.043
  391    HB2  HIS  52           HB2      HIS  52  48.877  12.435  11.822
  392    HB3  HIS  52           HB3      HIS  52  49.886  11.552  10.681
  Start of MODEL   24
    1    H1   GLY   1           1H       GLY   1  37.147 -11.853  -3.635
    2    H2   GLY   1           2H       GLY   1  36.932 -13.515  -3.862
    3    H3   GLY   1           3H       GLY   1  35.721 -12.600  -3.117
    4    HA2  GLY   1           HA2      GLY   1  36.607 -12.074  -5.889
    5    HA3  GLY   1           HA3      GLY   1  35.337 -13.231  -5.522
    6    H    SER   2           H        SER   2  33.357 -12.492  -4.687
    7    HA   SER   2           HA       SER   2  32.912  -9.604  -5.064
    8    HG   SER   2           HG       SER   2  31.297 -10.071  -7.504
    9    HB2  SER   2           HB2      SER   2  31.671 -11.768  -6.343
   10    HB3  SER   2           HB3      SER   2  30.486 -11.179  -5.176
   11    HA   PRO   3           HA       PRO   3  32.076  -9.515  -0.689
   12    HB2  PRO   3           HB2      PRO   3  30.738  -7.095  -0.750
   13    HB3  PRO   3           HB3      PRO   3  32.493  -7.271  -0.653
   14    HG2  PRO   3           HG2      PRO   3  30.769  -6.753  -3.043
   15    HG3  PRO   3           HG3      PRO   3  32.335  -6.037  -2.613
   16    HD2  PRO   3           HD2      PRO   3  32.171  -7.965  -4.453
   17    HD3  PRO   3           HD3      PRO   3  33.519  -7.916  -3.298
   18    HA   PRO   4           HA       PRO   4  28.025 -11.196  -0.272
   19    HB2  PRO   4           HB2      PRO   4  27.953  -9.677   2.286
   20    HB3  PRO   4           HB3      PRO   4  27.686 -11.399   1.994
   21    HG2  PRO   4           HG2      PRO   4  29.956 -10.549   3.091
   22    HG3  PRO   4           HG3      PRO   4  29.958 -11.869   1.907
   23    HD2  PRO   4           HD2      PRO   4  30.729  -9.003   1.553
   24    HD3  PRO   4           HD3      PRO   4  31.459 -10.463   0.854
   25    H    GLU   5           H        GLU   5  26.151  -9.736   1.490
   26    HA   GLU   5           HA       GLU   5  25.138  -7.896  -0.531
   27    HB2  GLU   5           HB2      GLU   5  23.049  -7.966   0.651
   28    HB3  GLU   5           HB3      GLU   5  23.644  -9.613   0.497
   29    HG2  GLU   5           HG2      GLU   5  24.341  -9.643   2.783
   30    HG3  GLU   5           HG3      GLU   5  23.989  -7.926   2.963
   31    H    ALA   6           H        ALA   6  27.471  -7.260   1.170
   32    HA   ALA   6           HA       ALA   6  28.151  -5.051   1.689
   33    HB1  ALA   6           HB1      ALA   6  25.669  -4.325   1.426
   34    HB2  ALA   6           HB2      ALA   6  26.734  -3.401   2.481
   35    HB3  ALA   6           HB3      ALA   6  25.599  -4.559   3.172
   36    H    ASP   7           H        ASP   7  29.360  -6.784   2.805
   37    HA   ASP   7           HA       ASP   7  28.663  -7.110   5.626
   38    HB2  ASP   7           HB2      ASP   7  30.014  -9.013   5.647
   39    HB3  ASP   7           HB3      ASP   7  29.322  -9.038   4.029
   40    HA   PRO   8           HA       PRO   8  31.542  -4.361   7.472
   41    HB2  PRO   8           HB2      PRO   8  32.741  -6.791   8.734
   42    HB3  PRO   8           HB3      PRO   8  32.243  -5.266   9.477
   43    HG2  PRO   8           HG2      PRO   8  30.723  -7.440   9.697
   44    HG3  PRO   8           HG3      PRO   8  29.998  -5.838   9.468
   45    HD2  PRO   8           HD2      PRO   8  30.281  -8.083   7.537
   46    HD3  PRO   8           HD3      PRO   8  29.020  -6.840   7.652
   47    H    ARG   9           H        ARG   9  32.592  -6.941   5.486
   48    HA   ARG   9           HA       ARG   9  35.400  -6.347   5.596
   49    HE   ARG   9           HE       ARG   9  37.612 -10.340   4.411
   50    HB2  ARG   9           HB2      ARG   9  33.684  -8.309   4.279
   51    HB3  ARG   9           HB3      ARG   9  34.971  -7.722   3.230
   52    HG2  ARG   9           HG2      ARG   9  36.650  -8.437   4.753
   53    HG3  ARG   9           HG3      ARG   9  35.453  -8.786   6.001
   54    HD2  ARG   9           HD2      ARG   9  34.860 -10.762   5.071
   55    HD3  ARG   9           HD3      ARG   9  35.081 -10.174   3.424
   56   HH11  ARG   9          HH11      ARG   9  34.946 -12.570   4.146
   57   HH12  ARG   9          HH12      ARG   9  35.961 -13.965   3.989
   58   HH21  ARG   9          HH21      ARG   9  38.955 -12.171   4.213
   59   HH22  ARG   9          HH22      ARG   9  38.241 -13.738   4.030
   60    H    LEU  10           H        LEU  10  33.036  -6.136   2.931
   61    HA   LEU  10           HA       LEU  10  34.616  -3.979   1.772
   62    HG   LEU  10           HG       LEU  10  34.237  -7.110   0.230
   63    HB2  LEU  10           HB2      LEU  10  32.476  -5.739   0.586
   64    HB3  LEU  10           HB3      LEU  10  33.223  -4.403  -0.268
   65   HD11  LEU  10          HD11      LEU  10  34.059  -6.694  -1.995
   66   HD12  LEU  10          HD12      LEU  10  35.723  -6.165  -1.749
   67   HD13  LEU  10          HD13      LEU  10  34.420  -4.977  -1.819
   68   HD21  LEU  10          HD21      LEU  10  36.623  -6.305   0.238
   69   HD22  LEU  10          HD22      LEU  10  35.745  -6.089   1.752
   70   HD23  LEU  10          HD23      LEU  10  36.002  -4.715   0.679
   71    H    ILE  11           H        ILE  11  31.927  -4.403   3.670
   72    HA   ILE  11           HA       ILE  11  30.393  -2.183   2.586
   73    HB   ILE  11           HB       ILE  11  29.371  -4.206   3.832
   74   HG12  ILE  11          HG12      ILE  11  28.639  -1.350   4.495
   75   HG13  ILE  11          HG13      ILE  11  28.034  -2.314   3.155
   76   HG21  ILE  11          HG21      ILE  11  29.391  -4.292   6.132
   77   HG22  ILE  11          HG22      ILE  11  29.785  -2.581   6.300
   78   HG23  ILE  11          HG23      ILE  11  31.026  -3.726   5.796
   79   HD11  ILE  11          HD11      ILE  11  27.567  -3.490   5.792
   80   HD12  ILE  11          HD12      ILE  11  26.474  -3.300   4.421
   81   HD13  ILE  11          HD13      ILE  11  26.758  -1.948   5.519
   82    H    GLU  12           H        GLU  12  32.571  -2.904   5.166
   83    HA   GLU  12           HA       GLU  12  32.377  -0.273   6.360
   84    HB2  GLU  12           HB2      GLU  12  32.950  -2.568   7.505
   85    HB3  GLU  12           HB3      GLU  12  34.584  -2.207   6.968
   86    HG2  GLU  12           HG2      GLU  12  34.422  -1.431   9.182
   87    HG3  GLU  12           HG3      GLU  12  34.370  -0.001   8.153
   88    H    SER  13           H        SER  13  35.075  -2.142   4.979
   89    HA   SER  13           HA       SER  13  36.671   0.169   4.582
   90    HG   SER  13           HG       SER  13  38.533  -0.632   2.928
   91    HB2  SER  13           HB2      SER  13  37.463  -2.195   5.026
   92    HB3  SER  13           HB3      SER  13  37.120  -2.534   3.330
   93    H    LEU  14           H        LEU  14  34.956  -1.966   2.245
   94    HA   LEU  14           HA       LEU  14  35.845  -0.442   0.009
   95    HG   LEU  14           HG       LEU  14  34.644  -3.139  -2.076
   96    HB2  LEU  14           HB2      LEU  14  34.539  -2.866   0.342
   97    HB3  LEU  14           HB3      LEU  14  33.351  -1.857  -0.457
   98   HD11  LEU  14          HD11      LEU  14  34.239  -1.403  -3.393
   99   HD12  LEU  14          HD12      LEU  14  35.820  -0.756  -2.954
  100   HD13  LEU  14          HD13      LEU  14  34.388  -0.282  -2.039
  101   HD21  LEU  14          HD21      LEU  14  36.804  -3.525  -1.759
  102   HD22  LEU  14          HD22      LEU  14  36.817  -2.421  -0.384
  103   HD23  LEU  14          HD23      LEU  14  37.140  -1.812  -2.008
  104    H    SER  15           H        SER  15  32.527  -0.780   1.289
  105    HA   SER  15           HA       SER  15  31.300   1.205  -0.086
  106    HG   SER  15           HG       SER  15  28.606   0.951   1.914
  107    HB2  SER  15           HB2      SER  15  30.667  -0.276   2.177
  108    HB3  SER  15           HB3      SER  15  30.592   1.393   2.741
  109    H    GLN  16           H        GLN  16  32.685   1.795   3.165
  110    HA   GLN  16           HA       GLN  16  32.564   4.507   3.214
  111    HB2  GLN  16           HB2      GLN  16  34.110   4.479   4.923
  112    HB3  GLN  16           HB3      GLN  16  33.574   2.807   4.927
  113    HG2  GLN  16           HG2      GLN  16  35.811   2.466   5.006
  114    HG3  GLN  16           HG3      GLN  16  35.611   2.541   3.255
  115   HE21  GLN  16          HE21      GLN  16  37.095   3.715   2.296
  116   HE22  GLN  16          HE22      GLN  16  37.864   5.122   2.937
  117    H    MET  17           H        MET  17  34.913   2.517   1.500
  118    HA   MET  17           HA       MET  17  36.639   4.598   0.718
  119    HB2  MET  17           HB2      MET  17  36.267   1.792   0.072
  120    HB3  MET  17           HB3      MET  17  36.677   2.726  -1.360
  121    HG2  MET  17           HG2      MET  17  38.409   3.607   0.654
  122    HG3  MET  17           HG3      MET  17  38.351   1.851   0.794
  123    HE1  MET  17           HE1      MET  17  37.818   4.290  -1.892
  124    HE2  MET  17           HE2      MET  17  38.428   3.421  -3.301
  125    HE3  MET  17           HE3      MET  17  39.456   4.590  -2.473
  126    H    LEU  18           H        LEU  18  33.675   3.281  -0.678
  127    HA   LEU  18           HA       LEU  18  33.818   5.192  -2.889
  128    HG   LEU  18           HG       LEU  18  34.269   2.611  -3.287
  129    HB2  LEU  18           HB2      LEU  18  31.763   3.074  -2.252
  130    HB3  LEU  18           HB3      LEU  18  31.767   4.078  -3.690
  131   HD11  LEU  18          HD11      LEU  18  32.939   0.868  -2.414
  132   HD12  LEU  18          HD12      LEU  18  33.216   0.467  -4.109
  133   HD13  LEU  18          HD13      LEU  18  31.666   1.141  -3.603
  134   HD21  LEU  18          HD21      LEU  18  32.338   3.135  -5.521
  135   HD22  LEU  18          HD22      LEU  18  33.663   1.985  -5.699
  136   HD23  LEU  18          HD23      LEU  18  34.005   3.679  -5.346
  137    H    SER  19           H        SER  19  31.354   4.240  -0.500
  138    HA   SER  19           HA       SER  19  29.612   6.337  -0.800
  139    HG   SER  19           HG       SER  19  27.722   5.805   1.001
  140    HB2  SER  19           HB2      SER  19  30.050   4.248   1.108
  141    HB3  SER  19           HB3      SER  19  29.656   5.737   1.966
  142    H    MET  20           H        MET  20  32.783   6.551   0.427
  143    HA   MET  20           HA       MET  20  32.179   9.052   1.839
  144    HB2  MET  20           HB2      MET  20  33.666   7.235   2.870
  145    HB3  MET  20           HB3      MET  20  34.881   7.726   1.698
  146    HG2  MET  20           HG2      MET  20  35.340   9.652   2.774
  147    HG3  MET  20           HG3      MET  20  33.673   9.886   3.296
  148    HE1  MET  20           HE1      MET  20  35.910  10.398   5.984
  149    HE2  MET  20           HE2      MET  20  34.365   9.946   6.705
  150    HE3  MET  20           HE3      MET  20  34.399  10.862   5.199
  151    H    GLY  21           H        GLY  21  33.864   7.722  -0.902
  152    HA2  GLY  21           HA2      GLY  21  33.940   9.149  -2.904
  153    HA3  GLY  21           HA3      GLY  21  34.376  10.480  -1.837
  154    H    PHE  22           H        PHE  22  35.620   7.135  -2.042
  155    HA   PHE  22           HA       PHE  22  38.227   8.233  -2.805
  156    HD1  PHE  22           HD2      PHE  22  39.146   9.516  -1.354
  157    HD2  PHE  22           HD1      PHE  22  37.578   6.794   1.515
  158    HE1  PHE  22           HE2      PHE  22  39.227  11.280   0.360
  159    HE2  PHE  22           HE1      PHE  22  37.655   8.550   3.234
  160    HZ   PHE  22           HZ       PHE  22  38.482  10.798   2.658
  161    HB2  PHE  22           HB2      PHE  22  37.744   6.131  -0.676
  162    HB3  PHE  22           HB3      PHE  22  39.325   6.637  -1.272
  163    H    SER  23           H        SER  23  39.386   6.924  -4.206
  164    HA   SER  23           HA       SER  23  38.158   4.365  -4.888
  165    HG   SER  23           HG       SER  23  37.023   7.134  -6.450
  166    HB2  SER  23           HB2      SER  23  38.962   6.441  -6.942
  167    HB3  SER  23           HB3      SER  23  38.311   4.837  -7.286
  168    H    ASP  24           H        ASP  24  39.610   3.029  -6.310
  169    HA   ASP  24           HA       ASP  24  42.271   3.039  -5.232
  170    HB2  ASP  24           HB2      ASP  24  42.542   1.084  -6.881
  171    HB3  ASP  24           HB3      ASP  24  41.370   0.891  -5.577
  172    H    GLU  25           H        GLU  25  43.887   4.241  -5.998
  173    HA   GLU  25           HA       GLU  25  43.886   5.984  -8.031
  174    HB2  GLU  25           HB2      GLU  25  45.810   5.656  -6.508
  175    HB3  GLU  25           HB3      GLU  25  46.277   4.244  -7.445
  176    HG2  GLU  25           HG2      GLU  25  46.870   5.525  -9.304
  177    HG3  GLU  25           HG3      GLU  25  45.992   6.939  -8.720
  178    H    GLY  26           H        GLY  26  44.639   2.586  -8.412
  179    HA2  GLY  26           HA2      GLY  26  43.793   2.733 -11.193
  180    HA3  GLY  26           HA3      GLY  26  45.469   2.266 -10.918
  181    H    GLY  27           H        GLY  27  45.432   0.560  -8.868
  182    HA2  GLY  27           HA2      GLY  27  43.307  -1.323  -8.882
  183    HA3  GLY  27           HA3      GLY  27  44.578  -1.843  -9.978
  184    H    TRP  28           H        TRP  28  45.069  -0.062  -7.012
  185    HA   TRP  28           HA       TRP  28  46.700  -2.269  -6.010
  186    HD1  TRP  28           HD1      TRP  28  47.126   2.266  -6.637
  187    HE1  TRP  28           HE1      TRP  28  45.658   4.061  -5.531
  188    HE3  TRP  28           HE3      TRP  28  45.282  -0.445  -2.753
  189    HZ2  TRP  28           HZ2      TRP  28  43.938   4.299  -3.318
  190    HZ3  TRP  28           HZ3      TRP  28  43.739   0.621  -1.171
  191    HH2  TRP  28           HH2      TRP  28  43.072   2.944  -1.449
  192    HB2  TRP  28           HB2      TRP  28  47.555  -0.604  -4.366
  193    HB3  TRP  28           HB3      TRP  28  47.830  -0.133  -6.043
  194    H    LEU  29           H        LEU  29  43.847  -0.396  -5.267
  195    HA   LEU  29           HA       LEU  29  43.348  -0.923  -2.639
  196    HG   LEU  29           HG       LEU  29  40.657  -2.334  -2.897
  197    HB2  LEU  29           HB2      LEU  29  41.703   0.323  -3.695
  198    HB3  LEU  29           HB3      LEU  29  41.495  -0.845  -4.982
  199   HD11  LEU  29          HD11      LEU  29  39.286   0.115  -2.100
  200   HD12  LEU  29          HD12      LEU  29  41.000   0.094  -1.685
  201   HD13  LEU  29          HD13      LEU  29  39.938  -1.195  -1.115
  202   HD21  LEU  29          HD21      LEU  29  38.354  -1.016  -3.559
  203   HD22  LEU  29          HD22      LEU  29  39.070  -2.345  -4.473
  204   HD23  LEU  29          HD23      LEU  29  39.394  -0.676  -4.943
  205    H    THR  30           H        THR  30  42.201  -3.132  -5.205
  206    HA   THR  30           HA       THR  30  41.421  -5.249  -3.688
  207    HB   THR  30           HB       THR  30  41.859  -6.682  -5.549
  208    HG1  THR  30           HG1      THR  30  43.909  -6.418  -6.129
  209   HG21  THR  30          HG21      THR  30  40.401  -4.487  -5.898
  210   HG22  THR  30          HG22      THR  30  40.676  -5.669  -7.177
  211   HG23  THR  30          HG23      THR  30  41.641  -4.194  -7.118
  212    H    ARG  31           H        ARG  31  44.643  -4.080  -4.170
  213    HA   ARG  31           HA       ARG  31  45.864  -6.405  -2.894
  214    HE   ARG  31           HE       ARG  31  48.844  -7.310  -4.851
  215    HB2  ARG  31           HB2      ARG  31  47.364  -3.942  -3.716
  216    HB3  ARG  31           HB3      ARG  31  47.914  -5.608  -3.673
  217    HG2  ARG  31           HG2      ARG  31  45.729  -5.027  -5.559
  218    HG3  ARG  31           HG3      ARG  31  47.293  -4.299  -5.926
  219    HD2  ARG  31           HD2      ARG  31  46.665  -7.219  -5.551
  220    HD3  ARG  31           HD3      ARG  31  47.192  -6.414  -7.026
  221   HH11  ARG  31          HH11      ARG  31  48.597  -5.073  -7.510
  222   HH12  ARG  31          HH12      ARG  31  50.310  -4.923  -7.710
  223   HH21  ARG  31          HH21      ARG  31  51.102  -7.120  -5.109
  224   HH22  ARG  31          HH22      ARG  31  51.734  -6.088  -6.349
  225    H    LEU  32           H        LEU  32  46.092  -2.864  -2.498
  226    HA   LEU  32           HA       LEU  32  47.330  -2.613  -0.116
  227    HG   LEU  32           HG       LEU  32  45.783   0.855   0.118
  228    HB2  LEU  32           HB2      LEU  32  46.558  -0.756  -1.488
  229    HB3  LEU  32           HB3      LEU  32  44.893  -1.098  -1.051
  230   HD11  LEU  32          HD11      LEU  32  44.114  -0.831   1.119
  231   HD12  LEU  32          HD12      LEU  32  44.838   0.389   2.166
  232   HD13  LEU  32          HD13      LEU  32  45.446  -1.268   2.189
  233   HD21  LEU  32          HD21      LEU  32  48.132  -0.351   0.203
  234   HD22  LEU  32          HD22      LEU  32  47.551  -0.819   1.802
  235   HD23  LEU  32          HD23      LEU  32  47.669   0.888   1.369
  236    H    LEU  33           H        LEU  33  43.773  -2.814  -0.356
  237    HA   LEU  33           HA       LEU  33  43.278  -3.065   2.379
  238    HG   LEU  33           HG       LEU  33  41.031  -2.431   2.655
  239    HB2  LEU  33           HB2      LEU  33  41.797  -3.358  -0.111
  240    HB3  LEU  33           HB3      LEU  33  41.225  -4.453   1.139
  241   HD11  LEU  33          HD11      LEU  33  40.656  -0.492   0.631
  242   HD12  LEU  33          HD12      LEU  33  42.261  -1.188   0.411
  243   HD13  LEU  33          HD13      LEU  33  41.813  -0.478   1.961
  244   HD21  LEU  33          HD21      LEU  33  39.122  -1.668   0.698
  245   HD22  LEU  33          HD22      LEU  33  38.885  -2.653   2.141
  246   HD23  LEU  33          HD23      LEU  33  39.325  -3.419   0.616
  247    H    GLN  34           H        GLN  34  43.067  -5.667  -0.038
  248    HA   GLN  34           HA       GLN  34  42.605  -7.867   1.353
  249    HB2  GLN  34           HB2      GLN  34  44.041  -7.295  -1.036
  250    HB3  GLN  34           HB3      GLN  34  44.871  -8.589  -0.183
  251    HG2  GLN  34           HG2      GLN  34  43.403  -9.786  -1.460
  252    HG3  GLN  34           HG3      GLN  34  42.472  -9.596   0.025
  253   HE21  GLN  34          HE21      GLN  34  41.540  -7.071  -0.159
  254   HE22  GLN  34          HE22      GLN  34  40.491  -6.911  -1.523
  255    H    THR  35           H        THR  35  45.561  -6.047   1.688
  256    HA   THR  35           HA       THR  35  46.904  -8.116   3.192
  257    HB   THR  35           HB       THR  35  48.094  -5.608   3.748
  258    HG1  THR  35           HG1      THR  35  47.076  -4.622   2.076
  259   HG21  THR  35          HG21      THR  35  48.857  -7.703   1.729
  260   HG22  THR  35          HG22      THR  35  49.350  -7.647   3.421
  261   HG23  THR  35          HG23      THR  35  49.899  -6.399   2.302
  262    H    LYS  36           H        LYS  36  45.909  -4.843   4.052
  263    HA   LYS  36           HA       LYS  36  45.887  -5.395   6.848
  264    HB2  LYS  36           HB2      LYS  36  44.830  -3.053   5.269
  265    HB3  LYS  36           HB3      LYS  36  44.825  -3.127   7.026
  266    HG2  LYS  36           HG2      LYS  36  46.734  -1.903   6.516
  267    HG3  LYS  36           HG3      LYS  36  47.342  -3.528   6.838
  268    HD2  LYS  36           HD2      LYS  36  47.727  -3.961   4.575
  269    HD3  LYS  36           HD3      LYS  36  46.665  -2.651   4.050
  270    HE2  LYS  36           HE2      LYS  36  49.077  -2.149   3.753
  271    HE3  LYS  36           HE3      LYS  36  48.244  -1.000   4.797
  272    HZ1  LYS  36           HZ1      LYS  36  50.094  -3.169   5.595
  273    HZ2  LYS  36           HZ2      LYS  36  49.096  -2.374   6.705
  274    HZ3  LYS  36           HZ3      LYS  36  50.268  -1.505   5.848
  275    H    ASN  37           H        ASN  37  44.144  -7.241   5.476
  276    HA   ASN  37           HA       ASN  37  42.067  -8.134   5.515
  277    HB2  ASN  37           HB2      ASN  37  40.865  -7.829   7.739
  278    HB3  ASN  37           HB3      ASN  37  42.494  -8.499   7.815
  279   HD21  ASN  37          HD21      ASN  37  40.419  -5.992   8.793
  280   HD22  ASN  37          HD22      ASN  37  41.576  -5.060   9.675
  281    H    TYR  38           H        TYR  38  41.941  -6.109   3.866
  282    HA   TYR  38           HA       TYR  38  40.576  -4.548   2.887
  283    HD1  TYR  38           HD2      TYR  38  40.856  -6.603   2.288
  284    HD2  TYR  38           HD1      TYR  38  36.702  -7.021   3.106
  285    HE1  TYR  38           HE2      TYR  38  40.756  -8.540   0.774
  286    HE2  TYR  38           HE1      TYR  38  36.588  -8.956   1.599
  287    HH   TYR  38           HH       TYR  38  39.383 -10.501   0.378
  288    HB2  TYR  38           HB2      TYR  38  38.516  -5.817   4.709
  289    HB3  TYR  38           HB3      TYR  38  38.152  -4.743   3.364
  290    H    ASP  39           H        ASP  39  42.062  -3.204   4.387
  291    HA   ASP  39           HA       ASP  39  40.366  -1.644   6.226
  292    HB2  ASP  39           HB2      ASP  39  42.021  -2.604   7.581
  293    HB3  ASP  39           HB3      ASP  39  43.270  -2.389   6.355
  294    H    ILE  40           H        ILE  40  39.972   0.390   5.691
  295    HA   ILE  40           HA       ILE  40  41.247   1.531   3.394
  296    HB   ILE  40           HB       ILE  40  39.760   3.423   3.701
  297   HG12  ILE  40          HG12      ILE  40  39.944   3.223   6.286
  298   HG13  ILE  40          HG13      ILE  40  38.442   3.813   5.584
  299   HG21  ILE  40          HG21      ILE  40  38.878   1.457   2.583
  300   HG22  ILE  40          HG22      ILE  40  37.609   2.270   3.497
  301   HG23  ILE  40          HG23      ILE  40  38.346   0.799   4.128
  302   HD11  ILE  40          HD11      ILE  40  38.873   1.584   7.302
  303   HD12  ILE  40          HD12      ILE  40  38.205   1.015   5.774
  304   HD13  ILE  40          HD13      ILE  40  37.355   2.250   6.702
  305    H    GLY  41           H        GLY  41  41.860   1.321   6.678
  306    HA2  GLY  41           HA2      GLY  41  42.856   3.744   7.414
  307    HA3  GLY  41           HA3      GLY  41  43.542   2.211   7.922
  308    H    ALA  42           H        ALA  42  44.061   1.425   5.206
  309    HA   ALA  42           HA       ALA  42  46.526   2.929   4.757
  310    HB1  ALA  42           HB1      ALA  42  47.078   0.937   3.263
  311    HB2  ALA  42           HB2      ALA  42  45.667   0.157   3.975
  312    HB3  ALA  42           HB3      ALA  42  47.020   0.635   4.999
  313    H    ALA  43           H        ALA  43  43.520   1.955   3.353
  314    HA   ALA  43           HA       ALA  43  43.909   2.595   0.671
  315    HB1  ALA  43           HB1      ALA  43  41.367   3.065   2.235
  316    HB2  ALA  43           HB2      ALA  43  41.874   1.500   1.596
  317    HB3  ALA  43           HB3      ALA  43  41.515   2.828   0.493
  318    H    LEU  44           H        LEU  44  42.945   4.650   3.380
  319    HA   LEU  44           HA       LEU  44  42.658   7.035   1.896
  320    HG   LEU  44           HG       LEU  44  40.775   6.920   3.169
  321    HB2  LEU  44           HB2      LEU  44  43.063   6.399   4.791
  322    HB3  LEU  44           HB3      LEU  44  43.152   8.066   4.242
  323   HD11  LEU  44          HD11      LEU  44  40.838   6.685   6.161
  324   HD12  LEU  44          HD12      LEU  44  41.144   5.307   5.103
  325   HD13  LEU  44          HD13      LEU  44  39.591   6.140   5.037
  326   HD21  LEU  44          HD21      LEU  44  40.829   8.821   5.472
  327   HD22  LEU  44          HD22      LEU  44  39.785   8.807   4.051
  328   HD23  LEU  44          HD23      LEU  44  41.467   9.319   3.903
  329    H    ASP  45           H        ASP  45  45.362   5.208   2.741
  330    HA   ASP  45           HA       ASP  45  47.265   7.296   3.039
  331    HB2  ASP  45           HB2      ASP  45  47.353   4.786   3.780
  332    HB3  ASP  45           HB3      ASP  45  48.036   4.542   2.176
  333    H    THR  46           H        THR  46  46.649   5.009   0.341
  334    HA   THR  46           HA       THR  46  48.358   6.661  -1.349
  335    HB   THR  46           HB       THR  46  48.286   4.800  -2.931
  336    HG1  THR  46           HG1      THR  46  46.093   4.162  -2.237
  337   HG21  THR  46          HG21      THR  46  49.865   3.692  -1.846
  338   HG22  THR  46          HG22      THR  46  48.733   3.146  -0.610
  339   HG23  THR  46          HG23      THR  46  49.515   4.720  -0.456
  340    H    ILE  47           H        ILE  47  44.995   6.160  -0.827
  341    HA   ILE  47           HA       ILE  47  44.070   6.621  -3.459
