*HEADER    STRUCTURAL GENOMICS                     13-MAY-07   2JPI              
*TITLE     CHEMICAL SHIFT ASSIGNMENTS OF PA4090 FROM PSEUDOMONAS                 
*TITLE    2 AERUGINOSA                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA;                         
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 CELL_LINE: BL21;                                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI                                  
*KEYWDS    ALPHA-HELIX/BETA-SHEET, STRUCTURAL GENOMICS, ONTARIO CENTRE           
*KEYWDS   2 FOR STRUCTURAL PROTEOMICS, OCSP                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    X.AI, A.SEMESI, A.YEE, C.H.ARROWSMITH, S.S.C.LI, W.CHOY,              
*AUTHOR   2 ONTARIO CENTRE FOR STRUCTURAL PROTEOMICS (OCSP)                      
*REVDAT   1   16-OCT-07 2JPI    0                                                


assign (resid   10 and  name HA   )(resid   10 and  name HG2* ) 4.4 1.4 0.0
assign (resid   10 and  name HA   )(resid   11 and  name HN   ) 6.0 4.2 0.0
assign (resid   10 and  name HA   )(resid   82 and  name HB*  ) 5.2 1.4 0.0
assign (resid   10 and  name HG2* )(resid   10 and  name HN   ) 4.5 1.6 0.0
assign (resid   10 and  name HG2* )(resid   13 and  name HA   ) 4.1 1.4 0.0
assign (resid   10 and  name HG2* )(resid   13 and  name HN   ) 4.2 1.5 0.0
assign (resid   10 and  name HG2* )(resid   16 and  name HB2  ) 5.9 1.4 0.0
assign (resid   10 and  name HG2* )(resid   16 and  name HD*  ) 4.3 1.4 0.0
assign (resid   10 and  name HG2* )(resid   53 and  name HA   ) 3.9 1.4 0.0
assign (resid   10 and  name HG2* )(resid   54 and  name HA   ) 4.5 1.4 0.0
assign (resid   10 and  name HG2* )(resid   54 and  name HB*  ) 5.3 1.9 0.0
assign (resid   10 and  name HG2* )(resid   54 and  name HN   ) 5.6 2.3 0.0
assign (resid   10 and  name HG2* )(resid   55 and  name HB   ) 4.5 2.0 0.0
assign (resid   10 and  name HG2* )(resid   55 and  name HN   ) 4.5 1.9 0.0
assign (resid   10 and  name HG2* )(resid   81 and  name HG2  ) 4.5 1.4 0.0
assign (resid   10 and  name HN   )(resid   53 and  name HA   ) 4.7 1.4 0.0
assign (resid   10 and  name HN   )(resid   54 and  name HA   ) 6.0 4.2 0.0
assign (resid   10 and  name HN   )(resid   54 and  name HB1  ) 4.3 1.6 0.0
assign (resid   10 and  name HN   )(resid   54 and  name HB2  ) 4.5 1.7 0.0
assign (resid   10 and  name HN   )(resid   54 and  name HN   ) 5.2 2.0 0.0
assign (resid   10 and  name HN   )(resid   55 and  name HN   ) 4.3 1.5 0.0
assign (resid   10 and  name HN   )(resid    9 and  name HB1  ) 6.0 4.2 0.0
assign (resid   10 and  name HN   )(resid    9 and  name HG1  ) 6.0 4.2 0.0
assign (resid   11 and  name HB*  )(resid   11 and  name HN   ) 6.0 4.2 0.0
assign (resid   11 and  name HB*  )(resid   12 and  name HN   ) 4.6 1.4 0.0
assign (resid   11 and  name HB*  )(resid   13 and  name HN   ) 4.6 1.4 0.0
assign (resid   11 and  name HG*  )(resid   11 and  name HN   ) 3.9 1.4 0.0
assign (resid   11 and  name HG*  )(resid   12 and  name HN   ) 4.3 1.5 0.0
assign (resid   11 and  name HG*  )(resid   12 and  name HN   ) 4.5 1.4 0.0
assign (resid   11 and  name HG*  )(resid   13 and  name HN   ) 4.7 1.4 0.0
assign (resid   11 and  name HG*  )(resid   53 and  name HA   ) 4.1 1.4 0.0
assign (resid   11 and  name HG*  )(resid   53 and  name HB*  ) 4.8 1.4 0.0
assign (resid   11 and  name HN   )(resid   82 and  name HB*  ) 5.6 1.4 0.0