  342    HB   ILE  47           HB       ILE  47  41.922   7.363  -2.387
  343   HG12  ILE  47          HG12      ILE  47  42.171   6.477   0.200
  344   HG13  ILE  47          HG13      ILE  47  43.685   7.343  -0.044
  345   HG21  ILE  47          HG21      ILE  47  41.456   5.101  -1.393
  346   HG22  ILE  47          HG22      ILE  47  43.165   4.741  -1.606
  347   HG23  ILE  47          HG23      ILE  47  42.156   5.076  -3.013
  348   HD11  ILE  47          HD11      ILE  47  40.976   8.353   0.275
  349   HD12  ILE  47          HD12      ILE  47  41.841   9.076  -1.079
  350   HD13  ILE  47          HD13      ILE  47  42.525   9.148   0.545
  351    H    GLN  48           H        GLN  48  44.679   8.875  -0.780
  352    HA   GLN  48           HA       GLN  48  45.117  11.003  -2.691
  353    HB2  GLN  48           HB2      GLN  48  42.784  10.990  -0.797
  354    HB3  GLN  48           HB3      GLN  48  43.517  12.505  -1.305
  355    HG2  GLN  48           HG2      GLN  48  42.265  12.468  -3.122
  356    HG3  GLN  48           HG3      GLN  48  43.095  11.003  -3.641
  357   HE21  GLN  48          HE21      GLN  48  42.032   9.115  -3.638
  358   HE22  GLN  48          HE22      GLN  48  40.398   8.906  -3.100
  359    H    TYR  49           H        TYR  49  44.669  10.231   0.741
  360    HA   TYR  49           HA       TYR  49  46.576  12.250   1.556
  361    HD1  TYR  49           HD2      TYR  49  43.031  10.799   1.865
  362    HD2  TYR  49           HD1      TYR  49  45.238  13.570   4.217
  363    HE1  TYR  49           HE2      TYR  49  41.090  12.303   1.898
  364    HE2  TYR  49           HE1      TYR  49  43.303  15.086   4.261
  365    HH   TYR  49           HH       TYR  49  40.304  14.286   2.535
  366    HB2  TYR  49           HB2      TYR  49  45.087  10.143   3.132
  367    HB3  TYR  49           HB3      TYR  49  46.098  11.395   3.839
  368    H    SER  50           H        SER  50  48.649  11.743   0.977
  369    HA   SER  50           HA       SER  50  49.687   9.186   1.996
  370    HG   SER  50           HG       SER  50  48.414   9.241  -0.303
  371    HB2  SER  50           HB2      SER  50  50.923  10.439  -0.422
  372    HB3  SER  50           HB3      SER  50  50.862   8.742   0.054
  373    H    LYS  51           H        LYS  51  49.781  11.329   3.617
  374    HA   LYS  51           HA       LYS  51  51.274  12.381   4.981
  375    HB2  LYS  51           HB2      LYS  51  52.860  10.501   3.730
  376    HB3  LYS  51           HB3      LYS  51  53.679  12.013   3.356
  377    HG2  LYS  51           HG2      LYS  51  53.085  12.225   6.049
  378    HG3  LYS  51           HG3      LYS  51  53.556  10.538   5.840
  379    HD2  LYS  51           HD2      LYS  51  55.619  11.457   6.170
  380    HD3  LYS  51           HD3      LYS  51  55.501  11.646   4.420
  381    HE2  LYS  51           HE2      LYS  51  54.314  13.866   5.883
  382    HE3  LYS  51           HE3      LYS  51  56.026  13.648   6.244
  383    HZ1  LYS  51           HZ1      LYS  51  55.400  15.127   4.283
  384    HZ2  LYS  51           HZ2      LYS  51  55.042  13.694   3.460
  385    HZ3  LYS  51           HZ3      LYS  51  56.610  13.972   4.030
  386    H    HIS  52           H        HIS  52  50.027  13.398   2.441
  387    HA   HIS  52           HA       HIS  52  49.814  15.439   1.497
  388    HD1  HIS  52           HD1      HIS  52  48.561  16.789   1.901
  389    HD2  HIS  52           HD2      HIS  52  51.528  19.270   3.418
  390    HE1  HIS  52           HE1      HIS  52  47.605  19.130   1.884
  391    HB2  HIS  52           HB2      HIS  52  51.097  16.015   3.845
  392    HB3  HIS  52           HB3      HIS  52  52.217  16.670   2.656
  Start of MODEL   25
    1    H1   GLY   1           1H       GLY   1  28.678 -16.578   5.682
    2    H2   GLY   1           2H       GLY   1  29.585 -15.164   5.878
    3    H3   GLY   1           3H       GLY   1  28.985 -15.577   4.352
    4    HA2  GLY   1           HA2      GLY   1  26.721 -15.527   5.788
    5    HA3  GLY   1           HA3      GLY   1  27.666 -14.270   6.570
    6    H    SER   2           H        SER   2  29.081 -13.284   4.381
    7    HA   SER   2           HA       SER   2  26.894 -12.138   2.774
    8    HG   SER   2           HG       SER   2  29.395 -10.202   1.751
    9    HB2  SER   2           HB2      SER   2  27.703 -10.076   3.167
   10    HB3  SER   2           HB3      SER   2  28.700 -10.817   4.420
   11    HA   PRO   3           HA       PRO   3  29.144 -13.649  -0.740
   12    HB2  PRO   3           HB2      PRO   3  27.504 -12.687  -2.645
   13    HB3  PRO   3           HB3      PRO   3  27.017 -13.990  -1.559
   14    HG2  PRO   3           HG2      PRO   3  26.147 -11.178  -1.621
   15    HG3  PRO   3           HG3      PRO   3  25.333 -12.592  -0.936
   16    HD2  PRO   3           HD2      PRO   3  26.893 -10.594   0.428
   17    HD3  PRO   3           HD3      PRO   3  26.049 -11.989   1.122
   18    HA   PRO   4           HA       PRO   4  31.784 -10.661  -2.623
   19    HB2  PRO   4           HB2      PRO   4  31.334 -10.993  -5.334
   20    HB3  PRO   4           HB3      PRO   4  32.403 -12.003  -4.358
   21    HG2  PRO   4           HG2      PRO   4  29.589 -12.505  -5.225
   22    HG3  PRO   4           HG3      PRO   4  30.950 -13.637  -5.118
   23    HD2  PRO   4           HD2      PRO   4  29.021 -13.586  -3.257
   24    HD3  PRO   4           HD3      PRO   4  30.716 -13.895  -2.824
   25    H    GLU   5           H        GLU   5  30.294  -9.012  -1.711
   26    HA   GLU   5           HA       GLU   5  29.937  -6.825  -3.216
   27    HB2  GLU   5           HB2      GLU   5  28.545  -7.789  -4.833
   28    HB3  GLU   5           HB3      GLU   5  27.615  -8.681  -3.638
   29    HG2  GLU   5           HG2      GLU   5  27.331  -5.907  -3.096
   30    HG3  GLU   5           HG3      GLU   5  27.047  -6.175  -4.814
   31    H    ALA   6           H        ALA   6  30.438  -6.265  -0.994
   32    HA   ALA   6           HA       ALA   6  29.635  -4.849   0.681
   33    HB1  ALA   6           HB1      ALA   6  27.427  -4.546   1.161
   34    HB2  ALA   6           HB2      ALA   6  27.016  -6.239   0.888
   35    HB3  ALA   6           HB3      ALA   6  27.298  -5.167  -0.484
   36    H    ASP   7           H        ASP   7  31.274  -6.859   1.105
   37    HA   ASP   7           HA       ASP   7  30.217  -8.504   3.283
   38    HB2  ASP   7           HB2      ASP   7  33.037  -8.539   2.197
   39    HB3  ASP   7           HB3      ASP   7  32.214  -9.797   3.115
   40    HA   PRO   8           HA       PRO   8  31.539  -6.195   6.807
   41    HB2  PRO   8           HB2      PRO   8  33.795  -8.173   6.929
   42    HB3  PRO   8           HB3      PRO   8  32.803  -7.528   8.242
   43    HG2  PRO   8           HG2      PRO   8  32.348  -9.957   7.083
   44    HG3  PRO   8           HG3      PRO   8  31.077  -8.976   7.829
   45    HD2  PRO   8           HD2      PRO   8  31.439  -9.646   5.031
   46    HD3  PRO   8           HD3      PRO   8  30.092  -8.781   5.796
   47    H    ARG   9           H        ARG   9  34.431  -7.471   5.144
   48    HA   ARG   9           HA       ARG   9  36.069  -5.262   5.522
   49    HE   ARG   9           HE       ARG   9  38.609  -9.771   4.513
   50    HB2  ARG   9           HB2      ARG   9  36.044  -7.260   3.255
   51    HB3  ARG   9           HB3      ARG   9  37.382  -6.175   3.633
   52    HG2  ARG   9           HG2      ARG   9  38.198  -7.764   4.945
   53    HG3  ARG   9           HG3      ARG   9  36.830  -7.494   6.025
   54    HD2  ARG   9           HD2      ARG   9  35.976  -9.484   5.528
   55    HD3  ARG   9           HD3      ARG   9  36.028  -9.125   3.804
   56   HH11  ARG   9          HH11      ARG   9  35.495 -11.328   4.597
   57   HH12  ARG   9          HH12      ARG   9  36.143 -12.922   4.397
   58   HH21  ARG   9          HH21      ARG   9  39.471 -11.868   4.249
   59   HH22  ARG   9          HH22      ARG   9  38.401 -13.228   4.202
   60    H    LEU  10           H        LEU  10  34.135  -6.091   2.658
   61    HA   LEU  10           HA       LEU  10  34.789  -3.667   1.309
   62    HG   LEU  10           HG       LEU  10  34.199  -6.840  -0.650
   63    HB2  LEU  10           HB2      LEU  10  32.732  -5.787   0.725
   64    HB3  LEU  10           HB3      LEU  10  33.070  -4.435  -0.337
   65   HD11  LEU  10          HD11      LEU  10  36.238  -5.013  -1.342
   66   HD12  LEU  10          HD12      LEU  10  34.692  -4.189  -1.544
   67   HD13  LEU  10          HD13      LEU  10  34.992  -5.711  -2.378
   68   HD21  LEU  10          HD21      LEU  10  35.345  -6.902   1.466
   69   HD22  LEU  10          HD22      LEU  10  36.090  -5.334   1.154
   70   HD23  LEU  10          HD23      LEU  10  36.537  -6.732   0.176
   71    H    ILE  11           H        ILE  11  32.358  -4.581   3.547
   72    HA   ILE  11           HA       ILE  11  30.663  -2.314   2.858
   73    HB   ILE  11           HB       ILE  11  29.934  -4.717   3.784
   74   HG12  ILE  11          HG12      ILE  11  28.331  -3.117   3.026
   75   HG13  ILE  11          HG13      ILE  11  27.829  -3.631   4.634
   76   HG21  ILE  11          HG21      ILE  11  29.672  -3.273   6.355
   77   HG22  ILE  11          HG22      ILE  11  31.245  -3.972   5.971
   78   HG23  ILE  11          HG23      ILE  11  29.813  -5.001   6.029
   79   HD11  ILE  11          HD11      ILE  11  29.111  -1.534   5.434
   80   HD12  ILE  11          HD12      ILE  11  27.517  -1.352   4.703
   81   HD13  ILE  11          HD13      ILE  11  28.965  -1.019   3.754
   82    H    GLU  12           H        GLU  12  33.210  -3.211   4.850
   83    HA   GLU  12           HA       GLU  12  32.892  -0.950   6.684
   84    HB2  GLU  12           HB2      GLU  12  33.511  -3.248   7.532
   85    HB3  GLU  12           HB3      GLU  12  35.054  -3.058   6.710
   86    HG2  GLU  12           HG2      GLU  12  34.280  -0.868   8.519
   87    HG3  GLU  12           HG3      GLU  12  34.636  -2.418   9.281
   88    H    SER  13           H        SER  13  35.508  -2.390   4.745
   89    HA   SER  13           HA       SER  13  36.905   0.143   4.667
   90    HG   SER  13           HG       SER  13  37.767  -1.969   6.053
   91    HB2  SER  13           HB2      SER  13  37.606  -2.653   3.808
   92    HB3  SER  13           HB3      SER  13  38.643  -1.274   3.445
   93    H    LEU  14           H        LEU  14  35.246  -1.972   2.288
   94    HA   LEU  14           HA       LEU  14  36.239  -0.407   0.093
   95    HG   LEU  14           HG       LEU  14  34.642  -2.544  -2.373
   96    HB2  LEU  14           HB2      LEU  14  35.671  -2.713  -0.327
   97    HB3  LEU  14           HB3      LEU  14  34.016  -2.438   0.159
   98   HD11  LEU  14          HD11      LEU  14  32.569  -1.786  -2.692
   99   HD12  LEU  14          HD12      LEU  14  32.940  -0.211  -1.993
  100   HD13  LEU  14          HD13      LEU  14  32.517  -1.563  -0.943
  101   HD21  LEU  14          HD21      LEU  14  35.226  -0.466  -3.369
  102   HD22  LEU  14          HD22      LEU  14  36.410  -0.791  -2.103
  103   HD23  LEU  14          HD23      LEU  14  35.118   0.378  -1.823
  104    H    SER  15           H        SER  15  32.829  -0.836   1.168
  105    HA   SER  15           HA       SER  15  31.695   1.231  -0.190
  106    HG   SER  15           HG       SER  15  28.888   0.863   1.705
  107    HB2  SER  15           HB2      SER  15  30.816  -0.376   1.811
  108    HB3  SER  15           HB3      SER  15  30.947   1.150   2.684
  109    H    GLN  16           H        GLN  16  33.108   1.506   3.050
  110    HA   GLN  16           HA       GLN  16  33.037   4.159   3.525
  111    HB2  GLN  16           HB2      GLN  16  34.077   2.527   5.043
  112    HB3  GLN  16           HB3      GLN  16  35.445   2.373   3.951
  113    HG2  GLN  16           HG2      GLN  16  34.645   4.885   5.400
  114    HG3  GLN  16           HG3      GLN  16  35.931   3.789   5.892
  115   HE21  GLN  16          HE21      GLN  16  36.892   3.273   3.236
  116   HE22  GLN  16          HE22      GLN  16  37.688   4.708   2.694
  117    H    MET  17           H        MET  17  35.068   2.519   1.196
  118    HA   MET  17           HA       MET  17  36.584   4.898   0.574
  119    HB2  MET  17           HB2      MET  17  36.619   2.054  -0.306
  120    HB3  MET  17           HB3      MET  17  37.315   3.256  -1.384
  121    HG2  MET  17           HG2      MET  17  38.803   3.995   0.413
  122    HG3  MET  17           HG3      MET  17  38.114   2.768   1.473
  123    HE1  MET  17           HE1      MET  17  41.044   3.583  -0.685
  124    HE2  MET  17           HE2      MET  17  39.876   3.322  -1.980
  125    HE3  MET  17           HE3      MET  17  41.241   2.221  -1.789
  126    H    LEU  18           H        LEU  18  33.714   3.321  -0.604
  127    HA   LEU  18           HA       LEU  18  33.798   4.669  -3.166
  128    HG   LEU  18           HG       LEU  18  32.125   1.516  -3.852
  129    HB2  LEU  18           HB2      LEU  18  32.072   2.683  -1.845
  130    HB3  LEU  18           HB3      LEU  18  31.247   3.764  -2.953
  131   HD11  LEU  18          HD11      LEU  18  31.249   3.104  -5.369
  132   HD12  LEU  18          HD12      LEU  18  32.819   2.623  -6.013
  133   HD13  LEU  18          HD13      LEU  18  32.645   4.165  -5.176
  134   HD21  LEU  18          HD21      LEU  18  34.302   1.102  -3.783
  135   HD22  LEU  18          HD22      LEU  18  34.542   2.608  -2.896
  136   HD23  LEU  18          HD23      LEU  18  34.643   2.596  -4.656
  137    H    SER  19           H        SER  19  31.392   4.751  -0.521
  138    HA   SER  19           HA       SER  19  30.251   7.192  -1.443
  139    HG   SER  19           HG       SER  19  27.942   4.999  -0.051
  140    HB2  SER  19           HB2      SER  19  29.812   5.450   0.966
  141    HB3  SER  19           HB3      SER  19  29.011   7.014   0.817
  142    H    MET  20           H        MET  20  33.151   6.958  -0.202
  143    HA   MET  20           HA       MET  20  32.846   9.313   1.543
  144    HB2  MET  20           HB2      MET  20  33.829   7.269   2.621
  145    HB3  MET  20           HB3      MET  20  35.188   7.410   1.514
  146    HG2  MET  20           HG2      MET  20  36.151   8.676   3.054
  147    HG3  MET  20           HG3      MET  20  34.994   9.929   2.611
  148    HE1  MET  20           HE1      MET  20  32.511  10.302   4.752
  149    HE2  MET  20           HE2      MET  20  33.848  11.041   3.871
  150    HE3  MET  20           HE3      MET  20  33.884  10.974   5.633
  151    H    GLY  21           H        GLY  21  33.246   8.862  -1.483
  152    HA2  GLY  21           HA2      GLY  21  34.214  10.102  -3.163
  153    HA3  GLY  21           HA3      GLY  21  34.805  11.198  -1.916
  154    H    PHE  22           H        PHE  22  35.440   7.761  -2.503
  155    HA   PHE  22           HA       PHE  22  38.226   8.406  -3.080
  156    HD1  PHE  22           HD2      PHE  22  39.620   9.190  -1.964
  157    HD2  PHE  22           HD1      PHE  22  37.619   7.251   1.250
  158    HE1  PHE  22           HE2      PHE  22  40.478  10.892  -0.408
  159    HE2  PHE  22           HE1      PHE  22  38.470   8.949   2.813
  160    HZ   PHE  22           HZ       PHE  22  39.903  10.774   1.984
  161    HB2  PHE  22           HB2      PHE  22  37.229   6.550  -0.921
  162    HB3  PHE  22           HB3      PHE  22  38.837   6.376  -1.624
  163    H    SER  23           H        SER  23  39.271   6.843  -4.348
  164    HA   SER  23           HA       SER  23  37.694   4.582  -5.225
  165    HG   SER  23           HG       SER  23  37.312   7.674  -6.284
  166    HB2  SER  23           HB2      SER  23  38.828   6.416  -7.329
  167    HB3  SER  23           HB3      SER  23  37.622   5.143  -7.516
  168    H    ASP  24           H        ASP  24  39.420   4.187  -7.573
  169    HA   ASP  24           HA       ASP  24  41.880   3.451  -6.140
  170    HB2  ASP  24           HB2      ASP  24  42.159   1.764  -7.988
  171    HB3  ASP  24           HB3      ASP  24  40.750   1.495  -6.961
  172    H    GLU  25           H        GLU  25  43.531   4.748  -6.558
  173    HA   GLU  25           HA       GLU  25  43.562   6.387  -8.933
  174    HB2  GLU  25           HB2      GLU  25  44.582   6.659  -6.358
  175    HB3  GLU  25           HB3      GLU  25  46.008   6.456  -7.367
  176    HG2  GLU  25           HG2      GLU  25  44.435   8.251  -8.770
  177    HG3  GLU  25           HG3      GLU  25  44.247   8.729  -7.083
  178    H    GLY  26           H        GLY  26  43.629   3.838  -9.760
  179    HA2  GLY  26           HA2      GLY  26  45.277   3.468 -11.696
  180    HA3  GLY  26           HA3      GLY  26  46.445   3.270 -10.397
  181    H    GLY  27           H        GLY  27  43.453   2.068  -9.436
  182    HA2  GLY  27           HA2      GLY  27  42.509  -0.055  -9.483
  183    HA3  GLY  27           HA3      GLY  27  43.732  -0.542 -10.650
  184    H    TRP  28           H        TRP  28  44.323   0.948  -7.529
  185    HA   TRP  28           HA       TRP  28  45.903  -1.394  -6.794
  186    HD1  TRP  28           HD1      TRP  28  46.659   3.037  -7.110
  187    HE1  TRP  28           HE1      TRP  28  45.341   4.918  -5.971
  188    HE3  TRP  28           HE3      TRP  28  44.456   0.351  -3.374
  189    HZ2  TRP  28           HZ2      TRP  28  43.585   5.234  -3.793
  190    HZ3  TRP  28           HZ3      TRP  28  42.970   1.516  -1.799
  191    HH2  TRP  28           HH2      TRP  28  42.541   3.909  -2.008
  192    HB2  TRP  28           HB2      TRP  28  46.800   0.076  -4.967
  193    HB3  TRP  28           HB3      TRP  28  47.161   0.610  -6.608
  194    H    LEU  29           H        LEU  29  43.060   0.422  -5.753
  195    HA   LEU  29           HA       LEU  29  42.720  -0.311  -3.181
  196    HG   LEU  29           HG       LEU  29  40.008  -1.990  -4.062
  197    HB2  LEU  29           HB2      LEU  29  40.899   0.843  -3.855
  198    HB3  LEU  29           HB3      LEU  29  40.898   0.125  -5.453
  199   HD11  LEU  29          HD11      LEU  29  38.356  -1.083  -2.386
  200   HD12  LEU  29          HD12      LEU  29  39.275   0.423  -2.430
  201   HD13  LEU  29          HD13      LEU  29  40.049  -1.067  -1.890
  202   HD21  LEU  29          HD21      LEU  29  38.727   0.266  -5.440
  203   HD22  LEU  29          HD22      LEU  29  37.665  -0.705  -4.421
  204   HD23  LEU  29          HD23      LEU  29  38.582  -1.469  -5.719
  205    H    THR  30           H        THR  30  41.428  -2.323  -5.815
  206    HA   THR  30           HA       THR  30  40.790  -4.584  -4.471
  207    HB   THR  30           HB       THR  30  40.374  -4.726  -6.747
  208    HG1  THR  30           HG1      THR  30  42.747  -6.244  -6.427
  209   HG21  THR  30          HG21      THR  30  41.703  -3.052  -7.696
  210   HG22  THR  30          HG22      THR  30  42.217  -4.550  -8.472
  211   HG23  THR  30          HG23      THR  30  43.200  -3.837  -7.193
  212    H    ARG  31           H        ARG  31  43.972  -3.349  -5.056
  213    HA   ARG  31           HA       ARG  31  45.274  -5.746  -4.025
  214    HE   ARG  31           HE       ARG  31  48.671  -4.816  -7.669
  215    HB2  ARG  31           HB2      ARG  31  46.930  -3.389  -4.618
  216    HB3  ARG  31           HB3      ARG  31  47.125  -5.059  -5.128
  217    HG2  ARG  31           HG2      ARG  31  45.423  -4.729  -6.858
  218    HG3  ARG  31           HG3      ARG  31  45.244  -3.052  -6.350
  219    HD2  ARG  31           HD2      ARG  31  46.694  -2.859  -8.133
  220    HD3  ARG  31           HD3      ARG  31  47.801  -2.920  -6.763
  221   HH11  ARG  31          HH11      ARG  31  45.386  -4.486  -8.779
  222   HH12  ARG  31          HH12      ARG  31  45.456  -5.876  -9.810
  223   HH21  ARG  31          HH21      ARG  31  48.774  -6.654  -9.017
  224   HH22  ARG  31          HH22      ARG  31  47.383  -7.113  -9.940
  225    H    LEU  32           H        LEU  32  45.498  -2.228  -3.386
  226    HA   LEU  32           HA       LEU  32  46.920  -2.115  -1.111
  227    HG   LEU  32           HG       LEU  32  45.749   1.317  -0.623
  228    HB2  LEU  32           HB2      LEU  32  45.781  -0.243  -2.335
  229    HB3  LEU  32           HB3      LEU  32  44.314  -0.630  -1.449
  230   HD11  LEU  32          HD11      LEU  32  44.007   0.642   0.761
  231   HD12  LEU  32          HD12      LEU  32  45.432   0.581   1.798
  232   HD13  LEU  32          HD13      LEU  32  44.767  -0.905   1.126
  233   HD21  LEU  32          HD21      LEU  32  47.580   0.695   0.891
  234   HD22  LEU  32          HD22      LEU  32  47.913   0.273  -0.788
  235   HD23  LEU  32          HD23      LEU  32  47.432  -0.980   0.357
  236    H    LEU  33           H        LEU  33  43.347  -2.335  -0.905
  237    HA   LEU  33           HA       LEU  33  43.090  -2.858   1.765
  238    HG   LEU  33           HG       LEU  33  40.472  -2.670   2.036
  239    HB2  LEU  33           HB2      LEU  33  41.529  -3.558  -0.640
  240    HB3  LEU  33           HB3      LEU  33  41.199  -4.540   0.780
  241   HD11  LEU  33          HD11      LEU  33  41.485  -0.712   1.815
  242   HD12  LEU  33          HD12      LEU  33  40.620  -0.469   0.297
  243   HD13  LEU  33          HD13      LEU  33  42.216  -1.219   0.293
  244   HD21  LEU  33          HD21      LEU  33  39.459  -2.773  -0.773
  245   HD22  LEU  33          HD22      LEU  33  38.816  -1.581   0.356
  246   HD23  LEU  33          HD23      LEU  33  38.683  -3.302   0.719
  247    H    GLN  34           H        GLN  34  43.053  -5.453  -0.641
  248    HA   GLN  34           HA       GLN  34  43.358  -7.641   0.949
  249    HB2  GLN  34           HB2      GLN  34  43.667  -7.096  -1.777
  250    HB3  GLN  34           HB3      GLN  34  45.147  -7.919  -1.305
  251    HG2  GLN  34           HG2      GLN  34  44.067  -9.839  -1.488
  252    HG3  GLN  34           HG3      GLN  34  43.078  -9.363  -0.108
  253   HE21  GLN  34          HE21      GLN  34  41.385  -7.582  -0.913
  254   HE22  GLN  34          HE22      GLN  34  40.430  -8.112  -2.252
  255    H    THR  35           H        THR  35  46.042  -5.676  -0.326
  256    HA   THR  35           HA       THR  35  48.064  -7.043   1.164
  257    HB   THR  35           HB       THR  35  48.484  -4.270   0.134
  258    HG1  THR  35           HG1      THR  35  48.123  -4.793  -1.866
  259   HG21  THR  35          HG21      THR  35  50.089  -6.767   0.337
  260   HG22  THR  35          HG22      THR  35  50.499  -5.118   0.810
  261   HG23  THR  35          HG23      THR  35  50.489  -5.570  -0.895
  262    H    LYS  36           H        LYS  36  45.682  -5.200   2.196
  263    HA   LYS  36           HA       LYS  36  47.147  -4.230   4.542
  264    HB2  LYS  36           HB2      LYS  36  44.857  -2.750   3.236
  265    HB3  LYS  36           HB3      LYS  36  45.772  -2.232   4.646
  266    HG2  LYS  36           HG2      LYS  36  47.331  -2.755   2.196
  267    HG3  LYS  36           HG3      LYS  36  46.257  -1.355   2.166
  268    HD2  LYS  36           HD2      LYS  36  47.829  -0.219   3.254
  269    HD3  LYS  36           HD3      LYS  36  47.539  -1.260   4.650
  270    HE2  LYS  36           HE2      LYS  36  49.208  -2.845   3.790
  271    HE3  LYS  36           HE3      LYS  36  49.510  -1.772   2.423
  272    HZ1  LYS  36           HZ1      LYS  36  49.941  -0.062   4.342
  273    HZ2  LYS  36           HZ2      LYS  36  51.157  -1.123   3.834
  274    HZ3  LYS  36           HZ3      LYS  36  50.271  -1.462   5.234
  275    H    ASN  37           H        ASN  37  45.585  -6.654   3.909
  276    HA   ASN  37           HA       ASN  37  43.933  -7.969   4.765
  277    HB2  ASN  37           HB2      ASN  37  43.450  -6.981   7.323
  278    HB3  ASN  37           HB3      ASN  37  44.631  -8.216   6.889
  279   HD21  ASN  37          HD21      ASN  37  44.156  -5.160   8.204
  280   HD22  ASN  37          HD22      ASN  37  45.808  -4.659   8.285
  281    H    TYR  38           H        TYR  38  43.088  -5.797   3.225
  282    HA   TYR  38           HA       TYR  38  41.209  -4.642   2.639
  283    HD1  TYR  38           HD1      TYR  38  41.478  -8.199   3.380
  284    HD2  TYR  38           HD2      TYR  38  38.259  -6.037   1.630
  285    HE1  TYR  38           HE1      TYR  38  41.352  -9.862   1.571
  286    HE2  TYR  38           HE2      TYR  38  38.123  -7.694  -0.184
  287    HH   TYR  38           HH       TYR  38  40.432 -10.371  -0.405
  288    HB2  TYR  38           HB2      TYR  38  40.011  -6.518   4.685
  289    HB3  TYR  38           HB3      TYR  38  39.050  -5.396   3.729
  290    H    ASP  39           H        ASP  39  42.779  -3.160   4.057
  291    HA   ASP  39           HA       ASP  39  41.104  -1.928   6.149
  292    HB2  ASP  39           HB2      ASP  39  44.086  -2.229   5.931
  293    HB3  ASP  39           HB3      ASP  39  43.367  -0.973   6.940
  294    H    ILE  40           H        ILE  40  40.582   0.164   5.987
  295    HA   ILE  40           HA       ILE  40  41.328   1.559   3.563
  296    HB   ILE  40           HB       ILE  40  39.752   3.315   4.390
  297   HG12  ILE  40          HG12      ILE  40  40.135   2.326   6.847
  298   HG13  ILE  40          HG13      ILE  40  38.680   3.209   6.401
  299   HG21  ILE  40          HG21      ILE  40  38.808   0.491   4.031
  300   HG22  ILE  40          HG22      ILE  40  38.858   1.795   2.849
  301   HG23  ILE  40          HG23      ILE  40  37.688   1.846   4.167
  302   HD11  ILE  40          HD11      ILE  40  37.375   1.327   6.414
  303   HD12  ILE  40          HD12      ILE  40  38.536   0.941   7.684
  304   HD13  ILE  40          HD13      ILE  40  38.729   0.251   6.073
  305    H    GLY  41           H        GLY  41  42.035   1.465   6.921
  306    HA2  GLY  41           HA2      GLY  41  42.932   3.900   7.597
  307    HA3  GLY  41           HA3      GLY  41  43.793   2.448   8.059
  308    H    ALA  42           H        ALA  42  44.660   1.587   5.641
  309    HA   ALA  42           HA       ALA  42  46.724   3.554   5.036
  310    HB1  ALA  42           HB1      ALA  42  47.753   1.590   3.779
  311    HB2  ALA  42           HB2      ALA  42  46.495   0.602   4.521
  312    HB3  ALA  42           HB3      ALA  42  47.661   1.452   5.535
  313    H    ALA  43           H        ALA  43  43.864   2.248   3.731
  314    HA   ALA  43           HA       ALA  43  44.319   2.480   0.978
  315    HB1  ALA  43           HB1      ALA  43  42.278   1.474   1.927
  316    HB2  ALA  43           HB2      ALA  43  41.906   2.723   0.739
  317    HB3  ALA  43           HB3      ALA  43  41.752   3.071   2.460
  318    H    LEU  44           H        LEU  44  43.053   4.835   3.307
  319    HA   LEU  44           HA       LEU  44  42.672   7.047   1.761
  320    HG   LEU  44           HG       LEU  44  41.351   8.252   3.431
  321    HB2  LEU  44           HB2      LEU  44  43.658   6.649   4.544
  322    HB3  LEU  44           HB3      LEU  44  43.785   8.259   3.850
  323   HD11  LEU  44          HD11      LEU  44  40.232   6.363   4.975
  324   HD12  LEU  44          HD12      LEU  44  41.639   5.476   4.387
  325   HD13  LEU  44          HD13      LEU  44  40.494   6.174   3.241
  326   HD21  LEU  44          HD21      LEU  44  42.346   9.174   5.513
  327   HD22  LEU  44          HD22      LEU  44  42.021   7.631   6.303
  328   HD23  LEU  44          HD23      LEU  44  40.684   8.615   5.706
  329    H    ASP  45           H        ASP  45  45.686   6.398   3.496
  330    HA   ASP  45           HA       ASP  45  47.363   8.245   2.510
  331    HB2  ASP  45           HB2      ASP  45  48.277   6.788   4.090
  332    HB3  ASP  45           HB3      ASP  45  47.855   5.356   3.156
  333    H    THR  46           H        THR  46  46.189   5.488   0.663
  334    HA   THR  46           HA       THR  46  48.019   6.148  -1.514
  335    HB   THR  46           HB       THR  46  47.525   4.067  -2.460
  336    HG1  THR  46           HG1      THR  46  45.577   3.335  -2.474
  337   HG21  THR  46          HG21      THR  46  48.163   4.126   0.266
  338   HG22  THR  46          HG22      THR  46  48.462   2.831  -0.893
  339   HG23  THR  46          HG23      THR  46  46.976   2.839   0.057
  340    H    ILE  47           H        ILE  47  44.714   6.587  -0.660
  341    HA   ILE  47           HA       ILE  47  43.866   7.016  -3.393
  342    HB   ILE  47           HB       ILE  47  41.904   8.092  -1.647
  343   HG12  ILE  47          HG12      ILE  47  42.764   5.315  -0.823
  344   HG13  ILE  47          HG13      ILE  47  43.124   6.764   0.104
  345   HG21  ILE  47          HG21      ILE  47  41.897   5.411  -3.022
  346   HG22  ILE  47          HG22      ILE  47  41.657   6.941  -3.866
  347   HG23  ILE  47          HG23      ILE  47  40.512   6.430  -2.626
  348   HD11  ILE  47          HD11      ILE  47  40.349   5.838  -0.580
  349   HD12  ILE  47          HD12      ILE  47  40.799   7.163   0.494
  350   HD13  ILE  47          HD13      ILE  47  41.177   5.501   0.941
  351    H    GLN  48           H        GLN  48  44.693   9.046  -0.633
  352    HA   GLN  48           HA       GLN  48  45.231  11.251  -2.375
  353    HB2  GLN  48           HB2      GLN  48  42.689  11.171  -0.813
  354    HB3  GLN  48           HB3      GLN  48  43.541  12.705  -0.931
  355    HG2  GLN  48           HG2      GLN  48  42.651  13.052  -2.917
  356    HG3  GLN  48           HG3      GLN  48  43.407  11.584  -3.530
  357   HE21  GLN  48          HE21      GLN  48  42.193   9.752  -3.788
  358   HE22  GLN  48          HE22      GLN  48  40.472   9.706  -3.573
  359    H    TYR  49           H        TYR  49  44.164  10.825   0.978
  360    HA   TYR  49           HA       TYR  49  45.970  12.675   2.074
  361    HD1  TYR  49           HD2      TYR  49  42.482  11.085   1.954
  362    HD2  TYR  49           HD1      TYR  49  44.389  13.789   4.628
  363    HE1  TYR  49           HE2      TYR  49  40.507  12.544   1.873
  364    HE2  TYR  49           HE1      TYR  49  42.416  15.258   4.557
  365    HH   TYR  49           HH       TYR  49  39.742  14.722   3.987
  366    HB2  TYR  49           HB2      TYR  49  44.432  10.406   3.334
  367    HB3  TYR  49           HB3      TYR  49  45.319  11.620   4.252
  368    H    SER  50           H        SER  50  47.863  11.580   0.718
  369    HA   SER  50           HA       SER  50  49.117   9.453   2.287
  370    HG   SER  50           HG       SER  50  50.189  11.294  -0.916
  371    HB2  SER  50           HB2      SER  50  50.252   8.850   0.397
  372    HB3  SER  50           HB3      SER  50  48.907   9.679  -0.385
  373    H    LYS  51           H        LYS  51  49.009  11.924   3.577
  374    HA   LYS  51           HA       LYS  51  51.856  12.461   3.856
  375    HB2  LYS  51           HB2      LYS  51  50.234  14.200   2.375
  376    HB3  LYS  51           HB3      LYS  51  50.432  14.977   3.940
  377    HG2  LYS  51           HG2      LYS  51  52.232  15.818   2.815
  378    HG3  LYS  51           HG3      LYS  51  52.959  14.396   3.566
  379    HD2  LYS  51           HD2      LYS  51  52.032  13.336   1.251
  380    HD3  LYS  51           HD3      LYS  51  52.419  14.977   0.732
  381    HE2  LYS  51           HE2      LYS  51  54.664  14.613   1.913
  382    HE3  LYS  51           HE3      LYS  51  54.238  12.901   1.912
  383    HZ1  LYS  51           HZ1      LYS  51  54.407  14.615  -0.509
  384    HZ2  LYS  51           HZ2      LYS  51  54.083  12.955  -0.481
  385    HZ3  LYS  51           HZ3      LYS  51  55.602  13.527  -0.002
  386    H    HIS  52           H        HIS  52  51.091  11.149   5.766
  387    HA   HIS  52           HA       HIS  52  49.709  12.750   7.787
  388    HD1  HIS  52           HD1      HIS  52  48.341   8.941   9.725
  389    HD2  HIS  52           HD2      HIS  52  47.675  12.647   7.968
  390    HE1  HIS  52           HE1      HIS  52  46.032   9.670  10.456
  391    HB2  HIS  52           HB2      HIS  52  49.783   9.982   7.176
  392    HB3  HIS  52           HB3      HIS  52  50.505  10.180   8.770
  Start of MODEL   26
    1    H1   GLY   1           1H       GLY   1  27.068 -16.493   1.882
    2    H2   GLY   1           2H       GLY   1  27.699 -17.554   0.726
    3    H3   GLY   1           3H       GLY   1  26.055 -17.616   1.123
    4    HA2  GLY   1           HA2      GLY   1  27.335 -16.064  -0.845
    5    HA3  GLY   1           HA3      GLY   1  25.616 -16.232  -0.525
    6    H    SER   2           H        SER   2  28.503 -14.377   0.168
    7    HA   SER   2           HA       SER   2  26.903 -12.343   1.544
    8    HG   SER   2           HG       SER   2  27.973 -13.126   3.310
    9    HB2  SER   2           HB2      SER   2  29.893 -12.730   1.306
   10    HB3  SER   2           HB3      SER   2  29.148 -11.330   2.076
   11    HA   PRO   3           HA       PRO   3  26.607 -10.240  -2.419
   12    HB2  PRO   3           HB2      PRO   3  25.692  -8.083  -0.582
   13    HB3  PRO   3           HB3      PRO   3  24.930  -8.711  -2.047
   14    HG2  PRO   3           HG2      PRO   3  23.977  -9.341   0.358
   15    HG3  PRO   3           HG3      PRO   3  24.020 -10.541  -0.949
   16    HD2  PRO   3           HD2      PRO   3  25.803 -10.260   1.430
   17    HD3  PRO   3           HD3      PRO   3  25.206 -11.729   0.632
   18    HA   PRO   4           HA       PRO   4  30.444  -7.981  -2.104
   19    HB2  PRO   4           HB2      PRO   4  30.622  -7.225  -4.682
   20    HB3  PRO   4           HB3      PRO   4  30.894  -8.897  -4.175
   21    HG2  PRO   4           HG2      PRO   4  28.439  -7.655  -5.363
   22    HG3  PRO   4           HG3      PRO   4  29.208  -9.205  -5.755
   23    HD2  PRO   4           HD2      PRO   4  27.033  -9.000  -4.135
   24    HD3  PRO   4           HD3      PRO   4  28.254 -10.277  -3.957
   25    H    GLU   5           H        GLU   5  28.841  -6.469  -0.806
   26    HA   GLU   5           HA       GLU   5  29.369  -3.832  -1.627
   27    HB2  GLU   5           HB2      GLU   5  27.583  -4.279  -3.254
   28    HB3  GLU   5           HB3      GLU   5  26.492  -4.704  -1.942
   29    HG2  GLU   5           HG2      GLU   5  27.675  -2.080  -1.584
   30    HG3  GLU   5           HG3      GLU   5  26.782  -2.222  -3.098
   31    H    ALA   6           H        ALA   6  29.503  -5.581   0.703
   32    HA   ALA   6           HA       ALA   6  29.196  -3.908   2.780
   33    HB1  ALA   6           HB1      ALA   6  26.949  -3.434   2.555
   34    HB2  ALA   6           HB2      ALA   6  26.921  -4.741   3.739
   35    HB3  ALA   6           HB3      ALA   6  26.546  -5.075   2.049
   36    H    ASP   7           H        ASP   7  30.877  -5.919   2.337
   37    HA   ASP   7           HA       ASP   7  30.067  -8.095   4.142
   38    HB2  ASP   7           HB2      ASP   7  31.462  -9.542   2.995
   39    HB3  ASP   7           HB3      ASP   7  30.948  -8.470   1.699
   40    HA   PRO   8           HA       PRO   8  32.672  -6.971   7.490
   41    HB2  PRO   8           HB2      PRO   8  34.005  -9.614   7.082
   42    HB3  PRO   8           HB3      PRO   8  33.376  -8.891   8.566
   43    HG2  PRO   8           HG2      PRO   8  32.019 -10.802   7.297
   44    HG3  PRO   8           HG3      PRO   8  31.183  -9.440   8.064
   45    HD2  PRO   8           HD2      PRO   8  31.662  -9.990   5.183
   46    HD3  PRO   8           HD3      PRO   8  30.323  -9.125   5.962
   47    H    ARG   9           H        ARG   9  34.018  -7.980   4.456
   48    HA   ARG   9           HA       ARG   9  36.685  -7.064   5.180
   49    HE   ARG   9           HE       ARG   9  37.668 -11.257   1.593
   50    HB2  ARG   9           HB2      ARG   9  35.761  -8.171   2.533
   51    HB3  ARG   9           HB3      ARG   9  37.420  -7.988   3.094
   52    HG2  ARG   9           HG2      ARG   9  36.364  -9.554   5.044
   53    HG3  ARG   9           HG3      ARG   9  35.471 -10.103   3.624
   54    HD2  ARG   9           HD2      ARG   9  38.327  -9.734   3.145
   55    HD3  ARG   9           HD3      ARG   9  37.970 -10.953   4.368
   56   HH11  ARG   9          HH11      ARG   9  35.971 -11.909   4.559
   57   HH12  ARG   9          HH12      ARG   9  35.137 -13.292   3.931
   58   HH21  ARG   9          HH21      ARG   9  36.569 -13.074   0.750
   59   HH22  ARG   9          HH22      ARG   9  35.477 -13.953   1.766
   60    H    LEU  10           H        LEU  10  34.297  -6.340   2.610
   61    HA   LEU  10           HA       LEU  10  35.727  -3.868   2.077
   62    HG   LEU  10           HG       LEU  10  36.582  -5.288   0.477
   63    HB2  LEU  10           HB2      LEU  10  33.754  -5.486   0.497
   64    HB3  LEU  10           HB3      LEU  10  34.154  -3.836   0.053
   65   HD11  LEU  10          HD11      LEU  10  35.544  -7.337   0.022
   66   HD12  LEU  10          HD12      LEU  10  36.283  -6.844  -1.501
   67   HD13  LEU  10          HD13      LEU  10  34.547  -6.647  -1.259
   68   HD21  LEU  10          HD21      LEU  10  36.670  -3.411  -0.884
   69   HD22  LEU  10          HD22      LEU  10  35.250  -3.895  -1.814
   70   HD23  LEU  10          HD23      LEU  10  36.779  -4.749  -2.028
   71    H    ILE  11           H        ILE  11  33.108  -4.953   3.829
   72    HA   ILE  11           HA       ILE  11  31.244  -2.849   3.440
   73    HB   ILE  11           HB       ILE  11  30.818  -4.995   4.747
   74   HG12  ILE  11          HG12      ILE  11  30.120  -2.349   6.036
   75   HG13  ILE  11          HG13      ILE  11  29.214  -3.165   4.764
   76   HG21  ILE  11          HG21      ILE  11  31.663  -5.344   6.834
   77   HG22  ILE  11          HG22      ILE  11  31.823  -3.622   7.179
   78   HG23  ILE  11          HG23      ILE  11  32.998  -4.426   6.138
   79   HD11  ILE  11          HD11      ILE  11  29.477  -5.001   6.880
   80   HD12  ILE  11          HD12      ILE  11  28.020  -4.182   6.317
   81   HD13  ILE  11          HD13      ILE  11  29.004  -3.455   7.588
   82    H    GLU  12           H        GLU  12  34.190  -3.278   5.182
   83    HA   GLU  12           HA       GLU  12  34.009  -0.625   6.404
   84    HB2  GLU  12           HB2      GLU  12  35.092  -3.040   7.291
   85    HB3  GLU  12           HB3      GLU  12  36.491  -2.063   6.869
   86    HG2  GLU  12           HG2      GLU  12  36.188  -1.503   9.066
   87    HG3  GLU  12           HG3      GLU  12  35.285  -0.224   8.254
   88    H    SER  13           H        SER  13  36.198  -2.575   4.392
   89    HA   SER  13           HA       SER  13  37.923  -0.442   3.733
   90    HG   SER  13           HG       SER  13  39.589  -1.460   3.754
   91    HB2  SER  13           HB2      SER  13  37.625  -3.260   3.009
   92    HB3  SER  13           HB3      SER  13  38.285  -2.265   1.714
   93    H    LEU  14           H        LEU  14  35.220  -1.898   1.918
   94    HA   LEU  14           HA       LEU  14  35.591   0.016  -0.229
   95    HG   LEU  14           HG       LEU  14  32.843  -0.216  -1.478
   96    HB2  LEU  14           HB2      LEU  14  34.876  -2.310  -0.706
   97    HB3  LEU  14           HB3      LEU  14  33.387  -2.013   0.175
   98   HD11  LEU  14          HD11      LEU  14  35.038   0.318  -2.283
   99   HD12  LEU  14          HD12      LEU  14  34.071  -0.281  -3.631
  100   HD13  LEU  14          HD13      LEU  14  35.270  -1.328  -2.873
  101   HD21  LEU  14          HD21      LEU  14  32.585  -2.982  -1.683
  102   HD22  LEU  14          HD22      LEU  14  33.097  -2.449  -3.285
  103   HD23  LEU  14          HD23      LEU  14  31.652  -1.759  -2.545
  104    H    SER  15           H        SER  15  32.727  -0.903   1.700
  105    HA   SER  15           HA       SER  15  31.161   1.268   1.277
  106    HG   SER  15           HG       SER  15  29.437   0.917   2.046
  107    HB2  SER  15           HB2      SER  15  31.204  -0.810   3.145
  108    HB3  SER  15           HB3      SER  15  31.072   0.666   4.103
  109    H    GLN  16           H        GLN  16  34.197   1.420   2.778
  110    HA   GLN  16           HA       GLN  16  33.663   3.910   4.188
  111    HB2  GLN  16           HB2      GLN  16  35.194   2.471   5.319
  112    HB3  GLN  16           HB3      GLN  16  36.142   2.222   3.858
  113    HG2  GLN  16           HG2      GLN  16  35.863   4.905   5.158
  114    HG3  GLN  16           HG3      GLN  16  37.119   3.756   5.613
  115   HE21  GLN  16          HE21      GLN  16  36.558   6.397   3.822
  116   HE22  GLN  16          HE22      GLN  16  37.735   6.188   2.572
  117    H    MET  17           H        MET  17  35.315   2.694   1.334
  118    HA   MET  17           HA       MET  17  36.019   5.419   0.516
  119    HB2  MET  17           HB2      MET  17  37.009   2.695  -0.180
  120    HB3  MET  17           HB3      MET  17  37.152   3.960  -1.392
  121    HG2  MET  17           HG2      MET  17  38.134   5.212   0.809
  122    HG3  MET  17           HG3      MET  17  38.637   3.546   1.093
  123    HE1  MET  17           HE1      MET  17  38.548   2.875  -2.154
  124    HE2  MET  17           HE2      MET  17  39.802   2.121  -1.169
  125    HE3  MET  17           HE3      MET  17  40.243   3.018  -2.623
  126    H    LEU  18           H        LEU  18  33.552   3.210   0.084
  127    HA   LEU  18           HA       LEU  18  33.042   3.538  -2.699
  128    HG   LEU  18           HG       LEU  18  30.294   2.516  -3.111
  129    HB2  LEU  18           HB2      LEU  18  32.179   1.787  -0.879
  130    HB3  LEU  18           HB3      LEU  18  30.825   2.901  -0.830
  131   HD11  LEU  18          HD11      LEU  18  31.796   0.799  -4.370
  132   HD12  LEU  18          HD12      LEU  18  33.032   1.335  -3.231
  133   HD13  LEU  18          HD13      LEU  18  32.259   2.500  -4.308
  134   HD21  LEU  18          HD21      LEU  18  30.968   0.014  -1.598
  135   HD22  LEU  18          HD22      LEU  18  30.178  -0.036  -3.173
  136   HD23  LEU  18          HD23      LEU  18  29.396   0.782  -1.821
  137    H    SER  19           H        SER  19  31.003   4.634   0.019
  138    HA   SER  19           HA       SER  19  29.909   6.733  -1.651
  139    HG   SER  19           HG       SER  19  29.893   6.467   1.932
  140    HB2  SER  19           HB2      SER  19  28.119   6.670  -0.274
  141    HB3  SER  19           HB3      SER  19  28.833   5.179   0.339
  142    H    MET  20           H        MET  20  32.688   6.534  -0.097
  143    HA   MET  20           HA       MET  20  32.607   9.134   1.227
  144    HB2  MET  20           HB2      MET  20  33.771   7.311   2.364
  145    HB3  MET  20           HB3      MET  20  34.834   7.098   0.980
  146    HG2  MET  20           HG2      MET  20  36.050   8.284   2.620
  147    HG3  MET  20           HG3      MET  20  35.637   9.439   1.357
  148    HE1  MET  20           HE1      MET  20  34.949   7.893   4.585
  149    HE2  MET  20           HE2      MET  20  33.744   8.881   5.412
  150    HE3  MET  20           HE3      MET  20  35.449   9.331   5.477
  151    H    GLY  21           H        GLY  21  33.014   7.982  -1.840
  152    HA2  GLY  21           HA2      GLY  21  33.607   9.106  -3.764
  153    HA3  GLY  21           HA3      GLY  21  34.084  10.478  -2.768
  154    H    PHE  22           H        PHE  22  35.264   7.123  -2.616
  155    HA   PHE  22           HA       PHE  22  37.872   8.071  -3.569
  156    HD1  PHE  22           HD2      PHE  22  38.435   9.596  -2.526
  157    HD2  PHE  22           HD1      PHE  22  37.838   7.303   1.009
  158    HE1  PHE  22           HE2      PHE  22  38.699  11.629  -1.167
  159    HE2  PHE  22           HE1      PHE  22  38.100   9.330   2.376
  160    HZ   PHE  22           HZ       PHE  22  38.533  11.498   1.289
  161    HB2  PHE  22           HB2      PHE  22  37.353   6.373  -1.118
  162    HB3  PHE  22           HB3      PHE  22  38.943   6.641  -1.828
  163    H    SER  23           H        SER  23  38.946   6.634  -4.849
  164    HA   SER  23           HA       SER  23  37.799   3.960  -5.083
  165    HG   SER  23           HG       SER  23  35.883   4.825  -7.286
  166    HB2  SER  23           HB2      SER  23  38.407   5.746  -7.454
  167    HB3  SER  23           HB3      SER  23  37.822   4.084  -7.536
  168    H    ASP  24           H        ASP  24  39.309   2.714  -6.828
  169    HA   ASP  24           HA       ASP  24  41.918   2.692  -5.633
  170    HB2  ASP  24           HB2      ASP  24  42.365   0.791  -7.014
  171    HB3  ASP  24           HB3      ASP  24  40.685   0.652  -6.496
  172    H    GLU  25           H        GLU  25  43.497   4.070  -6.160
  173    HA   GLU  25           HA       GLU  25  43.347   5.514  -8.670
  174    HB2  GLU  25           HB2      GLU  25  43.921   6.561  -6.418
  175    HB3  GLU  25           HB3      GLU  25  45.500   5.808  -6.585
  176    HG2  GLU  25           HG2      GLU  25  46.197   7.452  -7.875
  177    HG3  GLU  25           HG3      GLU  25  44.865   7.187  -8.998
  178    H    GLY  26           H        GLY  26  43.891   2.765  -9.021
  179    HA2  GLY  26           HA2      GLY  26  45.707   2.646 -10.976
  180    HA3  GLY  26           HA3      GLY  26  46.747   2.571  -9.562
  181    H    GLY  27           H        GLY  27  43.736   1.006  -9.042
  182    HA2  GLY  27           HA2      GLY  27  43.101  -1.217  -9.159
  183    HA3  GLY  27           HA3      GLY  27  44.486  -1.517 -10.200
  184    H    TRP  28           H        TRP  28  44.908   0.074  -7.192
  185    HA   TRP  28           HA       TRP  28  46.448  -2.205  -6.199
  186    HD1  TRP  28           HD1      TRP  28  46.963   2.047  -7.180
  187    HE1  TRP  28           HE1      TRP  28  45.521   4.009  -6.386
  188    HE3  TRP  28           HE3      TRP  28  45.053   0.004  -2.909
  189    HZ2  TRP  28           HZ2      TRP  28  43.807   4.630  -4.243
  190    HZ3  TRP  28           HZ3      TRP  28  43.521   1.346  -1.538
  191    HH2  TRP  28           HH2      TRP  28  42.910   3.609  -2.193
  192    HB2  TRP  28           HB2      TRP  28  47.217  -0.504  -4.469
  193    HB3  TRP  28           HB3      TRP  28  47.698  -0.189  -6.140
  194    H    LEU  29           H        LEU  29  43.689  -0.172  -5.393
  195    HA   LEU  29           HA       LEU  29  43.135  -0.580  -2.821
  196    HG   LEU  29           HG       LEU  29  40.429  -2.370  -3.621
  197    HB2  LEU  29           HB2      LEU  29  41.376   0.466  -3.775
  198    HB3  LEU  29           HB3      LEU  29  41.421  -0.524  -5.219
  199   HD11  LEU  29          HD11      LEU  29  39.232  -1.639  -1.773
  200   HD12  LEU  29          HD12      LEU  29  39.288   0.049  -2.282
  201   HD13  LEU  29          HD13      LEU  29  40.741  -0.732  -1.656
  202   HD21  LEU  29          HD21      LEU  29  39.008  -0.057  -4.887
  203   HD22  LEU  29          HD22      LEU  29  38.123  -1.362  -4.096
  204   HD23  LEU  29          HD23      LEU  29  39.170  -1.713  -5.472
  205    H    THR  30           H        THR  30  41.945  -3.014  -5.155
  206    HA   THR  30           HA       THR  30  41.303  -5.009  -3.399
  207    HB   THR  30           HB       THR  30  41.561  -6.573  -5.193
  208    HG1  THR  30           HG1      THR  30  43.288  -6.467  -6.351
  209   HG21  THR  30          HG21      THR  30  39.868  -5.584  -6.216
  210   HG22  THR  30          HG22      THR  30  41.052  -4.731  -7.208
  211   HG23  THR  30          HG23      THR  30  40.432  -3.984  -5.736
  212    H    ARG  31           H        ARG  31  44.491  -4.192  -4.671
  213    HA   ARG  31           HA       ARG  31  45.857  -6.324  -3.329
  214    HE   ARG  31           HE       ARG  31  48.082  -6.556  -6.554
  215    HB2  ARG  31           HB2      ARG  31  47.368  -3.923  -4.177
  216    HB3  ARG  31           HB3      ARG  31  47.713  -5.623  -4.453
  217    HG2  ARG  31           HG2      ARG  31  45.892  -5.636  -6.163
  218    HG3  ARG  31           HG3      ARG  31  45.766  -3.891  -5.959
  219    HD2  ARG  31           HD2      ARG  31  47.169  -4.198  -7.818
  220    HD3  ARG  31           HD3      ARG  31  48.245  -3.797  -6.480
  221   HH11  ARG  31          HH11      ARG  31  49.156  -3.988  -8.646
  222   HH12  ARG  31          HH12      ARG  31  50.355  -4.957  -9.437
  223   HH21  ARG  31          HH21      ARG  31  49.652  -7.843  -7.590
  224   HH22  ARG  31          HH22      ARG  31  50.633  -7.151  -8.836
  225    H    LEU  32           H        LEU  32  46.183  -2.765  -2.960
  226    HA   LEU  32           HA       LEU  32  47.593  -2.543  -0.680
  227    HG   LEU  32           HG       LEU  32  46.429   0.946  -0.401
  228    HB2  LEU  32           HB2      LEU  32  46.439  -0.730  -2.043
  229    HB3  LEU  32           HB3      LEU  32  45.011  -1.025  -1.065
  230   HD11  LEU  32          HD11      LEU  32  45.316  -1.139   1.282
  231   HD12  LEU  32          HD12      LEU  32  45.170   0.612   1.396
  232   HD13  LEU  32          HD13      LEU  32  46.568  -0.201   2.095
  233   HD21  LEU  32          HD21      LEU  32  48.603  -0.139  -0.789
  234   HD22  LEU  32          HD22      LEU  32  48.305  -1.189   0.597
  235   HD23  LEU  32          HD23      LEU  32  48.464   0.553   0.827
  236    H    LEU  33           H        LEU  33  44.088  -3.092  -0.803
  237    HA   LEU  33           HA       LEU  33  43.463  -3.358   1.854
  238    HG   LEU  33           HG       LEU  33  41.841  -2.550  -0.620
  239    HB2  LEU  33           HB2      LEU  33  42.521  -4.861  -0.586
  240    HB3  LEU  33           HB3      LEU  33  41.784  -5.101   0.987
  241   HD11  LEU  33          HD11      LEU  33  39.249  -3.112   0.008
  242   HD12  LEU  33          HD12      LEU  33  39.923  -4.721  -0.254
  243   HD13  LEU  33          HD13      LEU  33  40.036  -3.500  -1.523
  244   HD21  LEU  33          HD21      LEU  33  40.133  -2.135   1.477