assign (resid   12 and  name HB1  )(resid   12 and  name HN   ) 4.5 1.7 0.0
assign (resid   12 and  name HB1  )(resid   15 and  name HB*  ) 5.1 1.7 0.0
assign (resid   12 and  name HB1  )(resid   15 and  name HN   ) 5.5 2.3 0.0
assign (resid   12 and  name HB*  )(resid   13 and  name HN   ) 6.0 4.2 0.0
assign (resid   12 and  name HB*  )(resid   15 and  name HB2  ) 5.0 2.1 0.0
assign (resid   12 and  name HB*  )(resid   16 and  name HD*  ) 5.4 1.4 0.0
assign (resid   12 and  name HB2  )(resid   12 and  name HN   ) 4.4 1.8 0.0
assign (resid   12 and  name HB2  )(resid   13 and  name HN   ) 5.2 1.9 0.0
assign (resid   12 and  name HB2  )(resid   52 and  name HA   ) 4.7 1.4 0.0
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 4.2 1.5 0.0
assign (resid   13 and  name HA   )(resid   13 and  name HN   ) 4.0 1.6 0.0
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 5.2 2.2 0.0
assign (resid   13 and  name HA   )(resid   16 and  name HA   ) 6.0 4.2 0.0
assign (resid   13 and  name HA   )(resid   16 and  name HB2  ) 4.7 1.5 0.0
assign (resid   13 and  name HA   )(resid   16 and  name HD*  ) 4.3 1.4 0.0
assign (resid   13 and  name HA   )(resid   50 and  name HA   ) 4.9 1.4 0.0
assign (resid   13 and  name HA   )(resid   50 and  name HB*  ) 4.3 1.4 0.0
assign (resid   13 and  name HA   )(resid   51 and  name HN   ) 5.3 1.4 0.0
assign (resid   13 and  name HA   )(resid   55 and  name HB   ) 4.5 1.4 0.0
assign (resid   13 and  name HA   )(resid   55 and  name HG*  ) 3.8 1.4 0.0
assign (resid   13 and  name HB*  )(resid   13 and  name HN   ) 3.7 1.4 0.0
assign (resid   13 and  name HB*  )(resid   15 and  name HN   ) 5.6 1.4 0.0
assign (resid   13 and  name HB*  )(resid   16 and  name HD*  ) 5.7 1.4 0.0
assign (resid   13 and  name HB*  )(resid   50 and  name HA   ) 4.0 1.5 0.0
assign (resid   13 and  name HB*  )(resid   50 and  name HN   ) 4.9 1.4 0.0
assign (resid   13 and  name HB*  )(resid   51 and  name HB*  ) 5.0 1.4 0.0
assign (resid   13 and  name HB*  )(resid   51 and  name HN   ) 4.3 1.7 0.0
assign (resid   13 and  name HB*  )(resid   54 and  name HA   ) 5.5 1.4 0.0
assign (resid   13 and  name HB*  )(resid   54 and  name HN   ) 4.7 1.4 0.0
assign (resid   13 and  name HB*  )(resid   55 and  name HB   ) 4.2 1.7 0.0
assign (resid   13 and  name HB*  )(resid   55 and  name HG*  ) 3.4 1.4 0.0
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 4.5 1.7 0.0
assign (resid   13 and  name HN   )(resid   15 and  name HN   ) 4.9 1.4 0.0
assign (resid   13 and  name HN   )(resid   50 and  name HA   ) 6.0 4.2 0.0
assign (resid   13 and  name HN   )(resid   51 and  name HA   ) 5.4 1.4 0.0
assign (resid   13 and  name HN   )(resid   51 and  name HN   ) 5.4 1.5 0.0
assign (resid   13 and  name HN   )(resid   54 and  name HN   ) 5.7 1.4 0.0
assign (resid   14 and  name HA   )(resid   14 and  name HN   ) 4.2 1.4 0.0
assign (resid   14 and  name HA   )(resid   15 and  name HN   ) 4.6 1.8 0.0
assign (resid   14 and  name HA   )(resid   17 and  name HA   ) 6.0 4.2 0.0
assign (resid   14 and  name HA   )(resid   17 and  name HG1* ) 4.5 1.9 0.0
assign (resid   14 and  name HA   )(resid   17 and  name HG2* ) 5.0 2.1 0.0
assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 4.7 1.5 0.0
assign (resid   14 and  name HA   )(resid   18 and  name HN   ) 5.0 1.6 0.0
assign (resid   14 and  name HA   )(resid   50 and  name HA   ) 4.4 1.4 0.0