  245   HD22  LEU  33          HD22      LEU  33  41.775  -1.506   1.353
  246   HD23  LEU  33          HD23      LEU  33  41.468  -3.001   2.238
  247    H    GLN  34           H        GLN  34  44.155  -6.030  -0.280
  248    HA   GLN  34           HA       GLN  34  44.428  -8.174   1.286
  249    HB2  GLN  34           HB2      GLN  34  45.638  -7.307  -1.177
  250    HB3  GLN  34           HB3      GLN  34  46.725  -8.372  -0.294
  251    HG2  GLN  34           HG2      GLN  34  45.592  -9.968  -1.404
  252    HG3  GLN  34           HG3      GLN  34  44.456  -9.775  -0.070
  253   HE21  GLN  34          HE21      GLN  34  42.442  -9.104  -0.479
  254   HE22  GLN  34          HE22      GLN  34  41.852  -8.648  -2.038
  255    H    THR  35           H        THR  35  47.093  -5.822   0.880
  256    HA   THR  35           HA       THR  35  48.743  -7.129   2.846
  257    HB   THR  35           HB       THR  35  49.414  -4.353   2.129
  258    HG1  THR  35           HG1      THR  35  49.209  -4.561   0.069
  259   HG21  THR  35          HG21      THR  35  50.857  -6.412   3.070
  260   HG22  THR  35          HG22      THR  35  51.541  -5.070   2.154
  261   HG23  THR  35          HG23      THR  35  51.154  -6.587   1.340
  262    H    LYS  36           H        LYS  36  46.100  -5.444   3.165
  263    HA   LYS  36           HA       LYS  36  46.819  -4.403   5.821
  264    HB2  LYS  36           HB2      LYS  36  44.725  -3.029   4.172
  265    HB3  LYS  36           HB3      LYS  36  45.633  -2.412   5.545
  266    HG2  LYS  36           HG2      LYS  36  47.236  -3.134   3.189
  267    HG3  LYS  36           HG3      LYS  36  46.139  -1.769   2.986
  268    HD2  LYS  36           HD2      LYS  36  47.936  -0.641   3.810
  269    HD3  LYS  36           HD3      LYS  36  47.181  -1.093   5.339
  270    HE2  LYS  36           HE2      LYS  36  49.035  -3.075   4.192
  271    HE3  LYS  36           HE3      LYS  36  49.770  -1.566   4.733
  272    HZ1  LYS  36           HZ1      LYS  36  49.593  -2.230   6.823
  273    HZ2  LYS  36           HZ2      LYS  36  49.008  -3.726   6.292
  274    HZ3  LYS  36           HZ3      LYS  36  47.927  -2.480   6.664
  275    H    ASN  37           H        ASN  37  45.614  -6.925   4.871
  276    HA   ASN  37           HA       ASN  37  43.817  -8.291   5.267
  277    HB2  ASN  37           HB2      ASN  37  43.028  -8.268   7.561
  278    HB3  ASN  37           HB3      ASN  37  44.762  -7.942   7.554
  279   HD21  ASN  37          HD21      ASN  37  41.598  -6.632   8.095
  280   HD22  ASN  37          HD22      ASN  37  42.106  -5.173   8.866
  281    H    TYR  38           H        TYR  38  43.312  -5.982   3.708
  282    HA   TYR  38           HA       TYR  38  41.524  -4.983   2.705
  283    HD1  TYR  38           HD2      TYR  38  41.017  -8.517   2.698
  284    HD2  TYR  38           HD1      TYR  38  38.478  -5.243   1.732
  285    HE1  TYR  38           HE2      TYR  38  40.549  -9.534   0.507
  286    HE2  TYR  38           HE1      TYR  38  38.003  -6.250  -0.461
  287    HH   TYR  38           HH       TYR  38  39.722  -9.072  -1.597
  288    HB2  TYR  38           HB2      TYR  38  40.214  -6.986   4.424
  289    HB3  TYR  38           HB3      TYR  38  39.209  -5.602   4.004
  290    H    ASP  39           H        ASP  39  42.912  -3.386   4.161
  291    HA   ASP  39           HA       ASP  39  40.948  -1.877   5.766
  292    HB2  ASP  39           HB2      ASP  39  42.545  -2.755   7.308
  293    HB3  ASP  39           HB3      ASP  39  43.893  -2.273   6.274
  294    H    ILE  40           H        ILE  40  40.554   0.138   5.183
  295    HA   ILE  40           HA       ILE  40  41.957   1.264   2.946
  296    HB   ILE  40           HB       ILE  40  40.338   3.091   3.106
  297   HG12  ILE  40          HG12      ILE  40  40.278   2.604   5.761
  298   HG13  ILE  40          HG13      ILE  40  39.025   3.507   4.921
  299   HG21  ILE  40          HG21      ILE  40  38.216   1.459   3.127
  300   HG22  ILE  40          HG22      ILE  40  39.504   0.262   2.982
  301   HG23  ILE  40          HG23      ILE  40  39.355   1.546   1.783
  302   HD11  ILE  40          HD11      ILE  40  38.446   1.545   6.564
  303   HD12  ILE  40          HD12      ILE  40  38.736   0.558   5.132
  304   HD13  ILE  40          HD13      ILE  40  37.503   1.820   5.099
  305    H    GLY  41           H        GLY  41  42.101   1.349   6.340
  306    HA2  GLY  41           HA2      GLY  41  42.833   3.800   7.106
  307    HA3  GLY  41           HA3      GLY  41  43.686   2.373   7.665
  308    H    ALA  42           H        ALA  42  44.701   1.585   5.248
  309    HA   ALA  42           HA       ALA  42  46.837   3.543   4.870
  310    HB1  ALA  42           HB1      ALA  42  48.188   1.775   4.901
  311    HB2  ALA  42           HB2      ALA  42  47.397   1.153   3.452
  312    HB3  ALA  42           HB3      ALA  42  46.793   0.706   5.048
  313    H    ALA  43           H        ALA  43  44.303   1.852   3.195
  314    HA   ALA  43           HA       ALA  43  44.993   2.378   0.546
  315    HB1  ALA  43           HB1      ALA  43  42.175   2.547   1.601
  316    HB2  ALA  43           HB2      ALA  43  43.020   1.022   1.336
  317    HB3  ALA  43           HB3      ALA  43  42.699   2.101  -0.021
  318    H    LEU  44           H        LEU  44  43.579   4.444   2.995
  319    HA   LEU  44           HA       LEU  44  42.785   6.608   1.449
  320    HG   LEU  44           HG       LEU  44  41.159   7.413   3.160
  321    HB2  LEU  44           HB2      LEU  44  43.753   6.317   4.259
  322    HB3  LEU  44           HB3      LEU  44  43.511   7.926   3.596
  323   HD11  LEU  44          HD11      LEU  44  41.648   4.916   2.870
  324   HD12  LEU  44          HD12      LEU  44  40.140   5.376   3.662
  325   HD13  LEU  44          HD13      LEU  44  41.509   4.823   4.626
  326   HD21  LEU  44          HD21      LEU  44  40.655   6.792   5.722
  327   HD22  LEU  44          HD22      LEU  44  41.168   8.394   5.194
  328   HD23  LEU  44          HD23      LEU  44  42.349   7.264   5.856
  329    H    ASP  45           H        ASP  45  45.793   6.350   3.281
  330    HA   ASP  45           HA       ASP  45  47.234   8.438   2.542
  331    HB2  ASP  45           HB2      ASP  45  48.242   6.802   3.929
  332    HB3  ASP  45           HB3      ASP  45  48.164   5.580   2.663
  333    H    THR  46           H        THR  46  46.378   5.856   0.358
  334    HA   THR  46           HA       THR  46  48.097   6.924  -1.735
  335    HB   THR  46           HB       THR  46  47.563   4.873  -2.971
  336    HG1  THR  46           HG1      THR  46  45.649   4.153  -2.406
  337   HG21  THR  46          HG21      THR  46  48.456   3.210  -1.296
  338   HG22  THR  46          HG22      THR  46  48.487   4.540  -0.138
  339   HG23  THR  46          HG23      THR  46  49.457   4.628  -1.608
  340    H    ILE  47           H        ILE  47  44.614   6.445  -1.184
  341    HA   ILE  47           HA       ILE  47  43.757   6.918  -3.809
  342    HB   ILE  47           HB       ILE  47  41.645   7.903  -2.539
  343   HG12  ILE  47          HG12      ILE  47  42.842   6.172  -0.392
  344   HG13  ILE  47          HG13      ILE  47  43.066   7.917  -0.399
  345   HG21  ILE  47          HG21      ILE  47  40.732   5.926  -3.028
  346   HG22  ILE  47          HG22      ILE  47  41.839   5.056  -1.973
  347   HG23  ILE  47          HG23      ILE  47  42.333   5.477  -3.610
  348   HD11  ILE  47          HD11      ILE  47  40.944   6.479   0.687
  349   HD12  ILE  47          HD12      ILE  47  40.295   7.270  -0.748
  350   HD13  ILE  47          HD13      ILE  47  41.075   8.228   0.508
  351    H    GLN  48           H        GLN  48  44.284   9.255  -1.189
  352    HA   GLN  48           HA       GLN  48  44.699  11.347  -3.120
  353    HB2  GLN  48           HB2      GLN  48  42.296  11.428  -1.291
  354    HB3  GLN  48           HB3      GLN  48  42.953  12.849  -2.091
  355    HG2  GLN  48           HG2      GLN  48  41.373  12.322  -3.610
  356    HG3  GLN  48           HG3      GLN  48  42.665  11.291  -4.225
  357   HE21  GLN  48          HE21      GLN  48  40.863  10.109  -5.175
  358   HE22  GLN  48          HE22      GLN  48  40.052   8.912  -4.219
  359    H    TYR  49           H        TYR  49  43.982  10.675   0.286
  360    HA   TYR  49           HA       TYR  49  45.555  12.811   1.295
  361    HD1  TYR  49           HD1      TYR  49  42.415  10.996   1.303
  362    HD2  TYR  49           HD2      TYR  49  44.207  13.225   4.451
  363    HE1  TYR  49           HE1      TYR  49  40.283  12.160   1.681
  364    HE2  TYR  49           HE2      TYR  49  42.080  14.396   4.841
  365    HH   TYR  49           HH       TYR  49  40.028  14.939   3.632
  366    HB2  TYR  49           HB2      TYR  49  44.561  10.250   2.569
  367    HB3  TYR  49           HB3      TYR  49  45.416  11.510   3.458
  368    H    SER  50           H        SER  50  47.710  12.944   1.200
  369    HA   SER  50           HA       SER  50  49.298  10.523   1.616
  370    HG   SER  50           HG       SER  50  48.335  10.079  -0.727
  371    HB2  SER  50           HB2      SER  50  50.007  12.368  -0.661
  372    HB3  SER  50           HB3      SER  50  50.578  10.729  -0.352
  373    H    LYS  51           H        LYS  51  48.789  12.734   3.315
  374    HA   LYS  51           HA       LYS  51  51.300  13.367   4.275
  375    HB2  LYS  51           HB2      LYS  51  51.226  15.891   3.625
  376    HB3  LYS  51           HB3      LYS  51  51.895  14.727   2.490
  377    HG2  LYS  51           HG2      LYS  51  50.317  15.133   0.968
  378    HG3  LYS  51           HG3      LYS  51  49.026  15.119   2.171
  379    HD2  LYS  51           HD2      LYS  51  49.619  17.406   2.825
  380    HD3  LYS  51           HD3      LYS  51  50.901  17.417   1.611
  381    HE2  LYS  51           HE2      LYS  51  48.588  16.624   0.253
  382    HE3  LYS  51           HE3      LYS  51  48.081  17.939   1.314
  383    HZ1  LYS  51           HZ1      LYS  51  50.102  17.984  -0.837
  384    HZ2  LYS  51           HZ2      LYS  51  50.113  19.148   0.390
  385    HZ3  LYS  51           HZ3      LYS  51  48.764  18.997  -0.618
  386    H    HIS  52           H        HIS  52  49.387  12.633   5.752
  387    HA   HIS  52           HA       HIS  52  47.841  13.091   7.373
  388    HD1  HIS  52           HD1      HIS  52  48.795  11.882   8.691
  389    HD2  HIS  52           HD2      HIS  52  49.450  15.300  10.958
  390    HE1  HIS  52           HE1      HIS  52  48.836  11.132  11.106
  391    HB2  HIS  52           HB2      HIS  52  50.195  14.660   7.754
  392    HB3  HIS  52           HB3      HIS  52  48.808  15.610   8.280
  Start of MODEL   27
    1    H1   GLY   1           1H       GLY   1  32.027 -18.484  -3.860
    2    H2   GLY   1           2H       GLY   1  33.490 -19.292  -3.599
    3    H3   GLY   1           3H       GLY   1  33.228 -18.467  -5.053
    4    HA2  GLY   1           HA2      GLY   1  34.033 -17.454  -2.453
    5    HA3  GLY   1           HA3      GLY   1  34.431 -16.863  -4.059
    6    H    SER   2           H        SER   2  31.474 -17.267  -2.102
    7    HA   SER   2           HA       SER   2  30.566 -14.656  -3.075
    8    HG   SER   2           HG       SER   2  28.991 -15.506  -4.252
    9    HB2  SER   2           HB2      SER   2  29.160 -17.031  -1.888
   10    HB3  SER   2           HB3      SER   2  28.388 -15.447  -1.891
   11    HA   PRO   3           HA       PRO   3  31.685 -13.149   0.999
   12    HB2  PRO   3           HB2      PRO   3  31.599 -10.541   0.404
   13    HB3  PRO   3           HB3      PRO   3  32.899 -11.579  -0.192
   14    HG2  PRO   3           HG2      PRO   3  30.472 -10.573  -1.619
   15    HG3  PRO   3           HG3      PRO   3  32.135 -10.736  -2.210
   16    HD2  PRO   3           HD2      PRO   3  30.105 -12.543  -2.711
   17    HD3  PRO   3           HD3      PRO   3  31.836 -12.922  -2.785
   18    HA   PRO   4           HA       PRO   4  27.988 -11.941   3.031
   19    HB2  PRO   4           HB2      PRO   4  29.223  -9.555   4.209
   20    HB3  PRO   4           HB3      PRO   4  28.643 -11.024   4.998
   21    HG2  PRO   4           HG2      PRO   4  31.264 -10.495   4.775
   22    HG3  PRO   4           HG3      PRO   4  30.632 -12.150   4.666
   23    HD2  PRO   4           HD2      PRO   4  31.477 -10.301   2.456
   24    HD3  PRO   4           HD3      PRO   4  31.800 -12.033   2.660
   25    H    GLU   5           H        GLU   5  28.701 -10.317   0.438
   26    HA   GLU   5           HA       GLU   5  27.849  -8.556  -0.750
   27    HB2  GLU   5           HB2      GLU   5  25.971 -10.149  -0.732
   28    HB3  GLU   5           HB3      GLU   5  25.374  -9.423   0.753
   29    HG2  GLU   5           HG2      GLU   5  24.176  -8.689  -1.287
   30    HG3  GLU   5           HG3      GLU   5  24.887  -7.371  -0.355
   31    H    ALA   6           H        ALA   6  29.136  -7.069   0.520
   32    HA   ALA   6           HA       ALA   6  29.160  -4.863   1.264
   33    HB1  ALA   6           HB1      ALA   6  27.261  -3.741   2.028
   34    HB2  ALA   6           HB2      ALA   6  26.482  -5.228   2.570
   35    HB3  ALA   6           HB3      ALA   6  26.610  -4.875   0.846
   36    H    ASP   7           H        ASP   7  30.361  -6.954   2.352
   37    HA   ASP   7           HA       ASP   7  29.810  -7.352   5.111
   38    HB2  ASP   7           HB2      ASP   7  31.740  -8.722   5.145
   39    HB3  ASP   7           HB3      ASP   7  31.024  -8.959   3.557
   40    HA   PRO   8           HA       PRO   8  31.661  -4.073   7.287
   41    HB2  PRO   8           HB2      PRO   8  33.667  -6.154   8.127
   42    HB3  PRO   8           HB3      PRO   8  32.875  -4.909   9.107
   43    HG2  PRO   8           HG2      PRO   8  31.978  -7.414   9.162
   44    HG3  PRO   8           HG3      PRO   8  30.841  -6.053   9.153
   45    HD2  PRO   8           HD2      PRO   8  31.519  -7.964   6.983
   46    HD3  PRO   8           HD3      PRO   8  30.010  -7.070   7.255
   47    H    ARG   9           H        ARG   9  33.985  -6.320   5.802
   48    HA   ARG   9           HA       ARG   9  36.077  -4.534   5.394
   49    HE   ARG   9           HE       ARG   9  37.734  -9.370   4.433
   50    HB2  ARG   9           HB2      ARG   9  35.192  -6.987   3.884
   51    HB3  ARG   9           HB3      ARG   9  36.655  -6.103   3.470
   52    HG2  ARG   9           HG2      ARG   9  37.771  -7.234   5.004
   53    HG3  ARG   9           HG3      ARG   9  36.708  -6.594   6.257
   54    HD2  ARG   9           HD2      ARG   9  36.280  -8.801   6.562
   55    HD3  ARG   9           HD3      ARG   9  35.100  -8.485   5.291
   56   HH11  ARG   9          HH11      ARG   9  34.420 -10.204   5.119
   57   HH12  ARG   9          HH12      ARG   9  34.475 -11.688   4.229
   58   HH21  ARG   9          HH21      ARG   9  37.814 -11.329   3.265
   59   HH22  ARG   9          HH22      ARG   9  36.403 -12.329   3.182
   60    H    LEU  10           H        LEU  10  33.224  -5.187   3.417
   61    HA   LEU  10           HA       LEU  10  34.099  -3.246   1.427
   62    HG   LEU  10           HG       LEU  10  33.178  -6.565   0.045
   63    HB2  LEU  10           HB2      LEU  10  31.936  -5.327   1.461
   64    HB3  LEU  10           HB3      LEU  10  32.048  -4.117   0.197
   65   HD11  LEU  10          HD11      LEU  10  33.392  -4.048  -1.328
   66   HD12  LEU  10          HD12      LEU  10  33.419  -5.689  -1.978
   67   HD13  LEU  10          HD13      LEU  10  34.912  -4.939  -1.414
   68   HD21  LEU  10          HD21      LEU  10  35.590  -6.353   0.359
   69   HD22  LEU  10          HD22      LEU  10  34.734  -6.136   1.885
   70   HD23  LEU  10          HD23      LEU  10  35.371  -4.735   1.024
   71    H    ILE  11           H        ILE  11  31.533  -3.727   3.806
   72    HA   ILE  11           HA       ILE  11  30.256  -1.265   2.911
   73    HB   ILE  11           HB       ILE  11  28.855  -3.256   3.537
   74   HG12  ILE  11          HG12      ILE  11  28.511  -0.633   4.989
   75   HG13  ILE  11          HG13      ILE  11  27.762  -1.143   3.480
   76   HG21  ILE  11          HG21      ILE  11  30.208  -2.769   6.137
   77   HG22  ILE  11          HG22      ILE  11  29.749  -4.286   5.367
   78   HG23  ILE  11          HG23      ILE  11  28.528  -3.297   6.164
   79   HD11  ILE  11          HD11      ILE  11  26.783  -3.028   5.097
   80   HD12  ILE  11          HD12      ILE  11  25.999  -1.469   4.845
   81   HD13  ILE  11          HD13      ILE  11  27.007  -1.728   6.268
   82    H    GLU  12           H        GLU  12  32.355  -2.441   5.302
   83    HA   GLU  12           HA       GLU  12  31.987  -0.017   6.941
   84    HB2  GLU  12           HB2      GLU  12  32.360  -2.482   7.849
   85    HB3  GLU  12           HB3      GLU  12  34.049  -2.023   7.700
   86    HG2  GLU  12           HG2      GLU  12  33.892  -1.053   9.681
   87    HG3  GLU  12           HG3      GLU  12  32.798   0.131   8.964
   88    H    SER  13           H        SER  13  34.817  -1.777   5.639
   89    HA   SER  13           HA       SER  13  36.389   0.633   5.790
   90    HG   SER  13           HG       SER  13  38.043  -1.911   7.045
   91    HB2  SER  13           HB2      SER  13  37.283  -1.960   4.556
   92    HB3  SER  13           HB3      SER  13  38.263  -0.716   5.334
   93    H    LEU  14           H        LEU  14  34.933  -1.273   3.141
   94    HA   LEU  14           HA       LEU  14  36.388   0.193   1.148
   95    HG   LEU  14           HG       LEU  14  35.419  -0.003  -1.146
   96    HB2  LEU  14           HB2      LEU  14  35.441  -2.132   0.854
   97    HB3  LEU  14           HB3      LEU  14  33.874  -1.381   0.675
   98   HD11  LEU  14          HD11      LEU  14  36.116  -2.419  -2.304
   99   HD12  LEU  14          HD12      LEU  14  36.642  -2.574  -0.626
  100   HD13  LEU  14          HD13      LEU  14  37.215  -1.227  -1.610
  101   HD21  LEU  14          HD21      LEU  14  34.088  -2.376  -2.220
  102   HD22  LEU  14          HD22      LEU  14  33.797  -0.666  -2.539
  103   HD23  LEU  14          HD23      LEU  14  33.089  -1.430  -1.116
  104    H    SER  15           H        SER  15  32.996   0.279   2.240
  105    HA   SER  15           HA       SER  15  31.997   2.274   0.660
  106    HG   SER  15           HG       SER  15  31.301   2.341   4.618
  107    HB2  SER  15           HB2      SER  15  30.348   2.541   2.229
  108    HB3  SER  15           HB3      SER  15  31.091   1.102   2.927
  109    H    GLN  16           H        GLN  16  33.847   2.718   3.639
  110    HA   GLN  16           HA       GLN  16  34.150   5.320   3.983
  111    HB2  GLN  16           HB2      GLN  16  35.416   3.475   5.147
  112    HB3  GLN  16           HB3      GLN  16  36.564   3.512   3.819
  113    HG2  GLN  16           HG2      GLN  16  35.939   5.803   5.657
  114    HG3  GLN  16           HG3      GLN  16  37.355   4.762   5.758
  115   HE21  GLN  16          HE21      GLN  16  37.875   4.552   2.993
  116   HE22  GLN  16          HE22      GLN  16  38.427   6.090   2.429
  117    H    MET  17           H        MET  17  35.458   3.559   1.247
  118    HA   MET  17           HA       MET  17  36.726   6.002   0.242
  119    HB2  MET  17           HB2      MET  17  36.976   3.116  -0.599
  120    HB3  MET  17           HB3      MET  17  37.716   4.448  -1.477
  121    HG2  MET  17           HG2      MET  17  38.980   5.048   0.545
  122    HG3  MET  17           HG3      MET  17  38.280   3.656   1.369
  123    HE1  MET  17           HE1      MET  17  39.362   4.071  -2.301
  124    HE2  MET  17           HE2      MET  17  38.621   2.474  -2.179
  125    HE3  MET  17           HE3      MET  17  40.337   2.623  -2.554
  126    H    LEU  18           H        LEU  18  34.056   3.867  -0.334
  127    HA   LEU  18           HA       LEU  18  33.585   4.529  -3.055
  128    HG   LEU  18           HG       LEU  18  32.329   2.171  -3.623
  129    HB2  LEU  18           HB2      LEU  18  31.959   3.299  -0.875
  130    HB3  LEU  18           HB3      LEU  18  31.181   3.765  -2.372
  131   HD11  LEU  18          HD11      LEU  18  34.255   1.745  -1.350
  132   HD12  LEU  18          HD12      LEU  18  34.568   2.795  -2.730
  133   HD13  LEU  18          HD13      LEU  18  34.342   1.063  -2.974
  134   HD21  LEU  18          HD21      LEU  18  31.031   1.371  -1.257
  135   HD22  LEU  18          HD22      LEU  18  32.434   0.322  -1.442
  136   HD23  LEU  18          HD23      LEU  18  31.246   0.443  -2.741
  137    H    SER  19           H        SER  19  31.710   5.526  -0.185
  138    HA   SER  19           HA       SER  19  30.482   7.665  -1.686
  139    HG   SER  19           HG       SER  19  28.747   6.610  -1.357
  140    HB2  SER  19           HB2      SER  19  29.989   6.305   0.880
  141    HB3  SER  19           HB3      SER  19  29.583   8.022   0.857
  142    H    MET  20           H        MET  20  33.430   7.592  -0.611
  143    HA   MET  20           HA       MET  20  33.370  10.248   0.671
  144    HB2  MET  20           HB2      MET  20  35.229   7.931   0.869
  145    HB3  MET  20           HB3      MET  20  35.906   9.542   1.045
  146    HG2  MET  20           HG2      MET  20  33.765   8.272   2.729
  147    HG3  MET  20           HG3      MET  20  35.406   8.694   3.215
  148    HE1  MET  20           HE1      MET  20  35.218  10.867   5.142
  149    HE2  MET  20           HE2      MET  20  35.470  12.227   4.048
  150    HE3  MET  20           HE3      MET  20  36.288  10.695   3.749
  151    H    GLY  21           H        GLY  21  34.057   8.637  -2.209
  152    HA2  GLY  21           HA2      GLY  21  34.630   9.646  -4.238
  153    HA3  GLY  21           HA3      GLY  21  35.174  11.067  -3.349
  154    H    PHE  22           H        PHE  22  36.199   7.781  -2.597
  155    HA   PHE  22           HA       PHE  22  38.836   8.391  -3.731
  156    HD1  PHE  22           HD1      PHE  22  39.979   9.863  -2.911
  157    HD2  PHE  22           HD2      PHE  22  38.405   8.570   0.827
  158    HE1  PHE  22           HE1      PHE  22  40.434  12.083  -1.957
  159    HE2  PHE  22           HE2      PHE  22  38.856  10.790   1.788
  160    HZ   PHE  22           HZ       PHE  22  39.873  12.549   0.395
  161    HB2  PHE  22           HB2      PHE  22  38.219   7.186  -1.019
  162    HB3  PHE  22           HB3      PHE  22  39.821   7.176  -1.759
  163    H    SER  23           H        SER  23  39.589   6.810  -4.999
  164    HA   SER  23           HA       SER  23  38.505   4.132  -4.630
  165    HG   SER  23           HG       SER  23  36.244   4.484  -6.317
  166    HB2  SER  23           HB2      SER  23  38.585   5.579  -7.290
  167    HB3  SER  23           HB3      SER  23  38.134   3.889  -7.065
  168    H    ASP  24           H        ASP  24  39.719   2.832  -6.738
  169    HA   ASP  24           HA       ASP  24  42.396   2.646  -5.855
  170    HB2  ASP  24           HB2      ASP  24  42.670   0.980  -7.567
  171    HB3  ASP  24           HB3      ASP  24  41.057   0.779  -6.882
  172    H    GLU  25           H        GLU  25  43.978   4.003  -6.300
  173    HA   GLU  25           HA       GLU  25  43.788   5.822  -8.548
  174    HB2  GLU  25           HB2      GLU  25  44.678   6.290  -6.125
  175    HB3  GLU  25           HB3      GLU  25  46.183   5.654  -6.766
  176    HG2  GLU  25           HG2      GLU  25  45.801   7.373  -8.670
  177    HG3  GLU  25           HG3      GLU  25  44.707   8.134  -7.516
  178    H    GLY  26           H        GLY  26  44.143   2.973  -9.066
  179    HA2  GLY  26           HA2      GLY  26  45.691   2.915 -11.272
  180    HA3  GLY  26           HA3      GLY  26  46.856   2.624  -9.988
  181    H    GLY  27           H        GLY  27  43.728   1.326  -9.327
  182    HA2  GLY  27           HA2      GLY  27  42.841  -0.795  -9.608
  183    HA3  GLY  27           HA3      GLY  27  44.188  -1.183 -10.670
  184    H    TRP  28           H        TRP  28  44.725   0.141  -7.513
  185    HA   TRP  28           HA       TRP  28  46.021  -2.354  -6.737
  186    HD1  TRP  28           HD1      TRP  28  47.085   1.956  -7.158
  187    HE1  TRP  28           HE1      TRP  28  45.835   3.946  -6.139
  188    HE3  TRP  28           HE3      TRP  28  44.735  -0.422  -3.298
  189    HZ2  TRP  28           HZ2      TRP  28  44.080   4.462  -3.997
  190    HZ3  TRP  28           HZ3      TRP  28  43.290   0.889  -1.806
  191    HH2  TRP  28           HH2      TRP  28  42.967   3.279  -2.148
  192    HB2  TRP  28           HB2      TRP  28  46.969  -0.942  -4.863
  193    HB3  TRP  28           HB3      TRP  28  47.464  -0.481  -6.493
  194    H    LEU  29           H        LEU  29  43.411  -0.202  -5.731
  195    HA   LEU  29           HA       LEU  29  42.910  -0.930  -3.187
  196    HG   LEU  29           HG       LEU  29  39.988  -2.125  -3.806
  197    HB2  LEU  29           HB2      LEU  29  41.347   0.537  -4.022
  198    HB3  LEU  29           HB3      LEU  29  41.058  -0.411  -5.467
  199   HD11  LEU  29          HD11      LEU  29  40.129  -1.482  -1.674
  200   HD12  LEU  29          HD12      LEU  29  38.849  -0.335  -2.068
  201   HD13  LEU  29          HD13      LEU  29  40.536   0.178  -2.108
  202   HD21  LEU  29          HD21      LEU  29  38.960   0.240  -5.157
  203   HD22  LEU  29          HD22      LEU  29  37.951  -0.275  -3.806
  204   HD23  LEU  29          HD23      LEU  29  38.322  -1.404  -5.109
  205    H    THR  30           H        THR  30  41.375  -2.754  -5.851
  206    HA   THR  30           HA       THR  30  40.452  -4.915  -4.510
  207    HB   THR  30           HB       THR  30  40.025  -5.067  -6.770
  208    HG1  THR  30           HG1      THR  30  42.330  -6.697  -6.729
  209   HG21  THR  30          HG21      THR  30  42.181  -5.121  -8.358
  210   HG22  THR  30          HG22      THR  30  42.753  -4.025  -7.101
  211   HG23  THR  30          HG23      THR  30  41.274  -3.655  -7.987
  212    H    ARG  31           H        ARG  31  43.770  -4.084  -5.073
  213    HA   ARG  31           HA       ARG  31  44.749  -6.633  -4.046
  214    HE   ARG  31           HE       ARG  31  48.756  -5.297  -6.580
  215    HB2  ARG  31           HB2      ARG  31  46.700  -4.496  -4.585
  216    HB3  ARG  31           HB3      ARG  31  46.701  -6.176  -5.099
  217    HG2  ARG  31           HG2      ARG  31  45.104  -5.637  -6.869
  218    HG3  ARG  31           HG3      ARG  31  45.113  -3.949  -6.356
  219    HD2  ARG  31           HD2      ARG  31  46.604  -4.625  -8.335
  220    HD3  ARG  31           HD3      ARG  31  47.300  -3.612  -7.074
  221   HH11  ARG  31          HH11      ARG  31  46.121  -6.609  -8.448
  222   HH12  ARG  31          HH12      ARG  31  46.861  -8.164  -8.634
  223   HH21  ARG  31          HH21      ARG  31  49.741  -7.338  -6.836
  224   HH22  ARG  31          HH22      ARG  31  48.919  -8.574  -7.727
  225    H    LEU  32           H        LEU  32  45.327  -3.163  -3.369
  226    HA   LEU  32           HA       LEU  32  46.714  -3.341  -1.026
  227    HG   LEU  32           HG       LEU  32  46.152   0.285  -0.568
  228    HB2  LEU  32           HB2      LEU  32  46.042  -1.287  -2.345
  229    HB3  LEU  32           HB3      LEU  32  44.506  -1.342  -1.492
  230   HD11  LEU  32          HD11      LEU  32  44.294  -0.933   0.729
  231   HD12  LEU  32          HD12      LEU  32  45.542  -0.081   1.639
  232   HD13  LEU  32          HD13      LEU  32  45.615  -1.835   1.474
  233   HD21  LEU  32          HD21      LEU  32  47.678  -1.762   0.839
  234   HD22  LEU  32          HD22      LEU  32  48.220  -0.281   0.049
  235   HD23  LEU  32          HD23      LEU  32  47.958  -1.742  -0.902
  236    H    LEU  33           H        LEU  33  43.203  -2.723  -1.041
  237    HA   LEU  33           HA       LEU  33  42.686  -3.155   1.616
  238    HG   LEU  33           HG       LEU  33  40.456  -2.409   2.002
  239    HB2  LEU  33           HB2      LEU  33  41.165  -3.112  -0.846
  240    HB3  LEU  33           HB3      LEU  33  40.491  -4.268   0.294
  241   HD11  LEU  33          HD11      LEU  33  40.296  -0.159   0.456
  242   HD12  LEU  33          HD12      LEU  33  41.676  -1.007  -0.245
  243   HD13  LEU  33          HD13      LEU  33  41.663  -0.609   1.473
  244   HD21  LEU  33          HD21      LEU  33  38.481  -1.271   0.901
  245   HD22  LEU  33          HD22      LEU  33  38.402  -3.028   1.021
  246   HD23  LEU  33          HD23      LEU  33  38.817  -2.266  -0.515
  247    H    GLN  34           H        GLN  34  41.910  -5.591  -0.828
  248    HA   GLN  34           HA       GLN  34  41.362  -7.776   0.554
  249    HB2  GLN  34           HB2      GLN  34  42.498  -7.251  -1.996
  250    HB3  GLN  34           HB3      GLN  34  43.289  -8.672  -1.329
  251    HG2  GLN  34           HG2      GLN  34  41.555  -9.740  -2.274
  252    HG3  GLN  34           HG3      GLN  34  40.734  -9.279  -0.786
  253   HE21  GLN  34          HE21      GLN  34  40.198  -6.664  -1.152
  254   HE22  GLN  34          HE22      GLN  34  39.139  -6.443  -2.498
  255    H    THR  35           H        THR  35  44.570  -6.365   0.438
  256    HA   THR  35           HA       THR  35  45.867  -8.617   1.674
  257    HB   THR  35           HB       THR  35  46.839  -5.762   1.445
  258    HG1  THR  35           HG1      THR  35  46.843  -6.224  -0.598
  259   HG21  THR  35          HG21      THR  35  48.013  -7.660   2.915
  260   HG22  THR  35          HG22      THR  35  48.903  -6.420   2.035
  261   HG23  THR  35          HG23      THR  35  48.713  -8.028   1.339
  262    H    LYS  36           H        LYS  36  45.371  -5.296   2.784
  263    HA   LYS  36           HA       LYS  36  45.726  -5.983   5.546
  264    HB2  LYS  36           HB2      LYS  36  44.784  -3.439   4.217
  265    HB3  LYS  36           HB3      LYS  36  45.053  -3.602   5.948
  266    HG2  LYS  36           HG2      LYS  36  47.133  -2.940   5.563
  267    HG3  LYS  36           HG3      LYS  36  47.406  -4.523   4.832
  268    HD2  LYS  36           HD2      LYS  36  47.181  -3.714   2.680
  269    HD3  LYS  36           HD3      LYS  36  46.217  -2.328   3.194
  270    HE2  LYS  36           HE2      LYS  36  48.658  -1.936   2.446
  271    HE3  LYS  36           HE3      LYS  36  48.075  -1.134   3.905
  272    HZ1  LYS  36           HZ1      LYS  36  49.220  -3.740   4.368
  273    HZ2  LYS  36           HZ2      LYS  36  49.483  -2.282   5.184
  274    HZ3  LYS  36           HZ3      LYS  36  50.321  -2.611   3.752
  275    H    ASN  37           H        ASN  37  43.655  -7.547   4.478
  276    HA   ASN  37           HA       ASN  37  41.480  -8.158   4.744
  277    HB2  ASN  37           HB2      ASN  37  40.663  -8.034   7.002
  278    HB3  ASN  37           HB3      ASN  37  42.407  -8.292   7.076
  279   HD21  ASN  37          HD21      ASN  37  43.729  -6.676   7.840
  280   HD22  ASN  37          HD22      ASN  37  43.125  -5.279   8.657
  281    H    TYR  38           H        TYR  38  41.671  -5.972   3.151
  282    HA   TYR  38           HA       TYR  38  40.501  -4.242   2.271
  283    HD1  TYR  38           HD2      TYR  38  39.387  -7.600   3.425
  284    HD2  TYR  38           HD1      TYR  38  37.609  -4.985   0.581
  285    HE1  TYR  38           HE2      TYR  38  39.127  -9.484   1.866
  286    HE2  TYR  38           HE1      TYR  38  37.340  -6.858  -0.983
  287    HH   TYR  38           HH       TYR  38  37.146  -9.582  -0.584
  288    HB2  TYR  38           HB2      TYR  38  38.297  -5.320   4.036
  289    HB3  TYR  38           HB3      TYR  38  38.078  -4.183   2.710
  290    H    ASP  39           H        ASP  39  42.112  -3.055   3.715
  291    HA   ASP  39           HA       ASP  39  40.610  -1.367   5.612
  292    HB2  ASP  39           HB2      ASP  39  43.458  -2.343   5.737
  293    HB3  ASP  39           HB3      ASP  39  42.886  -0.977   6.696
  294    H    ILE  40           H        ILE  40  40.458   0.710   5.133
  295    HA   ILE  40           HA       ILE  40  41.909   1.731   2.869
  296    HB   ILE  40           HB       ILE  40  40.530   3.670   2.991
  297   HG12  ILE  40          HG12      ILE  40  40.730   3.843   5.526
  298   HG13  ILE  40          HG13      ILE  40  39.173   4.286   4.837
  299   HG21  ILE  40          HG21      ILE  40  38.258   2.687   3.006
  300   HG22  ILE  40          HG22      ILE  40  38.944   1.202   3.665
  301   HG23  ILE  40          HG23      ILE  40  39.422   1.758   2.061
  302   HD11  ILE  40          HD11      ILE  40  38.401   2.987   6.498
  303   HD12  ILE  40          HD12      ILE  40  39.896   2.059   6.614
  304   HD13  ILE  40          HD13      ILE  40  38.728   1.690   5.346
  305    H    GLY  41           H        GLY  41  42.165   1.661   6.256
  306    HA2  GLY  41           HA2      GLY  41  43.285   3.930   7.084
  307    HA3  GLY  41           HA3      GLY  41  43.944   2.371   7.541
  308    H    ALA  42           H        ALA  42  44.712   1.622   4.953
  309    HA   ALA  42           HA       ALA  42  47.096   3.273   4.625
  310    HB1  ALA  42           HB1      ALA  42  47.235   0.941   3.023
  311    HB2  ALA  42           HB2      ALA  42  46.648   0.462   4.615
  312    HB3  ALA  42           HB3      ALA  42  48.176   1.329   4.463
  313    H    ALA  43           H        ALA  43  44.328   1.940   2.979
  314    HA   ALA  43           HA       ALA  43  44.912   2.606   0.343
  315    HB1  ALA  43           HB1      ALA  43  42.166   2.988   1.514
  316    HB2  ALA  43           HB2      ALA  43  42.853   1.388   1.231
  317    HB3  ALA  43           HB3      ALA  43  42.603   2.493  -0.121
  318    H    LEU  44           H        LEU  44  44.127   4.615   3.038
  319    HA   LEU  44           HA       LEU  44  43.321   6.948   1.696
  320    HG   LEU  44           HG       LEU  44  42.174   8.204   3.401
  321    HB2  LEU  44           HB2      LEU  44  44.213   6.211   4.393
  322    HB3  LEU  44           HB3      LEU  44  44.579   7.870   3.948
  323   HD11  LEU  44          HD11      LEU  44  40.646   6.572   3.463
  324   HD12  LEU  44          HD12      LEU  44  41.321   5.863   4.930
  325   HD13  LEU  44          HD13      LEU  44  42.030   5.484   3.362
  326   HD21  LEU  44          HD21      LEU  44  41.703   8.815   5.525
  327   HD22  LEU  44          HD22      LEU  44  43.400   8.406   5.775
  328   HD23  LEU  44          HD23      LEU  44  42.142   7.243   6.192
  329    H    ASP  45           H        ASP  45  46.475   6.257   3.200
  330    HA   ASP  45           HA       ASP  45  47.959   8.339   2.379
  331    HB2  ASP  45           HB2      ASP  45  49.067   6.706   3.651
  332    HB3  ASP  45           HB3      ASP  45  48.681   5.424   2.506
  333    H    THR  46           H        THR  46  46.695   5.860   0.286
  334    HA   THR  46           HA       THR  46  48.258   6.859  -1.969
  335    HB   THR  46           HB       THR  46  47.507   4.921  -3.179
  336    HG1  THR  46           HG1      THR  46  45.954   3.591  -2.433
  337   HG21  THR  46          HG21      THR  46  49.261   4.096  -2.022
  338   HG22  THR  46          HG22      THR  46  47.987   3.099  -1.319
  339   HG23  THR  46          HG23      THR  46  48.574   4.518  -0.454
  340    H    ILE  47           H        ILE  47  44.834   6.487  -1.020
  341    HA   ILE  47           HA       ILE  47  43.928   7.704  -3.477
  342    HB   ILE  47           HB       ILE  47  41.695   7.478  -2.626
  343   HG12  ILE  47          HG12      ILE  47  43.117   7.280  -0.033
  344   HG13  ILE  47          HG13      ILE  47  41.599   8.076  -0.420
  345   HG21  ILE  47          HG21      ILE  47  42.538   5.462  -3.528
  346   HG22  ILE  47          HG22      ILE  47  41.711   5.017  -2.037
  347   HG23  ILE  47          HG23      ILE  47  43.471   5.116  -2.073
  348   HD11  ILE  47          HD11      ILE  47  40.776   5.585  -0.697
  349   HD12  ILE  47          HD12      ILE  47  40.830   6.377   0.877
  350   HD13  ILE  47          HD13      ILE  47  42.122   5.275   0.400
  351    H    GLN  48           H        GLN  48  45.534   9.555  -2.689
  352    HA   GLN  48           HA       GLN  48  45.721  11.780  -2.266
  353    HB2  GLN  48           HB2      GLN  48  42.740  11.923  -1.909
  354    HB3  GLN  48           HB3      GLN  48  43.832  13.162  -2.511
  355    HG2  GLN  48           HG2      GLN  48  43.375  12.536  -4.576
  356    HG3  GLN  48           HG3      GLN  48  44.070  10.951  -4.241
  357   HE21  GLN  48          HE21      GLN  48  42.777   9.254  -4.385
  358   HE22  GLN  48          HE22      GLN  48  41.045   9.301  -4.415
  359    H    TYR  49           H        TYR  49  46.476  10.517  -0.208
  360    HA   TYR  49           HA       TYR  49  45.709  12.144   2.018
  361    HD1  TYR  49           HD2      TYR  49  44.910  12.326   4.150
  362    HD2  TYR  49           HD1      TYR  49  42.247   9.798   2.002
  363    HE1  TYR  49           HE2      TYR  49  42.996  13.567   5.071
  364    HE2  TYR  49           HE1      TYR  49  40.327  11.032   2.913
  365    HH   TYR  49           HH       TYR  49  39.658  12.606   4.349
  366    HB2  TYR  49           HB2      TYR  49  44.506   9.503   1.726
  367    HB3  TYR  49           HB3      TYR  49  45.371   9.688   3.253
  368    H    SER  50           H        SER  50  48.094  11.684   0.628
  369    HA   SER  50           HA       SER  50  49.740  10.004   2.344
  370    HG   SER  50           HG       SER  50  49.994  12.602   0.138
  371    HB2  SER  50           HB2      SER  50  51.518  10.404   0.763
  372    HB3  SER  50           HB3      SER  50  50.052  10.034  -0.144
  373    H    LYS  51           H        LYS  51  48.724  11.887   3.891
  374    HA   LYS  51           HA       LYS  51  50.994  13.282   4.861
  375    HB2  LYS  51           HB2      LYS  51  50.212  15.570   4.576
  376    HB3  LYS  51           HB3      LYS  51  50.400  14.799   3.008
  377    HG2  LYS  51           HG2      LYS  51  48.355  15.516   2.545
  378    HG3  LYS  51           HG3      LYS  51  47.767  14.292   3.672
  379    HD2  LYS  51           HD2      LYS  51  47.325  15.813   5.301
  380    HD3  LYS  51           HD3      LYS  51  48.676  16.855   4.842
  381    HE2  LYS  51           HE2      LYS  51  46.442  17.865   4.426
  382    HE3  LYS  51           HE3      LYS  51  47.445  17.731   2.981
  383    HZ1  LYS  51           HZ1      LYS  51  46.217  15.775   2.328
  384    HZ2  LYS  51           HZ2      LYS  51  45.144  17.058   2.580
  385    HZ3  LYS  51           HZ3      LYS  51  45.288  15.836   3.741
  386    H    HIS  52           H        HIS  52  50.232  14.853   6.708
  387    HA   HIS  52           HA       HIS  52  48.033  13.479   8.101
  388    HD1  HIS  52           HD1      HIS  52  48.087  14.673  11.522
  389    HD2  HIS  52           HD2      HIS  52  49.824  11.222   9.991
  390    HE1  HIS  52           HE1      HIS  52  47.420  12.793  13.077
  391    HB2  HIS  52           HB2      HIS  52  50.610  13.632   8.922
  392    HB3  HIS  52           HB3      HIS  52  49.951  15.069   9.696
  Start of MODEL   28
    1    H1   GLY   1           1H       GLY   1  28.469 -15.136   6.724
    2    H2   GLY   1           2H       GLY   1  29.883 -16.051   6.583
    3    H3   GLY   1           3H       GLY   1  28.397 -16.823   6.827
    4    HA2  GLY   1           HA2      GLY   1  29.453 -16.708   4.457
    5    HA3  GLY   1           HA3      GLY   1  27.717 -16.574   4.687
    6    H    SER   2           H        SER   2  30.640 -14.908   3.838
    7    HA   SER   2           HA       SER   2  29.127 -12.446   3.316
    8    HG   SER   2           HG       SER   2  31.790 -12.576   5.470
    9    HB2  SER   2           HB2      SER   2  32.115 -12.920   3.432
   10    HB3  SER   2           HB3      SER   2  31.351 -11.369   3.088
   11    HA   PRO   3           HA       PRO   3  29.499 -13.730  -0.971
   12    HB2  PRO   3           HB2      PRO   3  27.324 -12.409  -1.846
   13    HB3  PRO   3           HB3      PRO   3  27.206 -13.909  -0.920
   14    HG2  PRO   3           HG2      PRO   3  26.637 -11.132  -0.088
   15    HG3  PRO   3           HG3      PRO   3  25.989 -12.653   0.544
   16    HD2  PRO   3           HD2      PRO   3  28.086 -11.053   1.640
   17    HD3  PRO   3           HD3      PRO   3  27.492 -12.617   2.231
   18    HA   PRO   4           HA       PRO   4  31.669 -10.340  -2.786
   19    HB2  PRO   4           HB2      PRO   4  30.542 -11.180  -5.387
   20    HB3  PRO   4           HB3      PRO   4  32.228 -11.085  -4.870
   21    HG2  PRO   4           HG2      PRO   4  31.013 -13.444  -5.177
   22    HG3  PRO   4           HG3      PRO   4  32.179 -13.171  -3.869
   23    HD2  PRO   4           HD2      PRO   4  29.185 -13.213  -3.761
   24    HD3  PRO   4           HD3      PRO   4  30.361 -13.899  -2.621
   25    H    GLU   5           H        GLU   5  29.611  -9.216  -1.663
   26    HA   GLU   5           HA       GLU   5  28.929  -7.069  -3.339
   27    HB2  GLU   5           HB2      GLU   5  27.428  -9.068  -4.151
   28    HB3  GLU   5           HB3      GLU   5  26.458  -8.642  -2.747
   29    HG2  GLU   5           HG2      GLU   5  25.596  -6.862  -3.756
   30    HG3  GLU   5           HG3      GLU   5  27.172  -6.323  -4.333
   31    H    ALA   6           H        ALA   6  29.887  -6.397  -1.223
   32    HA   ALA   6           HA       ALA   6  29.392  -4.908   0.486
   33    HB1  ALA   6           HB1      ALA   6  26.902  -5.207  -0.350
   34    HB2  ALA   6           HB2      ALA   6  27.285  -4.457   1.200
   35    HB3  ALA   6           HB3      ALA   6  26.778  -6.145   1.139
   36    H    ASP   7           H        ASP   7  31.029  -6.848   0.867
   37    HA   ASP   7           HA       ASP   7  30.201  -8.483   3.138
   38    HB2  ASP   7           HB2      ASP   7  32.942  -8.365   1.869
   39    HB3  ASP   7           HB3      ASP   7  32.267  -9.654   2.861
   40    HA   PRO   8           HA       PRO   8  31.622  -6.061   6.550
   41    HB2  PRO   8           HB2      PRO   8  33.948  -7.961   6.593
   42    HB3  PRO   8           HB3      PRO   8  32.995  -7.332   7.942
   43    HG2  PRO   8           HG2      PRO   8  32.581  -9.795   6.858
   44    HG3  PRO   8           HG3      PRO   8  31.301  -8.843   7.627
   45    HD2  PRO   8           HD2      PRO   8  31.612  -9.554   4.824
   46    HD3  PRO   8           HD3      PRO   8  30.237  -8.771   5.626
   47    H    ARG   9           H        ARG   9  34.448  -7.316   4.791
   48    HA   ARG   9           HA       ARG   9  36.117  -5.151   5.002
   49    HE   ARG   9           HE       ARG   9  38.284  -9.023   6.058
   50    HB2  ARG   9           HB2      ARG   9  35.790  -7.041   2.666
   51    HB3  ARG   9           HB3      ARG   9  37.203  -6.034   2.965
   52    HG2  ARG   9           HG2      ARG   9  36.318  -8.519   4.313
   53    HG3  ARG   9           HG3      ARG   9  37.938  -7.997   3.851
   54    HD2  ARG   9           HD2      ARG   9  37.702  -6.239   5.690
   55    HD3  ARG   9           HD3      ARG   9  36.313  -7.175   6.241
   56   HH11  ARG   9          HH11      ARG   9  38.029  -5.931   7.639
   57   HH12  ARG   9          HH12      ARG   9  39.111  -6.354   8.924
   58   HH21  ARG   9          HH21      ARG   9  39.712  -9.588   7.747
   59   HH22  ARG   9          HH22      ARG   9  40.069  -8.431   8.985
   60    H    LEU  10           H        LEU  10  34.508  -5.891   1.954
   61    HA   LEU  10           HA       LEU  10  34.885  -3.408   0.801
   62    HG   LEU  10           HG       LEU  10  34.335  -6.370  -1.411
   63    HB2  LEU  10           HB2      LEU  10  32.900  -5.586   0.199
   64    HB3  LEU  10           HB3      LEU  10  33.054  -4.147  -0.793
   65   HD11  LEU  10          HD11      LEU  10  34.482  -3.801  -2.227
   66   HD12  LEU  10          HD12      LEU  10  35.460  -5.108  -2.896
   67   HD13  LEU  10          HD13      LEU  10  36.130  -4.053  -1.652
   68   HD21  LEU  10          HD21      LEU  10  36.704  -6.200  -0.593
   69   HD22  LEU  10          HD22      LEU  10  35.534  -6.713   0.623
   70   HD23  LEU  10          HD23      LEU  10  36.134  -5.053   0.619
   71    H    ILE  11           H        ILE  11  32.313  -4.527   2.884
   72    HA   ILE  11           HA       ILE  11  30.711  -2.177   2.352
   73    HB   ILE  11           HB       ILE  11  29.884  -4.558   3.130
   74   HG12  ILE  11          HG12      ILE  11  28.781  -1.903   4.040
   75   HG13  ILE  11          HG13      ILE  11  28.333  -2.828   2.609
   76   HG21  ILE  11          HG21      ILE  11  29.981  -3.260   5.823
   77   HG22  ILE  11          HG22      ILE  11  31.306  -4.278   5.267
   78   HG23  ILE  11          HG23      ILE  11  29.683  -4.947   5.406
   79   HD11  ILE  11          HD11      ILE  11  27.081  -4.339   3.826
   80   HD12  ILE  11          HD12      ILE  11  26.768  -2.817   4.657
   81   HD13  ILE  11          HD13      ILE  11  27.916  -3.971   5.335
   82    H    GLU  12           H        GLU  12  33.310  -3.070   4.260
   83    HA   GLU  12           HA       GLU  12  32.910  -0.933   6.224
   84    HB2  GLU  12           HB2      GLU  12  33.643  -2.959   7.234
   85    HB3  GLU  12           HB3      GLU  12  34.918  -3.171   6.042
   86    HG2  GLU  12           HG2      GLU  12  36.042  -1.165   6.930
   87    HG3  GLU  12           HG3      GLU  12  34.796  -1.050   8.173
   88    H    SER  13           H        SER  13  35.630  -2.091   4.237
   89    HA   SER  13           HA       SER  13  36.802   0.552   4.266
   90    HG   SER  13           HG       SER  13  38.682  -2.736   2.803
   91    HB2  SER  13           HB2      SER  13  38.774  -0.480   3.402
   92    HB3  SER  13           HB3      SER  13  38.122  -1.550   4.641
   93    H    LEU  14           H        LEU  14  35.269  -1.565   1.815
   94    HA   LEU  14           HA       LEU  14  36.168   0.128  -0.332
   95    HG   LEU  14           HG       LEU  14  34.183  -0.012  -2.202
   96    HB2  LEU  14           HB2      LEU  14  35.705  -2.058  -1.036
   97    HB3  LEU  14           HB3      LEU  14  34.166  -2.098  -0.213
   98   HD11  LEU  14          HD11      LEU  14  35.752  -2.128  -2.982
   99   HD12  LEU  14          HD12      LEU  14  34.923  -1.002  -4.058
  100   HD13  LEU  14          HD13      LEU  14  34.170  -2.542  -3.641
  101   HD21  LEU  14          HD21      LEU  14  32.522  -2.480  -2.358
  102   HD22  LEU  14          HD22      LEU  14  32.076  -0.799  -2.649
  103   HD23  LEU  14          HD23      LEU  14  32.294  -1.380  -0.999
  104    H    SER  15           H        SER  15  32.803  -0.558   0.646
  105    HA   SER  15           HA       SER  15  31.560   1.562  -0.519
  106    HG   SER  15           HG       SER  15  29.828   2.066   2.500
  107    HB2  SER  15           HB2      SER  15  30.229   0.009   0.739
  108    HB3  SER  15           HB3      SER  15  31.079   0.398   2.235
  109    H    GLN  16           H        GLN  16  32.685   1.658   2.831
  110    HA   GLN  16           HA       GLN  16  32.495   4.252   3.476
  111    HB2  GLN  16           HB2      GLN  16  33.437   2.685   5.028
  112    HB3  GLN  16           HB3      GLN  16  34.831   2.406   4.001
  113    HG2  GLN  16           HG2      GLN  16  34.191   5.024   5.336
  114    HG3  GLN  16           HG3      GLN  16  35.282   3.810   5.995
  115   HE21  GLN  16          HE21      GLN  16  36.263   3.162   3.246
  116   HE22  GLN  16          HE22      GLN  16  37.342   4.447   2.846
  117    H    MET  17           H        MET  17  34.931   2.875   1.314
  118    HA   MET  17           HA       MET  17  36.364   5.333   0.999
  119    HB2  MET  17           HB2      MET  17  36.897   2.684   0.430
  120    HB3  MET  17           HB3      MET  17  36.699   3.398  -1.161
  121    HG2  MET  17           HG2      MET  17  38.808   4.043  -1.023
  122    HG3  MET  17           HG3      MET  17  38.296   5.205   0.200
  123    HE1  MET  17           HE1      MET  17  38.349   1.385   0.202
  124    HE2  MET  17           HE2      MET  17  39.671   0.954   1.287
  125    HE3  MET  17           HE3      MET  17  40.022   1.580  -0.324
  126    H    LEU  18           H        LEU  18  33.611   3.862  -0.581
  127    HA   LEU  18           HA       LEU  18  33.815   5.427  -2.974
  128    HG   LEU  18           HG       LEU  18  30.414   5.198  -3.404
  129    HB2  LEU  18           HB2      LEU  18  32.643   3.275  -2.904
  130    HB3  LEU  18           HB3      LEU  18  31.475   3.941  -1.780
  131   HD11  LEU  18          HD11      LEU  18  32.297   6.419  -4.252
  132   HD12  LEU  18          HD12      LEU  18  31.427   5.713  -5.613
  133   HD13  LEU  18          HD13      LEU  18  32.929   4.979  -5.050
  134   HD21  LEU  18          HD21      LEU  18  30.548   2.596  -3.807
  135   HD22  LEU  18          HD22      LEU  18  31.360   3.104  -5.288
  136   HD23  LEU  18          HD23      LEU  18  29.723   3.661  -4.945
  137    H    SER  19           H        SER  19  31.452   5.514  -0.288
  138    HA   SER  19           HA       SER  19  30.370   8.020  -1.059
  139    HG   SER  19           HG       SER  19  30.381   7.312   2.578
  140    HB2  SER  19           HB2      SER  19  28.766   7.241   0.293
  141    HB3  SER  19           HB3      SER  19  29.853   6.013   0.940
  142    H    MET  20           H        MET  20  33.332   7.400   0.182
  143    HA   MET  20           HA       MET  20  33.418   9.837   1.816
  144    HB2  MET  20           HB2      MET  20  34.331   7.837   2.887
  145    HB3  MET  20           HB3      MET  20  35.443   7.608   1.545
  146    HG2  MET  20           HG2      MET  20  36.326   8.681   3.696