assign (resid   14 and  name HA   )(resid   50 and  name HB*  ) 6.0 4.2 0.0
assign (resid   14 and  name HA   )(resid   50 and  name HN   ) 5.3 1.4 0.0
assign (resid   14 and  name HB*  )(resid   15 and  name HN   ) 4.0 1.7 0.0
assign (resid   14 and  name HB*  )(resid   16 and  name HN   ) 5.1 2.0 0.0
assign (resid   14 and  name HB*  )(resid   18 and  name HN   ) 5.2 1.9 0.0
assign (resid   14 and  name HB*  )(resid   34 and  name HA   ) 4.6 1.4 0.0
assign (resid   14 and  name HB*  )(resid   50 and  name HA   ) 4.6 1.4 0.0
assign (resid   14 and  name HB*  )(resid   50 and  name HB*  ) 3.6 1.4 0.0
assign (resid   14 and  name HB*  )(resid   50 and  name HN   ) 5.3 2.1 0.0
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 4.3 1.4 0.0
assign (resid   14 and  name HN   )(resid   50 and  name HB*  ) 4.6 1.8 0.0
assign (resid   15 and  name HA   )(resid   15 and  name HG*  ) 3.7 1.4 0.0
assign (resid   15 and  name HA   )(resid   15 and  name HN   ) 3.8 1.4 0.0
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 4.4 1.5 0.0
assign (resid   15 and  name HA   )(resid   17 and  name HN   ) 5.5 2.2 0.0
assign (resid   15 and  name HA   )(resid   18 and  name HB2  ) 3.8 1.5 0.0
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 4.1 1.4 0.0
assign (resid   15 and  name HA   )(resid   19 and  name HN   ) 3.8 1.4 0.0
assign (resid   15 and  name HB1  )(resid   16 and  name HN   ) 4.1 1.4 0.0
assign (resid   15 and  name HB1  )(resid   17 and  name HN   ) 4.8 1.4 0.0
assign (resid   15 and  name HB*  )(resid   15 and  name HD*  ) 3.8 1.4 0.0
assign (resid   15 and  name HB*  )(resid   15 and  name HN   ) 3.8 1.6 0.0
assign (resid   15 and  name HB2  )(resid   15 and  name HN   ) 4.0 1.9 0.0
assign (resid   15 and  name HB2  )(resid   16 and  name HN   ) 3.8 1.4 0.0
assign (resid   15 and  name HD*  )(resid   15 and  name HN   ) 4.2 1.4 0.0
assign (resid   15 and  name HD*  )(resid   16 and  name HA   ) 4.4 1.4 0.0
assign (resid   15 and  name HD*  )(resid   16 and  name HD*  ) 4.3 1.4 0.0
assign (resid   15 and  name HD*  )(resid   16 and  name HN   ) 4.6 1.4 0.0
assign (resid   15 and  name HD*  )(resid   18 and  name HB2  ) 3.9 1.4 0.0
assign (resid   15 and  name HD*  )(resid   18 and  name HN   ) 5.2 1.4 0.0
assign (resid   15 and  name HD*  )(resid   19 and  name HD*  ) 3.0 1.2 0.0
assign (resid   15 and  name HD*  )(resid   19 and  name HG1  ) 4.0 1.8 0.0
assign (resid   15 and  name HD*  )(resid   19 and  name HG2  ) 4.1 2.0 0.0
assign (resid   15 and  name HD*  )(resid   19 and  name HN   ) 4.5 1.4 0.0
assign (resid   15 and  name HD*  )(resid   20 and  name HN   ) 5.1 1.9 0.0
assign (resid   15 and  name HG*  )(resid   15 and  name HN   ) 4.5 1.4 0.0
assign (resid   15 and  name HG*  )(resid   16 and  name HD*  ) 4.9 1.4 0.0
assign (resid   15 and  name HG*  )(resid   16 and  name HN   ) 4.3 1.4 0.0
assign (resid   15 and  name HG*  )(resid   19 and  name HD*  ) 4.6 1.4 0.0
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 3.9 1.5 0.0
assign (resid   15 and  name HN   )(resid   17 and  name HN   ) 4.8 1.5 0.0
assign (resid   16 and  name HA   )(resid   16 and  name HD*  ) 3.7 1.4 0.0
assign (resid   16 and  name HA   )(resid   16 and  name HN   ) 4.2 1.4 0.0
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 4.9 1.4 0.0
assign (resid   16 and  name HB1  )(resid   16 and  name HN   ) 4.5 1.9 0.0