  147    HG3  MET  20           HG3      MET  20  36.754   9.418   2.152
  148    HE1  MET  20           HE1      MET  20  37.427  11.728   3.177
  149    HE2  MET  20           HE2      MET  20  37.185  11.003   4.765
  150    HE3  MET  20           HE3      MET  20  36.468  12.571   4.393
  151    H    GLY  21           H        GLY  21  33.415   9.484  -1.229
  152    HA2  GLY  21           HA2      GLY  21  34.369  10.572  -3.017
  153    HA3  GLY  21           HA3      GLY  21  35.084  11.670  -1.837
  154    H    PHE  22           H        PHE  22  35.541   8.204  -2.249
  155    HA   PHE  22           HA       PHE  22  38.306   8.672  -3.078
  156    HD1  PHE  22           HD1      PHE  22  39.467   9.727  -2.136
  157    HD2  PHE  22           HD2      PHE  22  38.334   7.630   1.389
  158    HE1  PHE  22           HE1      PHE  22  40.517  11.475  -0.762
  159    HE2  PHE  22           HE2      PHE  22  39.384   9.374   2.768
  160    HZ   PHE  22           HZ       PHE  22  40.477  11.300   1.694
  161    HB2  PHE  22           HB2      PHE  22  37.388   7.049  -0.714
  162    HB3  PHE  22           HB3      PHE  22  38.928   6.731  -1.508
  163    H    SER  23           H        SER  23  39.314   6.783  -4.013
  164    HA   SER  23           HA       SER  23  37.566   4.612  -4.729
  165    HG   SER  23           HG       SER  23  36.937   7.307  -6.072
  166    HB2  SER  23           HB2      SER  23  38.817   6.369  -6.863
  167    HB3  SER  23           HB3      SER  23  37.922   4.879  -7.156
  168    H    ASP  24           H        ASP  24  39.742   4.363  -7.080
  169    HA   ASP  24           HA       ASP  24  41.871   3.336  -5.325
  170    HB2  ASP  24           HB2      ASP  24  42.290   1.734  -7.314
  171    HB3  ASP  24           HB3      ASP  24  40.922   1.396  -6.253
  172    H    GLU  25           H        GLU  25  43.714   4.472  -5.563
  173    HA   GLU  25           HA       GLU  25  44.153   6.527  -7.303
  174    HB2  GLU  25           HB2      GLU  25  45.634   5.425  -5.342
  175    HB3  GLU  25           HB3      GLU  25  46.551   4.892  -6.742
  176    HG2  GLU  25           HG2      GLU  25  45.799   7.726  -6.761
  177    HG3  GLU  25           HG3      GLU  25  46.899   7.251  -5.468
  178    H    GLY  26           H        GLY  26  45.782   3.456  -7.712
  179    HA2  GLY  26           HA2      GLY  26  45.411   3.714 -10.630
  180    HA3  GLY  26           HA3      GLY  26  46.938   3.195  -9.920
  181    H    GLY  27           H        GLY  27  43.782   2.246  -8.732
  182    HA2  GLY  27           HA2      GLY  27  42.634   0.228  -8.972
  183    HA3  GLY  27           HA3      GLY  27  43.911  -0.345 -10.037
  184    H    TRP  28           H        TRP  28  44.196   0.967  -6.773
  185    HA   TRP  28           HA       TRP  28  45.585  -1.482  -6.008
  186    HD1  TRP  28           HD1      TRP  28  46.221   3.103  -5.475
  187    HE1  TRP  28           HE1      TRP  28  44.818   4.619  -3.947
  188    HE3  TRP  28           HE3      TRP  28  44.036  -0.465  -2.520
  189    HZ2  TRP  28           HZ2      TRP  28  43.035   4.350  -1.801
  190    HZ3  TRP  28           HZ3      TRP  28  42.496   0.263  -0.755
  191    HH2  TRP  28           HH2      TRP  28  42.002   2.625  -0.405
  192    HB2  TRP  28           HB2      TRP  28  46.468  -0.265  -4.109
  193    HB3  TRP  28           HB3      TRP  28  46.764   0.632  -5.595
  194    H    LEU  29           H        LEU  29  42.698   0.386  -5.213
  195    HA   LEU  29           HA       LEU  29  41.881  -0.461  -2.809
  196    HG   LEU  29           HG       LEU  29  39.329  -2.064  -3.828
  197    HB2  LEU  29           HB2      LEU  29  40.305   0.766  -3.981
  198    HB3  LEU  29           HB3      LEU  29  40.407  -0.266  -5.396
  199   HD11  LEU  29          HD11      LEU  29  39.583  -0.542  -1.824
  200   HD12  LEU  29          HD12      LEU  29  37.986  -1.251  -2.065
  201   HD13  LEU  29          HD13      LEU  29  38.281   0.430  -2.513
  202   HD21  LEU  29          HD21      LEU  29  38.353  -0.903  -5.856
  203   HD22  LEU  29          HD22      LEU  29  37.596   0.221  -4.728
  204   HD23  LEU  29          HD23      LEU  29  37.200  -1.496  -4.662
  205    H    THR  30           H        THR  30  41.066  -2.396  -5.642
  206    HA   THR  30           HA       THR  30  40.360  -4.707  -4.325
  207    HB   THR  30           HB       THR  30  40.474  -5.815  -6.391
  208    HG1  THR  30           HG1      THR  30  42.658  -5.483  -6.850
  209   HG21  THR  30          HG21      THR  30  40.385  -3.107  -7.579
  210   HG22  THR  30          HG22      THR  30  39.188  -3.510  -6.348
  211   HG23  THR  30          HG23      THR  30  39.314  -4.488  -7.810
  212    H    ARG  31           H        ARG  31  43.618  -3.552  -5.083
  213    HA   ARG  31           HA       ARG  31  44.761  -6.102  -4.245
  214    HE   ARG  31           HE       ARG  31  46.902  -6.379  -7.125
  215    HB2  ARG  31           HB2      ARG  31  46.536  -3.840  -4.910
  216    HB3  ARG  31           HB3      ARG  31  46.618  -5.522  -5.405
  217    HG2  ARG  31           HG2      ARG  31  44.599  -4.975  -6.892
  218    HG3  ARG  31           HG3      ARG  31  45.042  -3.289  -6.613
  219    HD2  ARG  31           HD2      ARG  31  45.999  -4.460  -8.687
  220    HD3  ARG  31           HD3      ARG  31  47.101  -3.527  -7.674
  221   HH11  ARG  31          HH11      ARG  31  48.670  -3.776  -8.629
  222   HH12  ARG  31          HH12      ARG  31  50.145  -4.676  -8.744
  223   HH21  ARG  31          HH21      ARG  31  48.841  -7.565  -7.271
  224   HH22  ARG  31          HH22      ARG  31  50.242  -6.827  -7.975
  225    H    LEU  32           H        LEU  32  45.668  -2.718  -3.535
  226    HA   LEU  32           HA       LEU  32  47.197  -3.129  -1.338
  227    HG   LEU  32           HG       LEU  32  44.633  -0.645  -0.301
  228    HB2  LEU  32           HB2      LEU  32  47.316  -0.940  -1.658
  229    HB3  LEU  32           HB3      LEU  32  45.760  -0.898  -2.458
  230   HD11  LEU  32          HD11      LEU  32  47.349  -1.233   0.708
  231   HD12  LEU  32          HD12      LEU  32  45.772  -1.665   1.371
  232   HD13  LEU  32          HD13      LEU  32  46.405  -0.035   1.590
  233   HD21  LEU  32          HD21      LEU  32  44.961   1.568  -0.315
  234   HD22  LEU  32          HD22      LEU  32  46.126   1.257  -1.601
  235   HD23  LEU  32          HD23      LEU  32  46.674   1.407   0.068
  236    H    LEU  33           H        LEU  33  43.658  -2.505  -1.133
  237    HA   LEU  33           HA       LEU  33  43.291  -2.775   1.572
  238    HG   LEU  33           HG       LEU  33  41.444  -1.446  -0.634
  239    HB2  LEU  33           HB2      LEU  33  41.624  -3.799  -0.723
  240    HB3  LEU  33           HB3      LEU  33  41.105  -3.979   0.947
  241   HD11  LEU  33          HD11      LEU  33  39.133  -1.070   0.237
  242   HD12  LEU  33          HD12      LEU  33  39.174  -2.709   0.886
  243   HD13  LEU  33          HD13      LEU  33  39.292  -2.446  -0.853
  244   HD21  LEU  33          HD21      LEU  33  41.770  -1.864   2.252
  245   HD22  LEU  33          HD22      LEU  33  40.630  -0.594   1.808
  246   HD23  LEU  33          HD23      LEU  33  42.294  -0.526   1.230
  247    H    GLN  34           H        GLN  34  43.007  -5.415  -0.714
  248    HA   GLN  34           HA       GLN  34  42.933  -7.615   0.877
  249    HB2  GLN  34           HB2      GLN  34  43.547  -7.040  -1.806
  250    HB3  GLN  34           HB3      GLN  34  44.781  -8.163  -1.246
  251    HG2  GLN  34           HG2      GLN  34  43.229  -9.656  -1.954
  252    HG3  GLN  34           HG3      GLN  34  42.664  -9.438  -0.299
  253   HE21  GLN  34          HE21      GLN  34  41.415  -7.021  -0.447
  254   HE22  GLN  34          HE22      GLN  34  40.044  -7.130  -1.492
  255    H    THR  35           H        THR  35  45.936  -6.026  -0.227
  256    HA   THR  35           HA       THR  35  47.641  -7.673   1.390
  257    HB   THR  35           HB       THR  35  48.624  -5.045   0.430
  258    HG1  THR  35           HG1      THR  35  47.667  -7.079  -1.284
  259   HG21  THR  35          HG21      THR  35  50.242  -6.866  -0.671
  260   HG22  THR  35          HG22      THR  35  49.647  -7.791   0.707
  261   HG23  THR  35          HG23      THR  35  50.448  -6.241   0.964
  262    H    LYS  36           H        LYS  36  45.520  -5.461   2.202
  263    HA   LYS  36           HA       LYS  36  46.975  -4.581   4.600
  264    HB2  LYS  36           HB2      LYS  36  45.341  -3.012   2.696
  265    HB3  LYS  36           HB3      LYS  36  45.018  -2.706   4.397
  266    HG2  LYS  36           HG2      LYS  36  46.684  -1.171   3.421
  267    HG3  LYS  36           HG3      LYS  36  47.307  -2.102   4.784
  268    HD2  LYS  36           HD2      LYS  36  48.319  -3.691   3.169
  269    HD3  LYS  36           HD3      LYS  36  47.787  -2.642   1.855
  270    HE2  LYS  36           HE2      LYS  36  49.648  -1.453   2.084
  271    HE3  LYS  36           HE3      LYS  36  49.140  -1.010   3.714
  272    HZ1  LYS  36           HZ1      LYS  36  51.126  -2.008   4.150
  273    HZ2  LYS  36           HZ2      LYS  36  51.017  -3.088   2.853
  274    HZ3  LYS  36           HZ3      LYS  36  50.118  -3.362   4.258
  275    H    ASN  37           H        ASN  37  45.231  -6.899   3.878
  276    HA   ASN  37           HA       ASN  37  43.468  -8.092   4.674
  277    HB2  ASN  37           HB2      ASN  37  43.043  -7.735   7.191
  278    HB3  ASN  37           HB3      ASN  37  44.643  -8.292   6.702
  279   HD21  ASN  37          HD21      ASN  37  42.783  -5.473   7.669
  280   HD22  ASN  37          HD22      ASN  37  44.121  -4.575   8.292
  281    H    TYR  38           H        TYR  38  42.660  -6.009   3.167
  282    HA   TYR  38           HA       TYR  38  40.957  -4.566   2.717
  283    HD1  TYR  38           HD2      TYR  38  41.094  -8.210   3.598
  284    HD2  TYR  38           HD1      TYR  38  38.204  -6.063   1.330
  285    HE1  TYR  38           HE2      TYR  38  41.152  -9.963   1.875
  286    HE2  TYR  38           HE1      TYR  38  38.252  -7.813  -0.398
  287    HH   TYR  38           HH       TYR  38  39.172 -10.707  -0.056
  288    HB2  TYR  38           HB2      TYR  38  39.505  -6.423   4.609
  289    HB3  TYR  38           HB3      TYR  38  38.747  -5.318   3.471
  290    H    ASP  39           H        ASP  39  42.371  -3.073   4.133
  291    HA   ASP  39           HA       ASP  39  40.660  -2.068   6.330
  292    HB2  ASP  39           HB2      ASP  39  43.415  -2.852   6.433
  293    HB3  ASP  39           HB3      ASP  39  43.285  -1.131   6.774
  294    H    ILE  40           H        ILE  40  40.413   0.131   6.557
  295    HA   ILE  40           HA       ILE  40  40.922   1.671   4.147
  296    HB   ILE  40           HB       ILE  40  39.714   3.475   5.691
  297   HG12  ILE  40          HG12      ILE  40  39.775   1.599   7.546
  298   HG13  ILE  40          HG13      ILE  40  38.382   2.664   7.391
  299   HG21  ILE  40          HG21      ILE  40  38.717   2.943   3.667
  300   HG22  ILE  40          HG22      ILE  40  37.503   2.450   4.847
  301   HG23  ILE  40          HG23      ILE  40  38.537   1.240   4.088
  302   HD11  ILE  40          HD11      ILE  40  37.158   0.969   6.212
  303   HD12  ILE  40          HD12      ILE  40  37.785   0.294   7.716
  304   HD13  ILE  40          HD13      ILE  40  38.572  -0.085   6.183
  305    H    GLY  41           H        GLY  41  42.104   1.239   7.327
  306    HA2  GLY  41           HA2      GLY  41  43.226   3.538   8.106
  307    HA3  GLY  41           HA3      GLY  41  44.083   2.019   8.241
  308    H    ALA  42           H        ALA  42  44.818   1.326   5.904
  309    HA   ALA  42           HA       ALA  42  46.577   3.479   5.007
  310    HB1  ALA  42           HB1      ALA  42  47.991   1.742   5.366
  311    HB2  ALA  42           HB2      ALA  42  47.539   1.344   3.709
  312    HB3  ALA  42           HB3      ALA  42  46.750   0.527   5.057
  313    H    ALA  43           H        ALA  43  43.707   2.021   4.077
  314    HA   ALA  43           HA       ALA  43  43.984   1.864   1.279
  315    HB1  ALA  43           HB1      ALA  43  41.659   1.704   1.158
  316    HB2  ALA  43           HB2      ALA  43  41.417   2.721   2.578
  317    HB3  ALA  43           HB3      ALA  43  42.024   1.080   2.760
  318    H    LEU  44           H        LEU  44  42.846   4.484   3.362
  319    HA   LEU  44           HA       LEU  44  42.415   6.365   1.307
  320    HG   LEU  44           HG       LEU  44  40.365   7.475   2.858
  321    HB2  LEU  44           HB2      LEU  44  42.867   6.652   4.263
  322    HB3  LEU  44           HB3      LEU  44  42.573   8.035   3.219
  323   HD11  LEU  44          HD11      LEU  44  40.790   5.218   2.025
  324   HD12  LEU  44          HD12      LEU  44  39.421   5.246   3.138
  325   HD13  LEU  44          HD13      LEU  44  40.988   4.641   3.680
  326   HD21  LEU  44          HD21      LEU  44  39.680   6.309   5.203
  327   HD22  LEU  44          HD22      LEU  44  40.051   8.023   5.014
  328   HD23  LEU  44          HD23      LEU  44  41.292   6.910   5.588
  329    H    ASP  45           H        ASP  45  45.043   6.178   3.688
  330    HA   ASP  45           HA       ASP  45  46.674   8.172   3.059
  331    HB2  ASP  45           HB2      ASP  45  47.365   6.626   4.719
  332    HB3  ASP  45           HB3      ASP  45  47.432   5.302   3.560
  333    H    THR  46           H        THR  46  46.054   5.489   0.908
  334    HA   THR  46           HA       THR  46  48.193   6.343  -0.872
  335    HB   THR  46           HB       THR  46  47.795   4.295  -2.093
  336    HG1  THR  46           HG1      THR  46  45.459   4.351  -1.714
  337   HG21  THR  46          HG21      THR  46  48.056   2.605  -0.278
  338   HG22  THR  46          HG22      THR  46  47.810   3.908   0.884
  339   HG23  THR  46          HG23      THR  46  49.192   3.952  -0.210
  340    H    ILE  47           H        ILE  47  44.703   6.513  -0.714
  341    HA   ILE  47           HA       ILE  47  44.469   7.127  -3.543
  342    HB   ILE  47           HB       ILE  47  42.045   7.847  -2.614
  343   HG12  ILE  47          HG12      ILE  47  43.081   5.773  -0.692
  344   HG13  ILE  47          HG13      ILE  47  42.511   7.385  -0.296
  345   HG21  ILE  47          HG21      ILE  47  43.207   5.480  -3.805
  346   HG22  ILE  47          HG22      ILE  47  41.698   6.311  -4.173
  347   HG23  ILE  47          HG23      ILE  47  41.753   5.119  -2.876
  348   HD11  ILE  47          HD11      ILE  47  41.035   5.132  -0.114
  349   HD12  ILE  47          HD12      ILE  47  40.579   5.707  -1.717
  350   HD13  ILE  47          HD13      ILE  47  40.368   6.753  -0.313
  351    H    GLN  48           H        GLN  48  44.342   8.887  -0.487
  352    HA   GLN  48           HA       GLN  48  45.087  11.323  -1.761
  353    HB2  GLN  48           HB2      GLN  48  42.222  10.822  -1.187
  354    HB3  GLN  48           HB3      GLN  48  42.847  12.404  -0.744
  355    HG2  GLN  48           HG2      GLN  48  42.814  13.091  -2.846
  356    HG3  GLN  48           HG3      GLN  48  43.702  11.669  -3.393
  357   HE21  GLN  48          HE21      GLN  48  41.939   9.676  -2.724
  358   HE22  GLN  48          HE22      GLN  48  40.508   9.819  -3.691
  359    H    TYR  49           H        TYR  49  46.127   9.819   0.374
  360    HA   TYR  49           HA       TYR  49  46.138  11.862   2.424
  361    HD1  TYR  49           HD2      TYR  49  45.502  11.830   5.324
  362    HD2  TYR  49           HD1      TYR  49  42.741  10.176   2.542
  363    HE1  TYR  49           HE2      TYR  49  43.711  13.210   6.291
  364    HE2  TYR  49           HE1      TYR  49  40.942  11.551   3.500
  365    HH   TYR  49           HH       TYR  49  41.354  14.155   5.262
  366    HB2  TYR  49           HB2      TYR  49  44.893   9.201   2.800
  367    HB3  TYR  49           HB3      TYR  49  45.986   9.725   4.082
  368    H    SER  50           H        SER  50  47.886  10.514   0.383
  369    HA   SER  50           HA       SER  50  49.948   9.296   2.046
  370    HG   SER  50           HG       SER  50  51.780   9.412  -0.965
  371    HB2  SER  50           HB2      SER  50  50.519   8.188   0.176
  372    HB3  SER  50           HB3      SER  50  49.127   8.928  -0.612
  373    H    LYS  51           H        LYS  51  49.230  12.111   2.306
  374    HA   LYS  51           HA       LYS  51  51.896  13.250   1.943
  375    HB2  LYS  51           HB2      LYS  51  50.850  15.409   1.181
  376    HB3  LYS  51           HB3      LYS  51  50.768  14.096   0.013
  377    HG2  LYS  51           HG2      LYS  51  48.539  14.085   0.014
  378    HG3  LYS  51           HG3      LYS  51  48.447  14.215   1.771
  379    HD2  LYS  51           HD2      LYS  51  47.799  16.327   1.519
  380    HD3  LYS  51           HD3      LYS  51  49.399  16.693   0.873
  381    HE2  LYS  51           HE2      LYS  51  47.653  17.431  -0.659
  382    HE3  LYS  51           HE3      LYS  51  48.619  16.143  -1.377
  383    HZ1  LYS  51           HZ1      LYS  51  46.882  14.740  -1.410
  384    HZ2  LYS  51           HZ2      LYS  51  45.958  16.156  -1.351
  385    HZ3  LYS  51           HZ3      LYS  51  46.254  15.280   0.066
  386    H    HIS  52           H        HIS  52  50.731  12.241   4.266
  387    HA   HIS  52           HA       HIS  52  50.209  14.696   5.810
  388    HD1  HIS  52           HD1      HIS  52  47.013  14.692   7.183
  389    HD2  HIS  52           HD2      HIS  52  50.034  12.639   9.164
  390    HE1  HIS  52           HE1      HIS  52  46.758  15.248   9.638
  391    HB2  HIS  52           HB2      HIS  52  48.278  13.117   5.677
  392    HB3  HIS  52           HB3      HIS  52  49.270  11.899   6.473
  Start of MODEL   29
    1    H1   GLY   1           1H       GLY   1  27.509 -18.678   5.177
    2    H2   GLY   1           2H       GLY   1  26.302 -17.494   5.220
    3    H3   GLY   1           3H       GLY   1  27.909 -17.072   5.534
    4    HA2  GLY   1           HA2      GLY   1  28.383 -17.945   3.184
    5    HA3  GLY   1           HA3      GLY   1  26.647 -17.775   2.962
    6    H    SER   2           H        SER   2  29.596 -16.235   2.714
    7    HA   SER   2           HA       SER   2  28.297 -13.589   2.664
    8    HG   SER   2           HG       SER   2  29.139 -12.148   3.880
    9    HB2  SER   2           HB2      SER   2  30.341 -14.246   4.303
   10    HB3  SER   2           HB3      SER   2  31.251 -13.720   2.888
   11    HA   PRO   3           HA       PRO   3  29.649 -14.018  -1.610
   12    HB2  PRO   3           HB2      PRO   3  27.450 -12.864  -2.685
   13    HB3  PRO   3           HB3      PRO   3  27.469 -14.538  -2.128
   14    HG2  PRO   3           HG2      PRO   3  26.103 -12.225  -0.981
   15    HG3  PRO   3           HG3      PRO   3  25.859 -13.944  -0.647
   16    HD2  PRO   3           HD2      PRO   3  27.392 -11.981   0.864
   17    HD3  PRO   3           HD3      PRO   3  26.935 -13.629   1.323
   18    HA   PRO   4           HA       PRO   4  31.366 -10.005  -2.319
   19    HB2  PRO   4           HB2      PRO   4  30.898 -10.426  -5.203
   20    HB3  PRO   4           HB3      PRO   4  32.419 -10.200  -4.334
   21    HG2  PRO   4           HG2      PRO   4  31.725 -12.586  -5.341
   22    HG3  PRO   4           HG3      PRO   4  32.607 -12.443  -3.809
   23    HD2  PRO   4           HD2      PRO   4  29.697 -12.970  -4.279
   24    HD3  PRO   4           HD3      PRO   4  30.794 -13.691  -3.081
   25    H    GLU   5           H        GLU   5  28.936  -9.556  -1.455
   26    HA   GLU   5           HA       GLU   5  27.909  -7.530  -3.277
   27    HB2  GLU   5           HB2      GLU   5  26.672  -9.859  -3.429
   28    HB3  GLU   5           HB3      GLU   5  25.889  -9.292  -1.960
   29    HG2  GLU   5           HG2      GLU   5  25.603  -7.117  -3.514
   30    HG3  GLU   5           HG3      GLU   5  25.590  -8.384  -4.741
   31    H    ALA   6           H        ALA   6  29.351  -6.887  -1.135
   32    HA   ALA   6           HA       ALA   6  29.133  -5.228   0.467
   33    HB1  ALA   6           HB1      ALA   6  26.734  -4.958  -0.340
   34    HB2  ALA   6           HB2      ALA   6  27.074  -4.518   1.333
   35    HB3  ALA   6           HB3      ALA   6  26.290  -6.055   0.967
   36    H    ASP   7           H        ASP   7  30.593  -6.922   1.294
   37    HA   ASP   7           HA       ASP   7  29.454  -8.414   3.551
   38    HB2  ASP   7           HB2      ASP   7  32.262  -8.677   2.468
   39    HB3  ASP   7           HB3      ASP   7  31.380  -9.812   3.486
   40    HA   PRO   8           HA       PRO   8  30.934  -5.916   6.865
   41    HB2  PRO   8           HB2      PRO   8  33.052  -8.033   7.139
   42    HB3  PRO   8           HB3      PRO   8  32.126  -7.215   8.403
   43    HG2  PRO   8           HG2      PRO   8  31.474  -9.683   7.496
   44    HG3  PRO   8           HG3      PRO   8  30.266  -8.527   8.081
   45    HD2  PRO   8           HD2      PRO   8  30.711  -9.503   5.366
   46    HD3  PRO   8           HD3      PRO   8  29.349  -8.561   6.002
   47    H    ARG   9           H        ARG   9  33.657  -7.538   5.244
   48    HA   ARG   9           HA       ARG   9  35.555  -5.564   5.429
   49    HE   ARG   9           HE       ARG   9  37.933  -9.476   6.092
   50    HB2  ARG   9           HB2      ARG   9  35.100  -7.448   3.101
   51    HB3  ARG   9           HB3      ARG   9  36.619  -6.634   3.498
   52    HG2  ARG   9           HG2      ARG   9  35.235  -8.820   5.027
   53    HG3  ARG   9           HG3      ARG   9  36.835  -8.846   4.282
   54    HD2  ARG   9           HD2      ARG   9  37.226  -6.810   5.932
   55    HD3  ARG   9           HD3      ARG   9  35.940  -7.609   6.835
   56   HH11  ARG   9          HH11      ARG   9  37.316  -6.860   8.305
   57   HH12  ARG   9          HH12      ARG   9  38.421  -7.442   9.505
   58   HH21  ARG   9          HH21      ARG   9  39.396 -10.249   7.666
   59   HH22  ARG   9          HH22      ARG   9  39.604  -9.367   9.141
   60    H    LEU  10           H        LEU  10  33.863  -6.222   2.388
   61    HA   LEU  10           HA       LEU  10  34.513  -3.831   1.155
   62    HG   LEU  10           HG       LEU  10  33.507  -6.718  -1.033
   63    HB2  LEU  10           HB2      LEU  10  32.256  -5.762   0.666
   64    HB3  LEU  10           HB3      LEU  10  32.569  -4.386  -0.376
   65   HD11  LEU  10          HD11      LEU  10  34.090  -4.273  -1.847
   66   HD12  LEU  10          HD12      LEU  10  35.001  -5.677  -2.395
   67   HD13  LEU  10          HD13      LEU  10  35.642  -4.660  -1.105
   68   HD21  LEU  10          HD21      LEU  10  35.813  -7.075  -0.179
   69   HD22  LEU  10          HD22      LEU  10  34.563  -7.316   1.039
   70   HD23  LEU  10          HD23      LEU  10  35.515  -5.830   1.033
   71    H    ILE  11           H        ILE  11  31.940  -4.607   3.347
   72    HA   ILE  11           HA       ILE  11  30.513  -2.154   2.820
   73    HB   ILE  11           HB       ILE  11  29.934  -4.568   4.235
   74   HG12  ILE  11          HG12      ILE  11  28.221  -2.118   3.794
   75   HG13  ILE  11          HG13      ILE  11  28.508  -3.379   2.598
   76   HG21  ILE  11          HG21      ILE  11  30.624  -3.456   6.291
   77   HG22  ILE  11          HG22      ILE  11  28.881  -3.719   6.273
   78   HG23  ILE  11          HG23      ILE  11  29.533  -2.114   5.946
   79   HD11  ILE  11          HD11      ILE  11  26.341  -3.547   3.814
   80   HD12  ILE  11          HD12      ILE  11  27.258  -3.887   5.281
   81   HD13  ILE  11          HD13      ILE  11  27.352  -4.989   3.907
   82    H    GLU  12           H        GLU  12  33.146  -3.229   4.633
   83    HA   GLU  12           HA       GLU  12  33.118  -0.925   6.434
   84    HB2  GLU  12           HB2      GLU  12  34.608  -3.511   6.356
   85    HB3  GLU  12           HB3      GLU  12  35.331  -2.146   7.196
   86    HG2  GLU  12           HG2      GLU  12  33.799  -2.178   8.866
   87    HG3  GLU  12           HG3      GLU  12  32.509  -2.774   7.824
   88    H    SER  13           H        SER  13  35.519  -2.531   4.339
   89    HA   SER  13           HA       SER  13  37.001  -0.057   4.136
   90    HG   SER  13           HG       SER  13  36.840  -3.529   3.444
   91    HB2  SER  13           HB2      SER  13  38.701  -1.436   2.978
   92    HB3  SER  13           HB3      SER  13  38.261  -2.076   4.562
   93    H    LEU  14           H        LEU  14  35.052  -2.101   1.946
   94    HA   LEU  14           HA       LEU  14  35.963  -0.675  -0.374
   95    HG   LEU  14           HG       LEU  14  34.415  -0.865  -2.350
   96    HB2  LEU  14           HB2      LEU  14  34.955  -3.012  -0.409
   97    HB3  LEU  14           HB3      LEU  14  33.393  -2.236  -0.241
   98   HD11  LEU  14          HD11      LEU  14  35.089  -3.534  -3.297
   99   HD12  LEU  14          HD12      LEU  14  36.210  -2.922  -2.080
  100   HD13  LEU  14          HD13      LEU  14  35.914  -1.996  -3.551
  101   HD21  LEU  14          HD21      LEU  14  32.453  -2.930  -1.883
  102   HD22  LEU  14          HD22      LEU  14  33.142  -3.052  -3.502
  103   HD23  LEU  14          HD23      LEU  14  32.393  -1.545  -2.973
  104    H    SER  15           H        SER  15  32.660  -0.773   1.043
  105    HA   SER  15           HA       SER  15  31.600   1.407  -0.185
  106    HG   SER  15           HG       SER  15  28.962   1.233   1.804
  107    HB2  SER  15           HB2      SER  15  30.636  -0.116   1.733
  108    HB3  SER  15           HB3      SER  15  31.237   1.160   2.790
  109    H    GLN  16           H        GLN  16  33.241   1.556   2.969
  110    HA   GLN  16           HA       GLN  16  33.539   4.217   3.335
  111    HB2  GLN  16           HB2      GLN  16  34.475   2.652   4.927
  112    HB3  GLN  16           HB3      GLN  16  35.639   2.076   3.744
  113    HG2  GLN  16           HG2      GLN  16  35.580   4.888   4.799
  114    HG3  GLN  16           HG3      GLN  16  36.563   3.603   5.491
  115   HE21  GLN  16          HE21      GLN  16  37.672   5.950   4.533
  116   HE22  GLN  16          HE22      GLN  16  38.600   5.612   3.114
  117    H    MET  17           H        MET  17  35.308   2.196   1.061
  118    HA   MET  17           HA       MET  17  37.195   4.124   0.249
  119    HB2  MET  17           HB2      MET  17  37.948   2.523  -1.161
  120    HB3  MET  17           HB3      MET  17  36.879   1.484  -0.237
  121    HG2  MET  17           HG2      MET  17  36.147   0.899  -2.271
  122    HG3  MET  17           HG3      MET  17  35.160   2.349  -2.108
  123    HE1  MET  17           HE1      MET  17  34.729   3.145  -4.360
  124    HE2  MET  17           HE2      MET  17  35.915   4.126  -5.219
  125    HE3  MET  17           HE3      MET  17  35.471   4.531  -3.561
  126    H    LEU  18           H        LEU  18  33.916   3.367  -0.811
  127    HA   LEU  18           HA       LEU  18  34.048   5.501  -2.825
  128    HG   LEU  18           HG       LEU  18  30.795   5.394  -2.871
  129    HB2  LEU  18           HB2      LEU  18  33.031   3.527  -3.654
  130    HB3  LEU  18           HB3      LEU  18  32.052   3.335  -2.213
  131   HD11  LEU  18          HD11      LEU  18  31.229   5.500  -5.603
  132   HD12  LEU  18          HD12      LEU  18  32.851   5.436  -4.915
  133   HD13  LEU  18          HD13      LEU  18  31.730   6.702  -4.415
  134   HD21  LEU  18          HD21      LEU  18  30.679   2.761  -3.960
  135   HD22  LEU  18          HD22      LEU  18  30.171   3.915  -5.192
  136   HD23  LEU  18          HD23      LEU  18  29.358   3.882  -3.627
  137    H    SER  19           H        SER  19  31.784   4.463  -0.285
  138    HA   SER  19           HA       SER  19  30.239   6.695  -0.047
  139    HG   SER  19           HG       SER  19  28.676   5.312   2.589
  140    HB2  SER  19           HB2      SER  19  30.471   4.323   1.315
  141    HB3  SER  19           HB3      SER  19  30.861   5.513   2.556
  142    H    MET  20           H        MET  20  33.560   6.659   0.624
  143    HA   MET  20           HA       MET  20  33.381   8.826   2.576
  144    HB2  MET  20           HB2      MET  20  35.693   7.220   1.504
  145    HB3  MET  20           HB3      MET  20  35.940   8.686   2.439
  146    HG2  MET  20           HG2      MET  20  34.232   6.472   3.496
  147    HG3  MET  20           HG3      MET  20  35.987   6.422   3.649
  148    HE1  MET  20           HE1      MET  20  34.310   7.477   7.175
  149    HE2  MET  20           HE2      MET  20  35.020   6.125   6.291
  150    HE3  MET  20           HE3      MET  20  33.387   6.669   5.908
  151    H    GLY  21           H        GLY  21  34.131   8.190  -0.752
  152    HA2  GLY  21           HA2      GLY  21  33.687  10.026  -2.312
  153    HA3  GLY  21           HA3      GLY  21  34.482  11.092  -1.160
  154    H    PHE  22           H        PHE  22  35.848   7.931  -1.776
  155    HA   PHE  22           HA       PHE  22  37.867   9.167  -3.507
  156    HD1  PHE  22           HD1      PHE  22  39.164  10.685  -1.670
  157    HD2  PHE  22           HD2      PHE  22  37.983   7.312   0.640
  158    HE1  PHE  22           HE1      PHE  22  39.044  12.105   0.333
  159    HE2  PHE  22           HE2      PHE  22  37.859   8.726   2.648
  160    HZ   PHE  22           HZ       PHE  22  38.387  11.127   2.496
  161    HB2  PHE  22           HB2      PHE  22  38.583   7.007  -1.549
  162    HB3  PHE  22           HB3      PHE  22  39.632   8.195  -2.326
  163    H    SER  23           H        SER  23  39.323   7.060  -4.217
  164    HA   SER  23           HA       SER  23  37.689   4.779  -4.760
  165    HG   SER  23           HG       SER  23  35.866   6.026  -6.588
  166    HB2  SER  23           HB2      SER  23  38.547   6.472  -7.120
  167    HB3  SER  23           HB3      SER  23  37.616   4.976  -7.177
  168    H    ASP  24           H        ASP  24  39.426   4.416  -7.311
  169    HA   ASP  24           HA       ASP  24  41.818   3.521  -5.856
  170    HB2  ASP  24           HB2      ASP  24  42.043   1.758  -7.387
  171    HB3  ASP  24           HB3      ASP  24  40.300   1.863  -7.133
  172    H    GLU  25           H        GLU  25  43.538   4.769  -6.118
  173    HA   GLU  25           HA       GLU  25  43.734   6.493  -8.457
  174    HB2  GLU  25           HB2      GLU  25  44.394   6.814  -5.766
  175    HB3  GLU  25           HB3      GLU  25  45.944   6.687  -6.590
  176    HG2  GLU  25           HG2      GLU  25  44.779   8.407  -8.233
  177    HG3  GLU  25           HG3      GLU  25  43.857   8.778  -6.778
  178    H    GLY  26           H        GLY  26  44.047   3.949  -9.277
  179    HA2  GLY  26           HA2      GLY  26  46.087   3.738 -10.899
  180    HA3  GLY  26           HA3      GLY  26  46.930   3.421  -9.388
  181    H    GLY  27           H        GLY  27  43.953   2.166  -8.884
  182    HA2  GLY  27           HA2      GLY  27  42.985   0.076  -9.217
  183    HA3  GLY  27           HA3      GLY  27  44.255  -0.295 -10.381
  184    H    TRP  28           H        TRP  28  44.982   0.951  -7.261
  185    HA   TRP  28           HA       TRP  28  46.369  -1.519  -6.556
  186    HD1  TRP  28           HD1      TRP  28  46.960   2.811  -7.214
  187    HE1  TRP  28           HE1      TRP  28  45.636   4.719  -6.106
  188    HE3  TRP  28           HE3      TRP  28  45.446   0.402  -2.993
  189    HZ2  TRP  28           HZ2      TRP  28  44.144   5.151  -3.748
  190    HZ3  TRP  28           HZ3      TRP  28  44.090   1.620  -1.365
  191    HH2  TRP  28           HH2      TRP  28  43.443   3.940  -1.722
  192    HB2  TRP  28           HB2      TRP  28  47.359  -0.013  -4.760
  193    HB3  TRP  28           HB3      TRP  28  47.735   0.448  -6.427
  194    H    LEU  29           H        LEU  29  43.667   0.494  -5.651
  195    HA   LEU  29           HA       LEU  29  43.146   0.003  -3.063
  196    HG   LEU  29           HG       LEU  29  40.590  -1.158  -2.894
  197    HB2  LEU  29           HB2      LEU  29  41.474   1.184  -4.148
  198    HB3  LEU  29           HB3      LEU  29  41.333   0.003  -5.439
  199   HD11  LEU  29          HD11      LEU  29  39.673   1.552  -3.425
  200   HD12  LEU  29          HD12      LEU  29  39.557   0.583  -1.957
  201   HD13  LEU  29          HD13      LEU  29  38.353   0.399  -3.233
  202   HD21  LEU  29          HD21      LEU  29  39.354  -0.780  -5.595
  203   HD22  LEU  29          HD22      LEU  29  38.421  -1.444  -4.253
  204   HD23  LEU  29          HD23      LEU  29  39.879  -2.268  -4.806
  205    H    THR  30           H        THR  30  41.803  -2.203  -5.510
  206    HA   THR  30           HA       THR  30  41.059  -4.331  -4.072
  207    HB   THR  30           HB       THR  30  40.857  -4.660  -6.366
  208    HG1  THR  30           HG1      THR  30  43.173  -6.212  -6.019
  209   HG21  THR  30          HG21      THR  30  42.498  -4.399  -8.023
  210   HG22  THR  30          HG22      THR  30  43.802  -4.352  -6.837
  211   HG23  THR  30          HG23      THR  30  42.669  -3.005  -6.956
  212    H    ARG  31           H        ARG  31  44.350  -3.310  -4.619
  213    HA   ARG  31           HA       ARG  31  45.527  -5.578  -3.277
  214    HE   ARG  31           HE       ARG  31  49.823  -2.482  -2.200
  215    HB2  ARG  31           HB2      ARG  31  47.423  -4.880  -4.266
  216    HB3  ARG  31           HB3      ARG  31  46.461  -3.643  -5.060
  217    HG2  ARG  31           HG2      ARG  31  47.018  -2.030  -3.398
  218    HG3  ARG  31           HG3      ARG  31  47.765  -3.260  -2.376
  219    HD2  ARG  31           HD2      ARG  31  49.253  -3.630  -4.528
  220    HD3  ARG  31           HD3      ARG  31  48.778  -1.961  -4.853
  221   HH11  ARG  31          HH11      ARG  31  50.516  -1.458  -5.458
  222   HH12  ARG  31          HH12      ARG  31  51.950  -0.591  -5.016
  223   HH21  ARG  31          HH21      ARG  31  51.708  -1.347  -1.610
  224   HH22  ARG  31          HH22      ARG  31  52.628  -0.529  -2.830
  225    H    LEU  32           H        LEU  32  45.264  -2.086  -2.631
  226    HA   LEU  32           HA       LEU  32  46.281  -1.785  -0.167
  227    HG   LEU  32           HG       LEU  32  43.163  -1.085   0.926
  228    HB2  LEU  32           HB2      LEU  32  45.272   0.143  -0.818
  229    HB3  LEU  32           HB3      LEU  32  43.926  -0.697  -1.565
  230   HD11  LEU  32          HD11      LEU  32  43.788   0.761   2.370
  231   HD12  LEU  32          HD12      LEU  32  44.970   1.283   1.167
  232   HD13  LEU  32          HD13      LEU  32  45.152  -0.280   1.965
  233   HD21  LEU  32          HD21      LEU  32  42.229   0.415  -0.997
  234   HD22  LEU  32          HD22      LEU  32  42.865   1.717   0.007
  235   HD23  LEU  32          HD23      LEU  32  41.663   0.609   0.662
  236    H    LEU  33           H        LEU  33  42.869  -2.475  -0.490
  237    HA   LEU  33           HA       LEU  33  42.306  -3.245   2.079
  238    HG   LEU  33           HG       LEU  33  41.346  -2.610  -1.202
  239    HB2  LEU  33           HB2      LEU  33  40.869  -4.802   0.017
  240    HB3  LEU  33           HB3      LEU  33  40.249  -3.814   1.327
  241   HD11  LEU  33          HD11      LEU  33  38.980  -4.109  -0.936
  242   HD12  LEU  33          HD12      LEU  33  39.544  -3.159  -2.314
  243   HD13  LEU  33          HD13      LEU  33  38.538  -2.406  -1.076
  244   HD21  LEU  33          HD21      LEU  33  41.034  -1.359   1.076
  245   HD22  LEU  33          HD22      LEU  33  39.336  -1.368   0.600
  246   HD23  LEU  33          HD23      LEU  33  40.539  -0.606  -0.439
  247    H    GLN  34           H        GLN  34  42.633  -5.530  -0.578
  248    HA   GLN  34           HA       GLN  34  42.845  -7.900   0.705
  249    HB2  GLN  34           HB2      GLN  34  44.280  -6.812  -1.680
  250    HB3  GLN  34           HB3      GLN  34  44.577  -8.464  -1.148
  251    HG2  GLN  34           HG2      GLN  34  41.866  -7.354  -1.850
  252    HG3  GLN  34           HG3      GLN  34  42.894  -8.264  -2.958
  253   HE21  GLN  34          HE21      GLN  34  40.488  -8.448  -0.637
  254   HE22  GLN  34          HE22      GLN  34  40.517 -10.153  -0.362
  255    H    THR  35           H        THR  35  45.670  -5.872  -0.073
  256    HA   THR  35           HA       THR  35  47.445  -7.400   1.563
  257    HB   THR  35           HB       THR  35  49.103  -5.650   1.003
  258    HG1  THR  35           HG1      THR  35  48.490  -3.784   0.269
  259   HG21  THR  35          HG21      THR  35  49.337  -6.976  -0.768
  260   HG22  THR  35          HG22      THR  35  48.435  -5.735  -1.638
  261   HG23  THR  35          HG23      THR  35  47.596  -7.145  -0.990
  262    H    LYS  36           H        LYS  36  45.095  -5.386   2.443
  263    HA   LYS  36           HA       LYS  36  46.524  -4.622   4.896
  264    HB2  LYS  36           HB2      LYS  36  44.450  -2.902   3.521
  265    HB3  LYS  36           HB3      LYS  36  45.274  -2.530   5.029
  266    HG2  LYS  36           HG2      LYS  36  47.218  -3.056   3.006
  267    HG3  LYS  36           HG3      LYS  36  46.060  -1.861   2.418
  268    HD2  LYS  36           HD2      LYS  36  47.530  -0.479   3.482
  269    HD3  LYS  36           HD3      LYS  36  46.436  -0.832   4.820
  270    HE2  LYS  36           HE2      LYS  36  48.005  -1.959   5.959
  271    HE3  LYS  36           HE3      LYS  36  48.600  -2.776   4.515
  272    HZ1  LYS  36           HZ1      LYS  36  50.382  -1.478   4.959
  273    HZ2  LYS  36           HZ2      LYS  36  49.478  -0.273   5.729
  274    HZ3  LYS  36           HZ3      LYS  36  49.511  -0.356   4.040
  275    H    ASN  37           H        ASN  37  44.826  -6.901   4.166
  276    HA   ASN  37           HA       ASN  37  43.046  -8.100   4.942
  277    HB2  ASN  37           HB2      ASN  37  42.876  -8.243   7.273
  278    HB3  ASN  37           HB3      ASN  37  44.521  -7.648   7.037
  279   HD21  ASN  37          HD21      ASN  37  45.030  -5.558   7.623
  280   HD22  ASN  37          HD22      ASN  37  43.985  -4.578   8.589
  281    H    TYR  38           H        TYR  38  42.483  -5.699   3.516
  282    HA   TYR  38           HA       TYR  38  40.651  -4.511   2.892
  283    HD1  TYR  38           HD1      TYR  38  40.226  -8.098   4.791
  284    HD2  TYR  38           HD2      TYR  38  38.250  -6.014   1.653
  285    HE1  TYR  38           HE1      TYR  38  40.129 -10.177   3.480
  286    HE2  TYR  38           HE2      TYR  38  38.147  -8.086   0.333
  287    HH   TYR  38           HH       TYR  38  38.241 -10.860   1.249
  288    HB2  TYR  38           HB2      TYR  38  39.220  -5.898   5.166
  289    HB3  TYR  38           HB3      TYR  38  38.464  -5.020   3.841
  290    H    ASP  39           H        ASP  39  42.387  -3.009   4.104
  291    HA   ASP  39           HA       ASP  39  40.856  -1.557   6.161
  292    HB2  ASP  39           HB2      ASP  39  42.652  -2.335   7.389
  293    HB3  ASP  39           HB3      ASP  39  43.753  -2.270   6.015
  294    H    ILE  40           H        ILE  40  40.308   0.410   5.695
  295    HA   ILE  40           HA       ILE  40  41.325   1.692   3.318
  296    HB   ILE  40           HB       ILE  40  39.602   3.349   3.662
  297   HG12  ILE  40          HG12      ILE  40  39.928   2.987   6.303
  298   HG13  ILE  40          HG13      ILE  40  38.481   3.715   5.617
  299   HG21  ILE  40          HG21      ILE  40  38.836   0.473   3.892
  300   HG22  ILE  40          HG22      ILE  40  38.714   1.562   2.510
  301   HG23  ILE  40          HG23      ILE  40  37.589   1.721   3.859
  302   HD11  ILE  40          HD11      ILE  40  38.529   0.768   5.973
  303   HD12  ILE  40          HD12      ILE  40  37.186   1.904   6.083
  304   HD13  ILE  40          HD13      ILE  40  38.354   1.789   7.399
  305    H    GLY  41           H        GLY  41  41.652   1.735   6.731
  306    HA2  GLY  41           HA2      GLY  41  42.424   4.205   7.425
  307    HA3  GLY  41           HA3      GLY  41  43.278   2.788   8.001
  308    H    ALA  42           H        ALA  42  44.405   1.869   5.746
  309    HA   ALA  42           HA       ALA  42  46.522   3.786   5.308
  310    HB1  ALA  42           HB1      ALA  42  47.828   2.003   4.953
  311    HB2  ALA  42           HB2      ALA  42  46.718   1.340   3.753
  312    HB3  ALA  42           HB3      ALA  42  46.454   1.023   5.468
  313    H    ALA  43           H        ALA  43  43.756   2.519   3.681
  314    HA   ALA  43           HA       ALA  43  44.298   3.020   1.012
  315    HB1  ALA  43           HB1      ALA  43  41.911   3.488   0.734
  316    HB2  ALA  43           HB2      ALA  43  41.738   3.671   2.480
  317    HB3  ALA  43           HB3      ALA  43  42.166   2.105   1.794
  318    H    LEU  44           H        LEU  44  42.707   5.310   3.202
  319    HA   LEU  44           HA       LEU  44  42.698   7.607   1.808
  320    HG   LEU  44           HG       LEU  44  40.939   8.215   3.399
  321    HB2  LEU  44           HB2      LEU  44  43.465   7.176   4.687
  322    HB3  LEU  44           HB3      LEU  44  43.317   8.785   3.998
  323   HD11  LEU  44          HD11      LEU  44  41.633   5.767   4.995
  324   HD12  LEU  44          HD12      LEU  44  40.886   5.869   3.400
  325   HD13  LEU  44          HD13      LEU  44  39.975   6.347   4.832
  326   HD21  LEU  44          HD21      LEU  44  41.012   7.890   6.311
  327   HD22  LEU  44          HD22      LEU  44  40.278   9.156   5.327
  328   HD23  LEU  44          HD23      LEU  44  42.001   9.214   5.697
  329    H    ASP  45           H        ASP  45  45.455   6.680   3.845
  330    HA   ASP  45           HA       ASP  45  47.265   8.583   3.254
  331    HB2  ASP  45           HB2      ASP  45  47.762   6.797   4.809
  332    HB3  ASP  45           HB3      ASP  45  47.806   5.619   3.499
  333    H    THR  46           H        THR  46  46.451   5.872   1.108
  334    HA   THR  46           HA       THR  46  48.437   6.831  -0.804
  335    HB   THR  46           HB       THR  46  48.259   4.767  -1.914
  336    HG1  THR  46           HG1      THR  46  46.060   4.534  -2.059
  337   HG21  THR  46          HG21      THR  46  47.724   3.953   0.920
  338   HG22  THR  46          HG22      THR  46  49.259   4.648   0.397
  339   HG23  THR  46          HG23      THR  46  48.696   3.128  -0.298
  340    H    ILE  47           H        ILE  47  44.919   6.542  -0.536
  341    HA   ILE  47           HA       ILE  47  44.381   7.100  -3.265
  342    HB   ILE  47           HB       ILE  47  42.170   8.108  -1.962
  343   HG12  ILE  47          HG12      ILE  47  42.903   5.612  -0.459
  344   HG13  ILE  47          HG13      ILE  47  43.350   7.200   0.158
  345   HG21  ILE  47          HG21      ILE  47  41.070   6.148  -2.725
  346   HG22  ILE  47          HG22      ILE  47  42.568   5.224  -2.705
  347   HG23  ILE  47          HG23      ILE  47  42.349   6.512  -3.883
  348   HD11  ILE  47          HD11      ILE  47  40.530   6.785  -0.640
  349   HD12  ILE  47          HD12      ILE  47  41.211   7.759   0.664
  350   HD13  ILE  47          HD13      ILE  47  41.094   6.007   0.839
  351    H    GLN  48           H        GLN  48  44.859   9.195  -0.480
  352    HA   GLN  48           HA       GLN  48  45.530  11.412  -2.089
  353    HB2  GLN  48           HB2      GLN  48  42.695  11.129  -1.320
  354    HB3  GLN  48           HB3      GLN  48  43.401  12.710  -1.017
  355    HG2  GLN  48           HG2      GLN  48  43.339  13.248  -3.167
  356    HG3  GLN  48           HG3      GLN  48  44.094  11.730  -3.645
  357   HE21  GLN  48          HE21      GLN  48  42.209   9.932  -2.728
  358   HE22  GLN  48          HE22      GLN  48  40.755  10.116  -3.651
  359    H    TYR  49           H        TYR  49  46.551  10.048   0.180
  360    HA   TYR  49           HA       TYR  49  46.890  12.332   1.951
  361    HD1  TYR  49           HD2      TYR  49  46.401  13.044   4.356
  362    HD2  TYR  49           HD1      TYR  49  43.364  10.467   2.865
  363    HE1  TYR  49           HE2      TYR  49  44.684  14.602   5.175
  364    HE2  TYR  49           HE1      TYR  49  41.639  12.018   3.678
  365    HH   TYR  49           HH       TYR  49  41.226  13.877   4.821
  366    HB2  TYR  49           HB2      TYR  49  45.568   9.788   2.729
  367    HB3  TYR  49           HB3      TYR  49  46.725  10.466   3.875
  368    H    SER  50           H        SER  50  48.509  10.875  -0.015
  369    HA   SER  50           HA       SER  50  50.523   9.536   1.613
  370    HG   SER  50           HG       SER  50  49.924   9.940  -2.273
  371    HB2  SER  50           HB2      SER  50  51.521   9.649  -0.962
  372    HB3  SER  50           HB3      SER  50  50.600   8.308  -0.278
  373    H    LYS  51           H        LYS  51  50.002  12.419   1.857
  374    HA   LYS  51           HA       LYS  51  52.756  13.311   1.496
  375    HB2  LYS  51           HB2      LYS  51  50.439  14.354   0.031
  376    HB3  LYS  51           HB3      LYS  51  51.372  15.598   0.853
  377    HG2  LYS  51           HG2      LYS  51  52.635  13.554  -0.947
  378    HG3  LYS  51           HG3      LYS  51  52.013  15.096  -1.537
  379    HD2  LYS  51           HD2      LYS  51  54.052  15.899  -1.076
  380    HD3  LYS  51           HD3      LYS  51  53.545  15.846   0.614
  381    HE2  LYS  51           HE2      LYS  51  55.725  14.764   0.260
  382    HE3  LYS  51           HE3      LYS  51  54.510  13.640   0.868
  383    HZ1  LYS  51           HZ1      LYS  51  54.415  12.529  -1.112
  384    HZ2  LYS  51           HZ2      LYS  51  56.042  12.992  -1.119
  385    HZ3  LYS  51           HZ3      LYS  51  54.913  13.859  -2.032
  386    H    HIS  52           H        HIS  52  51.371  12.508   3.824
  387    HA   HIS  52           HA       HIS  52  50.227  14.584   5.301
  388    HD1  HIS  52           HD1      HIS  52  48.579  13.079   7.816
  389    HD2  HIS  52           HD2      HIS  52  52.599  13.800   8.581
  390    HE1  HIS  52           HE1      HIS  52  48.712  13.894  10.205
  391    HB2  HIS  52           HB2      HIS  52  50.130  12.220   5.980
  392    HB3  HIS  52           HB3      HIS  52  51.859  12.244   6.316
  Start of MODEL   30
    1    H1   GLY   1           1H       GLY   1  24.970 -14.787   6.113
    2    H2   GLY   1           2H       GLY   1  24.646 -16.350   5.553
    3    H3   GLY   1           3H       GLY   1  24.506 -15.031   4.504
    4    HA2  GLY   1           HA2      GLY   1  27.037 -15.948   5.759
    5    HA3  GLY   1           HA3      GLY   1  26.547 -16.309   4.111
    6    H    SER   2           H        SER   2  28.712 -15.252   3.758
    7    HA   SER   2           HA       SER   2  28.484 -12.318   3.737
    8    HG   SER   2           HG       SER   2  31.806 -14.551   4.171
    9    HB2  SER   2           HB2      SER   2  31.089 -12.836   3.068
   10    HB3  SER   2           HB3      SER   2  30.520 -12.522   4.709
   11    HA   PRO   3           HA       PRO   3  28.194 -13.007  -0.704
   12    HB2  PRO   3           HB2      PRO   3  26.520 -10.992  -1.210
   13    HB3  PRO   3           HB3      PRO   3  25.965 -12.450  -0.380
   14    HG2  PRO   3           HG2      PRO   3  26.485  -9.742   0.705
   15    HG3  PRO   3           HG3      PRO   3  25.357 -10.983   1.272
   16    HD2  PRO   3           HD2      PRO   3  27.968 -10.390   2.283
   17    HD3  PRO   3           HD3      PRO   3  26.869 -11.676   2.807
   18    HA   PRO   4           HA       PRO   4  31.560 -10.286  -1.855
   19    HB2  PRO   4           HB2      PRO   4  30.484 -10.856  -4.574
   20    HB3  PRO   4           HB3      PRO   4  32.137 -11.001  -3.964
   21    HG2  PRO   4           HG2      PRO   4  30.632 -13.165  -4.359
   22    HG3  PRO   4           HG3      PRO   4  31.731 -13.057  -2.972
   23    HD2  PRO   4           HD2      PRO   4  28.762 -12.780  -3.067
   24    HD3  PRO   4           HD3      PRO   4  29.793 -13.483  -1.804
   25    H    GLU   5           H        GLU   5  30.283  -8.529  -0.920
   26    HA   GLU   5           HA       GLU   5  30.142  -6.220  -2.097
   27    HB2  GLU   5           HB2      GLU   5  27.973  -7.850  -3.305
   28    HB3  GLU   5           HB3      GLU   5  27.574  -6.189  -2.898
   29    HG2  GLU   5           HG2      GLU   5  30.033  -6.035  -4.194
   30    HG3  GLU   5           HG3      GLU   5  29.100  -7.219  -5.109
   31    H    ALA   6           H        ALA   6  30.150  -5.473  -0.039
   32    HA   ALA   6           HA       ALA   6  29.026  -4.280   1.615
   33    HB1  ALA   6           HB1      ALA   6  26.871  -4.770   0.335
   34    HB2  ALA   6           HB2      ALA   6  26.753  -4.503   2.073
   35    HB3  ALA   6           HB3      ALA   6  26.687  -6.143   1.428
   36    H    ASP   7           H        ASP   7  30.694  -6.719   1.661
   37    HA   ASP   7           HA       ASP   7  29.798  -8.123   4.043
   38    HB2  ASP   7           HB2      ASP   7  31.392  -8.843   1.873
   39    HB3  ASP   7           HB3      ASP   7  32.537  -8.659   3.197
   40    HA   PRO   8           HA       PRO   8  31.674  -5.890   7.331
   41    HB2  PRO   8           HB2      PRO   8  33.648  -8.151   7.359
   42    HB3  PRO   8           HB3      PRO   8  32.853  -7.345   8.717
   43    HG2  PRO   8           HG2      PRO   8  31.993  -9.716   7.706
   44    HG3  PRO   8           HG3      PRO   8  30.909  -8.536   8.461
   45    HD2  PRO   8           HD2      PRO   8  31.066  -9.356   5.672
   46    HD3  PRO   8           HD3      PRO   8  29.843  -8.349   6.470
   47    H    ARG   9           H        ARG   9  34.195  -7.576   5.454
   48    HA   ARG   9           HA       ARG   9  36.146  -5.601   5.721
   49    HE   ARG   9           HE       ARG   9  35.701  -9.369   3.059
   50    HB2  ARG   9           HB2      ARG   9  35.892  -7.535   3.422
   51    HB3  ARG   9           HB3      ARG   9  37.365  -6.771   4.017
   52    HG2  ARG   9           HG2      ARG   9  37.318  -8.048   6.017
   53    HG3  ARG   9           HG3      ARG   9  35.692  -8.642   5.673
   54    HD2  ARG   9           HD2      ARG   9  38.172  -9.237   4.063
   55    HD3  ARG   9           HD3      ARG   9  37.390 -10.338   5.197
   56   HH11  ARG   9          HH11      ARG   9  37.863 -11.859   4.165
   57   HH12  ARG   9          HH12      ARG   9  37.266 -13.050   3.060
   58   HH21  ARG   9          HH21      ARG   9  34.901 -10.929   1.600
   59   HH22  ARG   9          HH22      ARG   9  35.581 -12.522   1.603
   60    H    LEU  10           H        LEU  10  33.623  -5.925   3.242
   61    HA   LEU  10           HA       LEU  10  34.764  -3.673   1.793
   62    HG   LEU  10           HG       LEU  10  33.865  -6.979   0.840
   63    HB2  LEU  10           HB2      LEU  10  32.331  -5.285   1.065
   64    HB3  LEU  10           HB3      LEU  10  33.229  -4.192   0.029
   65   HD11  LEU  10          HD11      LEU  10  33.017  -5.929  -1.450
   66   HD12  LEU  10          HD12      LEU  10  34.091  -7.325  -1.391
   67   HD13  LEU  10          HD13      LEU  10  34.751  -5.717  -1.688
   68   HD21  LEU  10          HD21      LEU  10  35.776  -5.832   1.741
   69   HD22  LEU  10          HD22      LEU  10  35.949  -4.876   0.270
   70   HD23  LEU  10          HD23      LEU  10  36.245  -6.614   0.232
   71    H    ILE  11           H        ILE  11  31.991  -4.517   3.718
   72    HA   ILE  11           HA       ILE  11  30.590  -2.060   3.174
   73    HB   ILE  11           HB       ILE  11  29.420  -4.151   3.928
   74   HG12  ILE  11          HG12      ILE  11  29.081  -1.594   5.498
   75   HG13  ILE  11          HG13      ILE  11  28.198  -2.104   4.062
   76   HG21  ILE  11          HG21      ILE  11  30.237  -3.489   6.722
   77   HG22  ILE  11          HG22      ILE  11  31.274  -4.506   5.723
   78   HG23  ILE  11          HG23      ILE  11  29.616  -5.002   6.063
   79   HD11  ILE  11          HD11      ILE  11  27.227  -2.293   6.544
   80   HD12  ILE  11          HD12      ILE  11  27.995  -3.875   6.407
   81   HD13  ILE  11          HD13      ILE  11  26.769  -3.384   5.237
   82    H    GLU  12           H        GLU  12  33.093  -3.123   5.170
   83    HA   GLU  12           HA       GLU  12  32.895  -0.799   6.950
   84    HB2  GLU  12           HB2      GLU  12  33.385  -3.162   7.817
   85    HB3  GLU  12           HB3      GLU  12  34.987  -2.957   7.119
   86    HG2  GLU  12           HG2      GLU  12  35.211  -2.374   9.372
   87    HG3  GLU  12           HG3      GLU  12  35.162  -0.843   8.499
   88    H    SER  13           H        SER  13  35.310  -2.425   4.900
   89    HA   SER  13           HA       SER  13  36.896   0.014   4.860
   90    HG   SER  13           HG       SER  13  37.301  -2.104   6.181
   91    HB2  SER  13           HB2      SER  13  37.586  -2.648   3.626
   92    HB3  SER  13           HB3      SER  13  38.680  -1.314   3.979
   93    H    LEU  14           H        LEU  14  35.179  -2.063   2.488
   94    HA   LEU  14           HA       LEU  14  36.193  -0.634   0.253
   95    HG   LEU  14           HG       LEU  14  34.951  -0.859  -1.808
   96    HB2  LEU  14           HB2      LEU  14  35.132  -2.921   0.167
   97    HB3  LEU  14           HB3      LEU  14  33.577  -2.129   0.309
   98   HD11  LEU  14          HD11      LEU  14  34.907  -3.164  -3.185
   99   HD12  LEU  14          HD12      LEU  14  35.463  -3.753  -1.619
  100   HD13  LEU  14          HD13      LEU  14  36.364  -2.490  -2.456
  101   HD21  LEU  14          HD21      LEU  14  32.794  -2.898  -2.176
  102   HD22  LEU  14          HD22      LEU  14  33.037  -1.362  -3.009
  103   HD23  LEU  14          HD23      LEU  14  32.460  -1.380  -1.342
  104    H    SER  15           H        SER  15  32.895  -0.574   1.599
  105    HA   SER  15           HA       SER  15  31.860   1.532   0.219
  106    HG   SER  15           HG       SER  15  29.935  -0.142   1.371
  107    HB2  SER  15           HB2      SER  15  31.392   0.391   2.881
  108    HB3  SER  15           HB3      SER  15  30.932   2.088   2.754
  109    H    GLN  16           H        GLN  16  33.582   1.870   3.321
  110    HA   GLN  16           HA       GLN  16  33.678   4.537   3.628
  111    HB2  GLN  16           HB2      GLN  16  35.201   4.122   5.221
  112    HB3  GLN  16           HB3      GLN  16  34.968   2.436   4.793
  113    HG2  GLN  16           HG2      GLN  16  37.288   2.769   4.874
  114    HG3  GLN  16           HG3      GLN  16  36.875   2.720   3.160
  115   HE21  GLN  16          HE21      GLN  16  37.980   4.140   2.039
  116   HE22  GLN  16          HE22      GLN  16  38.434   5.726   2.553
  117    H    MET  17           H        MET  17  35.246   2.803   1.072
  118    HA   MET  17           HA       MET  17  36.804   5.176   0.362
  119    HB2  MET  17           HB2      MET  17  38.067   3.119   0.381
  120    HB3  MET  17           HB3      MET  17  36.901   2.344  -0.683
  121    HG2  MET  17           HG2      MET  17  37.533   3.719  -2.511
  122    HG3  MET  17           HG3      MET  17  38.510   4.755  -1.471
  123    HE1  MET  17           HE1      MET  17  40.674   2.545  -4.097
  124    HE2  MET  17           HE2      MET  17  40.644   4.207  -3.506
  125    HE3  MET  17           HE3      MET  17  39.182   3.484  -4.177
  126    H    LEU  18           H        LEU  18  34.148   3.160  -0.762
  127    HA   LEU  18           HA       LEU  18  34.060   4.324  -3.371
  128    HG   LEU  18           HG       LEU  18  32.660   0.912  -3.457
  129    HB2  LEU  18           HB2      LEU  18  32.247   2.535  -1.807
  130    HB3  LEU  18           HB3      LEU  18  31.689   3.255  -3.307
  131   HD11  LEU  18          HD11      LEU  18  33.620   3.206  -5.135
  132   HD12  LEU  18          HD12      LEU  18  32.328   2.055  -5.475
  133   HD13  LEU  18          HD13      LEU  18  34.012   1.533  -5.531
  134   HD21  LEU  18          HD21      LEU  18  35.319   2.293  -3.386
  135   HD22  LEU  18          HD22      LEU  18  34.963   0.568  -3.327
  136   HD23  LEU  18          HD23      LEU  18  34.616   1.589  -1.931
  137    H    SER  19           H        SER  19  31.525   4.494  -0.838
  138    HA   SER  19           HA       SER  19  30.397   6.830  -2.021
  139    HG   SER  19           HG       SER  19  30.286   5.456   1.389
  140    HB2  SER  19           HB2      SER  19  28.941   6.721   0.103
  141    HB3  SER  19           HB3      SER  19  28.831   5.386  -1.044
  142    H    MET  20           H        MET  20  33.173   6.779  -0.575
  143    HA   MET  20           HA       MET  20  32.670   9.134   1.118
  144    HB2  MET  20           HB2      MET  20  33.984   6.883   1.838
  145    HB3  MET  20           HB3      MET  20  35.328   7.852   1.250
  146    HG2  MET  20           HG2      MET  20  33.368   8.645   3.393
  147    HG3  MET  20           HG3      MET  20  35.029   8.116   3.644
  148    HE1  MET  20           HE1      MET  20  33.844  12.270   3.669
  149    HE2  MET  20           HE2      MET  20  33.419  10.819   4.576
  150    HE3  MET  20           HE3      MET  20  32.688  11.118   2.999
  151    H    GLY  21           H        GLY  21  33.573   8.328  -1.919
  152    HA2  GLY  21           HA2      GLY  21  34.369   9.689  -3.606
  153    HA3  GLY  21           HA3      GLY  21  34.722  10.921  -2.400
  154    H    PHE  22           H        PHE  22  35.924   7.582  -2.382
  155    HA   PHE  22           HA       PHE  22  38.607   8.634  -2.975
  156    HD1  PHE  22           HD1      PHE  22  38.684  10.085  -1.445
  157    HD2  PHE  22           HD2      PHE  22  37.758   7.001   1.337
  158    HE1  PHE  22           HE1      PHE  22  38.268  11.779   0.290
  159    HE2  PHE  22           HE2      PHE  22  37.338   8.689   3.076
  160    HZ   PHE  22           HZ       PHE  22  37.593  11.080   2.551
  161    HB2  PHE  22           HB2      PHE  22  38.002   6.486  -0.932
  162    HB3  PHE  22           HB3      PHE  22  39.570   7.220  -1.274
  163    H    SER  23           H        SER  23  39.524   7.617  -4.636
  164    HA   SER  23           HA       SER  23  38.562   4.907  -5.222
  165    HG   SER  23           HG       SER  23  37.203   7.061  -6.027
  166    HB2  SER  23           HB2      SER  23  39.355   7.008  -7.254
  167    HB3  SER  23           HB3      SER  23  38.786   5.379  -7.615
  168    H    ASP  24           H        ASP  24  40.252   4.207  -7.231
  169    HA   ASP  24           HA       ASP  24  42.705   3.713  -5.811
  170    HB2  ASP  24           HB2      ASP  24  43.316   2.314  -7.688
  171    HB3  ASP  24           HB3      ASP  24  41.625   2.008  -7.288
  172    H    GLU  25           H        GLU  25  44.395   5.060  -5.797
  173    HA   GLU  25           HA       GLU  25  44.531   7.171  -7.799
  174    HB2  GLU  25           HB2      GLU  25  44.949   7.347  -5.198
  175    HB3  GLU  25           HB3      GLU  25  46.581   6.874  -5.649
  176    HG2  GLU  25           HG2      GLU  25  45.971   8.873  -7.445
  177    HG3  GLU  25           HG3      GLU  25  45.231   9.420  -5.943
  178    H    GLY  26           H        GLY  26  45.079   4.431  -8.588
  179    HA2  GLY  26           HA2      GLY  26  47.036   4.685 -10.427
  180    HA3  GLY  26           HA3      GLY  26  47.944   4.270  -8.982
  181    H    GLY  27           H        GLY  27  44.896   2.748  -8.942
  182    HA2  GLY  27           HA2      GLY  27  44.187   0.651  -9.644
  183    HA3  GLY  27           HA3      GLY  27  45.678   0.483 -10.558
  184    H    TRP  28           H        TRP  28  45.853   1.415  -7.248
  185    HA   TRP  28           HA       TRP  28  47.182  -1.092  -6.604
  186    HD1  TRP  28           HD1      TRP  28  47.851   3.235  -6.606
  187    HE1  TRP  28           HE1      TRP  28  46.324   5.053  -5.642
  188    HE3  TRP  28           HE3      TRP  28  45.347   0.473  -3.113
  189    HZ2  TRP  28           HZ2      TRP  28  44.326   5.313  -3.675
  190    HZ3  TRP  28           HZ3      TRP  28  43.646   1.580  -1.729
  191    HH2  TRP  28           HH2      TRP  28  43.148   3.950  -2.005
  192    HB2  TRP  28           HB2      TRP  28  47.702   0.187  -4.448
  193    HB3  TRP  28           HB3      TRP  28  48.424   0.812  -5.937
  194    H    LEU  29           H        LEU  29  44.325   0.783  -5.695
  195    HA   LEU  29           HA       LEU  29  43.526  -0.174  -3.342
  196    HG   LEU  29           HG       LEU  29  40.752  -1.467  -4.245
  197    HB2  LEU  29           HB2      LEU  29  42.042   1.246  -4.493
  198    HB3  LEU  29           HB3      LEU  29  41.910   0.146  -5.856
  199   HD11  LEU  29          HD11      LEU  29  41.217   0.829  -2.491
  200   HD12  LEU  29          HD12      LEU  29  40.878  -0.855  -2.094
  201   HD13  LEU  29          HD13      LEU  29  39.554   0.241  -2.486
  202   HD21  LEU  29          HD21      LEU  29  39.797   0.430  -5.931
  203   HD22  LEU  29          HD22      LEU  29  39.012   0.893  -4.421
  204   HD23  LEU  29          HD23      LEU  29  38.792  -0.734  -5.065
  205    H    THR  30           H        THR  30  42.418  -1.933  -6.240
  206    HA   THR  30           HA       THR  30  41.565  -4.236  -5.126
  207    HB   THR  30           HB       THR  30  43.354  -4.324  -7.550
  208    HG1  THR  30           HG1      THR  30  40.751  -3.253  -7.300
  209   HG21  THR  30          HG21      THR  30  40.835  -5.636  -7.831
  210   HG22  THR  30          HG22      THR  30  41.652  -6.213  -6.378
  211   HG23  THR  30          HG23      THR  30  42.462  -6.303  -7.941
  212    H    ARG  31           H        ARG  31  44.878  -3.176  -5.393
  213    HA   ARG  31           HA       ARG  31  45.914  -5.725  -4.447
  214    HE   ARG  31           HE       ARG  31  50.635  -3.319  -3.548
  215    HB2  ARG  31           HB2      ARG  31  47.788  -5.120  -5.511
  216    HB3  ARG  31           HB3      ARG  31  46.914  -3.724  -6.110
  217    HG2  ARG  31           HG2      ARG  31  47.743  -2.360  -4.321
  218    HG3  ARG  31           HG3      ARG  31  48.482  -3.759  -3.539
  219    HD2  ARG  31           HD2      ARG  31  49.644  -3.943  -5.941
  220    HD3  ARG  31           HD3      ARG  31  49.364  -2.204  -5.901
  221   HH11  ARG  31          HH11      ARG  31  51.053  -1.792  -6.651
  222   HH12  ARG  31          HH12      ARG  31  52.649  -1.220  -6.300
  223   HH21  ARG  31          HH21      ARG  31  52.742  -2.567  -3.075
  224   HH22  ARG  31          HH22      ARG  31  53.611  -1.664  -4.271
  225    H    LEU  32           H        LEU  32  46.105  -2.294  -3.439
  226    HA   LEU  32           HA       LEU  32  47.343  -2.553  -1.021
  227    HG   LEU  32           HG       LEU  32  46.255   0.912  -0.241
  228    HB2  LEU  32           HB2      LEU  32  46.586  -0.455  -2.154
  229    HB3  LEU  32           HB3      LEU  32  44.966  -0.771  -1.552
  230   HD11  LEU  32          HD11      LEU  32  45.532   0.135   1.889
  231   HD12  LEU  32          HD12      LEU  32  45.566  -1.544   1.352
  232   HD13  LEU  32          HD13      LEU  32  44.372  -0.428   0.687
  233   HD21  LEU  32          HD21      LEU  32  48.351  -0.761  -0.504
  234   HD22  LEU  32          HD22      LEU  32  47.804  -1.181   1.119
  235   HD23  LEU  32          HD23      LEU  32  48.231   0.488   0.736
  236    H    LEU  33           H        LEU  33  43.785  -2.423  -1.334
  237    HA   LEU  33           HA       LEU  33  43.183  -3.210   1.263
  238    HG   LEU  33           HG       LEU  33  40.833  -2.669   1.608
  239    HB2  LEU  33           HB2      LEU  33  41.775  -2.887  -1.254
  240    HB3  LEU  33           HB3      LEU  33  41.122  -4.222  -0.319
  241   HD11  LEU  33          HD11      LEU  33  41.296  -0.432   1.517
  242   HD12  LEU  33          HD12      LEU  33  41.167  -0.363  -0.241
  243   HD13  LEU  33          HD13      LEU  33  42.603  -1.060   0.512
  244   HD21  LEU  33          HD21      LEU  33  39.255  -3.029  -0.617
  245   HD22  LEU  33          HD22      LEU  33  39.306  -1.275  -0.441
  246   HD23  LEU  33          HD23      LEU  33  38.752  -2.281   0.899
  247    H    GLN  34           H        GLN  34  42.784  -5.270  -1.604
  248    HA   GLN  34           HA       GLN  34  42.216  -7.666  -0.630
  249    HB2  GLN  34           HB2      GLN  34  44.106  -6.867  -2.788
  250    HB3  GLN  34           HB3      GLN  34  43.914  -8.574  -2.405
  251    HG2  GLN  34           HG2      GLN  34  41.895  -6.647  -3.489
  252    HG3  GLN  34           HG3      GLN  34  42.408  -8.201  -4.142
  253   HE21  GLN  34          HE21      GLN  34  40.185  -6.557  -2.180
  254   HE22  GLN  34          HE22      GLN  34  39.307  -7.931  -1.610
  255    H    THR  35           H        THR  35  45.374  -6.164  -0.259
  256    HA   THR  35           HA       THR  35  46.635  -8.527   0.787
  257    HB   THR  35           HB       THR  35  47.415  -5.609   0.803
  258    HG1  THR  35           HG1      THR  35  48.304  -6.109  -1.011
  259   HG21  THR  35          HG21      THR  35  49.402  -6.012   1.843
  260   HG22  THR  35          HG22      THR  35  49.380  -7.734   1.463
  261   HG23  THR  35          HG23      THR  35  48.342  -7.098   2.740
  262    H    LYS  36           H        LYS  36  45.919  -5.417   2.281
  263    HA   LYS  36           HA       LYS  36  46.042  -6.405   4.949
  264    HB2  LYS  36           HB2      LYS  36  44.966  -3.817   3.828
  265    HB3  LYS  36           HB3      LYS  36  45.114  -4.155   5.547
  266    HG2  LYS  36           HG2      LYS  36  47.214  -3.471   5.514
  267    HG3  LYS  36           HG3      LYS  36  47.614  -4.712   4.324
  268    HD2  LYS  36           HD2      LYS  36  47.120  -3.249   2.513
  269    HD3  LYS  36           HD3      LYS  36  46.389  -2.059   3.592
  270    HE2  LYS  36           HE2      LYS  36  48.413  -1.071   3.407
  271    HE3  LYS  36           HE3      LYS  36  48.837  -2.213   4.681
  272    HZ1  LYS  36           HZ1      LYS  36  49.724  -3.710   3.039
  273    HZ2  LYS  36           HZ2      LYS  36  50.449  -2.193   2.855
  274    HZ3  LYS  36           HZ3      LYS  36  49.241  -2.689   1.779
  275    H    ASN  37           H        ASN  37  44.190  -8.007   3.519
  276    HA   ASN  37           HA       ASN  37  42.070  -8.826   3.542
  277    HB2  ASN  37           HB2      ASN  37  41.137  -9.128   5.701
  278    HB3  ASN  37           HB3      ASN  37  42.882  -9.083   5.948
  279   HD21  ASN  37          HD21      ASN  37  43.801  -7.362   7.014
  280   HD22  ASN  37          HD22      ASN  37  42.871  -6.205   7.896
  281    H    TYR  38           H        TYR  38  42.220  -6.402   2.280
  282    HA   TYR  38           HA       TYR  38  40.958  -4.664   1.524
  283    HD1  TYR  38           HD2      TYR  38  41.179  -6.968   0.762
  284    HD2  TYR  38           HD1      TYR  38  37.147  -7.518   2.005
  285    HE1  TYR  38           HE2      TYR  38  41.195  -9.231  -0.200
  286    HE2  TYR  38           HE1      TYR  38  37.153  -9.780   1.050
  287    HH   TYR  38           HH       TYR  38  38.937 -10.865  -1.101
  288    HB2  TYR  38           HB2      TYR  38  38.538  -5.715   2.932
  289    HB3  TYR  38           HB3      TYR  38  38.680  -5.029   1.320
  290    H    ASP  39           H        ASP  39  42.363  -3.684   3.344
  291    HA   ASP  39           HA       ASP  39  40.569  -2.421   5.317
  292    HB2  ASP  39           HB2      ASP  39  43.322  -3.505   5.561
  293    HB3  ASP  39           HB3      ASP  39  42.953  -2.034   6.463
  294    H    ILE  40           H        ILE  40  40.262  -0.313   5.122
  295    HA   ILE  40           HA       ILE  40  41.741   1.192   3.202
  296    HB   ILE  40           HB       ILE  40  40.297   3.033   3.724
  297   HG12  ILE  40          HG12      ILE  40  40.421   2.512   6.258
  298   HG13  ILE  40          HG13      ILE  40  38.943   3.222   5.621
  299   HG21  ILE  40          HG21      ILE  40  38.768   2.021   2.492
  300   HG22  ILE  40          HG22      ILE  40  38.088   1.306   3.953
  301   HG23  ILE  40          HG23      ILE  40  39.327   0.442   3.042
  302   HD11  ILE  40          HD11      ILE  40  38.602   0.450   5.444
  303   HD12  ILE  40          HD12      ILE  40  37.822   1.568   6.562
  304   HD13  ILE  40          HD13      ILE  40  39.320   0.759   7.022
  305    H    GLY  41           H        GLY  41  41.974   0.451   6.494
  306    HA2  GLY  41           HA2      GLY  41  42.954   2.518   7.817
  307    HA3  GLY  41           HA3      GLY  41  43.722   0.945   7.910
  308    H    ALA  42           H        ALA  42  44.637   0.760   5.344
  309    HA   ALA  42           HA       ALA  42  46.811   2.717   5.348
  310    HB1  ALA  42           HB1      ALA  42  47.409   0.299   5.466
  311    HB2  ALA  42           HB2      ALA  42  48.097   1.131   4.071
  312    HB3  ALA  42           HB3      ALA  42  46.685   0.090   3.872
  313    H    ALA  43           H        ALA  43  44.246   1.372   3.419
  314    HA   ALA  43           HA       ALA  43  44.884   2.446   0.923
  315    HB1  ALA  43           HB1      ALA  43  42.042   2.488   1.866
  316    HB2  ALA  43           HB2      ALA  43  42.869   0.944   1.658
  317    HB3  ALA  43           HB3      ALA  43  42.693   2.042   0.289
  318    H    LEU  44           H        LEU  44  43.160   3.829   3.645
  319    HA   LEU  44           HA       LEU  44  42.422   6.305   2.691
  320    HG   LEU  44           HG       LEU  44  41.052   7.255   4.398
  321    HB2  LEU  44           HB2      LEU  44  43.017   5.150   5.301
  322    HB3  LEU  44           HB3      LEU  44  43.394   6.865   5.228
  323   HD11  LEU  44          HD11      LEU  44  40.364   5.191   3.547
  324   HD12  LEU  44          HD12      LEU  44  39.464   5.362   5.052
  325   HD13  LEU  44          HD13      LEU  44  40.883   4.318   4.989
  326   HD21  LEU  44          HD21      LEU  44  41.332   7.838   6.613
  327   HD22  LEU  44          HD22      LEU  44  41.716   6.190   7.110
  328   HD23  LEU  44          HD23      LEU  44  40.052   6.631   6.726
  329    H    ASP  45           H        ASP  45  45.375   5.763   4.588
  330    HA   ASP  45           HA       ASP  45  46.696   8.082   4.182
  331    HB2  ASP  45           HB2      ASP  45  47.699   6.420   5.559
  332    HB3  ASP  45           HB3      ASP  45  47.790   5.271   4.227
  333    H    THR  46           H        THR  46  46.168   5.596   1.776
  334    HA   THR  46           HA       THR  46  47.982   6.917  -0.092
  335    HB   THR  46           HB       THR  46  47.956   4.986  -1.379
  336    HG1  THR  46           HG1      THR  46  45.790   4.676  -1.681
  337   HG21  THR  46          HG21      THR  46  48.014   4.530   1.478
  338   HG22  THR  46          HG22      THR  46  49.050   3.888   0.203
  339   HG23  THR  46          HG23      THR  46  47.516   3.100   0.575
  340    H    ILE  47           H        ILE  47  44.519   6.062   0.094
  341    HA   ILE  47           HA       ILE  47  43.867   6.989  -2.467
  342    HB   ILE  47           HB       ILE  47  41.566   7.548  -1.036
  343   HG12  ILE  47          HG12      ILE  47  42.565   4.949   0.072
  344   HG13  ILE  47          HG13      ILE  47  42.913   6.455   0.916
  345   HG21  ILE  47          HG21      ILE  47  42.553   5.604  -2.909
  346   HG22  ILE  47          HG22      ILE  47  40.936   6.286  -2.743
  347   HG23  ILE  47          HG23      ILE  47  41.396   4.870  -1.798
  348   HD11  ILE  47          HD11      ILE  47  40.717   6.801   1.477
  349   HD12  ILE  47          HD12      ILE  47  40.821   5.041   1.535
  350   HD13  ILE  47          HD13      ILE  47  40.108   5.834   0.131
  351    H    GLN  48           H        GLN  48  43.996   8.791   0.595
  352    HA   GLN  48           HA       GLN  48  44.418  11.220  -0.800
  353    HB2  GLN  48           HB2      GLN  48  41.645  10.513  -0.097
  354    HB3  GLN  48           HB3      GLN  48  42.143  12.138   0.355
  355    HG2  GLN  48           HG2      GLN  48  41.985  12.849  -1.734
  356    HG3  GLN  48           HG3      GLN  48  42.982  11.522  -2.328
  357   HE21  GLN  48          HE21      GLN  48  41.982   9.593  -2.979
  358   HE22  GLN  48          HE22      GLN  48  40.300   9.541  -3.397
  359    H    TYR  49           H        TYR  49  45.439   9.670   1.537
  360    HA   TYR  49           HA       TYR  49  45.425  11.915   3.414
  361    HD1  TYR  49           HD2      TYR  49  43.977  12.238   5.648
  362    HD2  TYR  49           HD1      TYR  49  42.681   8.764   3.560
  363    HE1  TYR  49           HE2      TYR  49  41.637  12.895   6.018
  364    HE2  TYR  49           HE1      TYR  49  40.338   9.414   3.923
  365    HH   TYR  49           HH       TYR  49  39.262  11.303   6.079
  366    HB2  TYR  49           HB2      TYR  49  44.946   9.007   4.074
  367    HB3  TYR  49           HB3      TYR  49  45.468  10.180   5.283
  368    H    SER  50           H        SER  50  47.276  10.728   1.329
  369    HA   SER  50           HA       SER  50  49.524   9.807   2.918
  370    HG   SER  50           HG       SER  50  49.799  10.509  -0.995
  371    HB2  SER  50           HB2      SER  50  50.296   8.907   0.998
  372    HB3  SER  50           HB3      SER  50  48.713   9.298   0.327
  373    H    LYS  51           H        LYS  51  48.364  12.615   2.965
  374    HA   LYS  51           HA       LYS  51  49.437  14.543   3.700
  375    HB2  LYS  51           HB2      LYS  51  51.632  13.234   3.611
  376    HB3  LYS  51           HB3      LYS  51  51.809  13.863   1.980
  377    HG2  LYS  51           HG2      LYS  51  52.211  15.993   2.695
  378    HG3  LYS  51           HG3      LYS  51  51.292  15.782   4.188
  379    HD2  LYS  51           HD2      LYS  51  53.084  14.279   5.018
  380    HD3  LYS  51           HD3      LYS  51  54.013  14.641   3.562
  381    HE2  LYS  51           HE2      LYS  51  53.136  17.077   4.796
  382    HE3  LYS  51           HE3      LYS  51  53.968  16.072   5.981
  383    HZ1  LYS  51           HZ1      LYS  51  55.130  16.571   3.312
  384    HZ2  LYS  51           HZ2      LYS  51  55.908  16.066   4.725
  385    HZ3  LYS  51           HZ3      LYS  51  55.358  17.659   4.587
  386    H    HIS  52           H        HIS  52  48.418  13.492   0.861
  387    HA   HIS  52           HA       HIS  52  47.334  14.648  -0.822
  388    HD1  HIS  52           HD1      HIS  52  48.009  18.615  -2.066
  389    HD2  HIS  52           HD2      HIS  52  44.983  16.204  -0.553
  390    HE1  HIS  52           HE1      HIS  52  45.901  19.259  -3.305
  391    HB2  HIS  52           HB2      HIS  52  47.517  16.625   0.907
  392    HB3  HIS  52           HB3      HIS  52  48.791  17.183  -0.174