assign (resid   16 and  name HB1  )(resid   17 and  name HN   ) 5.4 2.5 0.0
assign (resid   16 and  name HB2  )(resid   16 and  name HN   ) 4.6 2.1 0.0
assign (resid   16 and  name HB2  )(resid   17 and  name HN   ) 5.6 2.8 0.0
assign (resid   16 and  name HB2  )(resid   78 and  name HD*  ) 5.1 2.9 0.0
assign (resid   16 and  name HB*  )(resid   55 and  name HG*  ) 5.2 1.4 0.0
assign (resid   16 and  name HB*  )(resid   78 and  name HD*  ) 4.7 2.4 0.0
assign (resid   16 and  name HD*  )(resid   16 and  name HN   ) 4.5 1.4 0.0
assign (resid   16 and  name HD*  )(resid   55 and  name HG*  ) 4.6 1.4 0.0
assign (resid   16 and  name HD*  )(resid   78 and  name HD*  ) 4.2 1.4 0.0
assign (resid   16 and  name HN   )(resid   17 and  name HA   ) 5.4 2.5 0.0
assign (resid   16 and  name HN   )(resid   17 and  name HB   ) 4.6 1.4 0.0
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 4.2 1.6 0.0
assign (resid   17 and  name HA   )(resid   17 and  name HG1* ) 3.8 1.8 0.0
assign (resid   17 and  name HA   )(resid   17 and  name HG2* ) 3.6 1.6 0.0
assign (resid   17 and  name HA   )(resid   17 and  name HN   ) 4.1 1.5 0.0
assign (resid   17 and  name HA   )(resid   18 and  name HN   ) 4.6 1.5 0.0
assign (resid   17 and  name HA   )(resid   19 and  name HN   ) 5.3 1.4 0.0
assign (resid   17 and  name HA   )(resid   20 and  name HD1* ) 4.9 2.0 0.0
assign (resid   17 and  name HA   )(resid   20 and  name HD2* ) 5.5 1.4 0.0
assign (resid   17 and  name HA   )(resid   20 and  name HN   ) 5.0 1.4 0.0
assign (resid   17 and  name HA   )(resid   21 and  name HN   ) 5.2 1.4 0.0
assign (resid   17 and  name HA   )(resid   48 and  name HG   ) 3.9 1.4 0.0
assign (resid   17 and  name HB   )(resid   17 and  name HN   ) 3.8 1.4 0.0
assign (resid   17 and  name HB   )(resid   18 and  name HN   ) 4.1 1.8 0.0
assign (resid   17 and  name HB   )(resid   37 and  name HN   ) 5.0 1.4 0.0
assign (resid   17 and  name HB   )(resid   48 and  name HG   ) 4.3 1.4 0.0
assign (resid   17 and  name HG1* )(resid   17 and  name HN   ) 3.9 1.6 0.0
assign (resid   17 and  name HG1* )(resid   18 and  name HN   ) 4.6 1.4 0.0
assign (resid   17 and  name HG1* )(resid   21 and  name HN   ) 4.6 2.0 0.0
assign (resid   17 and  name HG1* )(resid   48 and  name HB*  ) 3.5 1.4 0.0
assign (resid   17 and  name HG1* )(resid   48 and  name HN   ) 4.5 1.4 0.0
assign (resid   17 and  name HG1* )(resid   50 and  name HB*  ) 3.1 1.3 0.0
assign (resid   17 and  name HG2* )(resid   17 and  name HN   ) 3.8 1.4 0.0
assign (resid   17 and  name HG2* )(resid   18 and  name HN   ) 4.2 1.4 0.0
assign (resid   17 and  name HG2* )(resid   35 and  name HN   ) 6.0 1.4 0.0
assign (resid   17 and  name HG2* )(resid   36 and  name HA   ) 4.0 1.4 0.0
assign (resid   17 and  name HG2* )(resid   36 and  name HN   ) 4.9 1.4 0.0
assign (resid   17 and  name HG2* )(resid   37 and  name HA1  ) 4.1 1.4 0.0
assign (resid   17 and  name HG2* )(resid   37 and  name HA*  ) 4.2 1.4 0.0
assign (resid   17 and  name HG2* )(resid   37 and  name HN   ) 4.3 1.5 0.0
assign (resid   17 and  name HG2* )(resid   48 and  name HN   ) 4.1 1.5 0.0
assign (resid   17 and  name HG2* )(resid   49 and  name HB*  ) 4.7 1.4 0.0
assign (resid   17 and  name HG2* )(resid   50 and  name HN   ) 4.3 1.4 0.0
assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 5.1 1.4 0.0
assign (resid   18 and  name HA   )(resid   18 and  name HN   ) 3.9 1.4 0.0
assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 4.0 1.4 0.0
assign (resid   18 and  name HA   )(resid   20 and  name HN   ) 4.7 1.4 0.0
assign (resid   18 and  name HA   )(resid   32 and  name HD*  ) 3.9 1.4 0.0
assign (resid   18 and  name HB1  )(resid   18 and  name HN   ) 3.7 1.5 0.0
assign (resid   18 and  name HB1  )(resid   19 and  name HN   ) 4.1 1.7 0.0
assign (resid   18 and  name HB2  )(resid   18 and  name HN   ) 3.6 1.5 0.0
assign (resid   18 and  name HB2  )(resid   19 and  name HN   ) 4.0 1.8 0.0
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 4.2 1.5 0.0
assign (resid   18 and  name HN   )(resid   20 and  name HN   ) 5.1 1.4 0.0
assign (resid   18 and  name HN   )(resid   32 and  name HD*  ) 4.8 1.4 0.0
assign (resid   18 and  name HN   )(resid   32 and  name HG   ) 4.7 2.6 0.0
assign (resid   19 and  name HA   )(resid   19 and  name HD*  ) 4.5 1.4 0.0
assign (resid   19 and  name HA   )(resid   19 and  name HG1  ) 3.4 1.5 0.0
assign (resid   19 and  name HA   )(resid   19 and  name HN   ) 3.7 1.4 0.0
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 4.9 1.9 0.0
assign (resid   19 and  name HA   )(resid   21 and  name HN   ) 4.5 1.4 0.0
assign (resid   19 and  name HA   )(resid   23 and  name HN   ) 4.8 1.4 0.0
assign (resid   19 and  name HB*  )(resid   19 and  name HN   ) 6.0 4.2 0.0
assign (resid   19 and  name HB2  )(resid   19 and  name HD*  ) 4.3 2.4 0.0
assign (resid   19 and  name HB2  )(resid   20 and  name HN   ) 4.8 2.3 0.0
assign (resid   19 and  name HD*  )(resid   19 and  name HN   ) 4.6 1.5 0.0
assign (resid   19 and  name HD*  )(resid   22 and  name HD*  ) 4.2 1.4 0.0
assign (resid   19 and  name HG*  )(resid   19 and  name HN   ) 3.9 1.8 0.0
assign (resid   19 and  name HN   )(resid   19 and  name HB2  ) 6.0 4.2 0.0
assign (resid   19 and  name HN   )(resid   19 and  name HG2  ) 6.0 4.2 0.0
assign (resid   19 and  name HN   )(resid   20 and  name HG   ) 3.9 1.4 0.0
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 4.0 1.4 0.0
assign (resid    1 and  name HA   )(resid    2 and  name HN   ) 3.5 1.5 0.0
assign (resid    1 and  name HA   )(resid   60 and  name HA   ) 5.2 1.4 0.0
assign (resid    1 and  name HA   )(resid   61 and  name HN   ) 4.5 1.4 0.0
assign (resid    1 and  name HA   )(resid   62 and  name HA   ) 3.6 1.4 0.0
assign (resid    1 and  name HA   )(resid   62 and  name HB*  ) 3.8 1.5 0.0
assign (resid    1 and  name HB*  )(resid    2 and  name HN   ) 3.7 1.4 0.0
assign (resid    1 and  name HB*  )(resid   60 and  name HB*  ) 4.0 1.4 0.0
assign (resid    1 and  name HB*  )(resid   61 and  name HN   ) 4.3 1.4 0.0
assign (resid    1 and  name HB*  )(resid   62 and  name HB*  ) 3.4 1.6 0.0
assign (resid    1 and  name HG*  )(resid    1 and  name HT*  ) 4.6 2.3 0.0
assign (resid    1 and  name HG*  )(resid    2 and  name HN   ) 4.2 1.4 0.0
assign (resid   20 and  name HA   )(resid   20 and  name HD1* ) 3.8 1.4 0.0
assign (resid   20 and  name HA   )(resid   20 and  name HD2* ) 3.6 1.5 0.0
assign (resid   20 and  name HA   )(resid   20 and  name HG   ) 4.2 2.3 0.0
assign (resid   20 and  name HA   )(resid   20 and  name HN   ) 4.2 1.7 0.0
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 4.4 1.4 0.0
assign (resid   20 and  name HA   )(resid   23 and  name HB*  ) 3.6 1.4 0.0
assign (resid   20 and  name HA   )(resid   23 and  name HN   ) 4.3 1.5 0.0
assign (resid   20 and  name HA   )(resid   24 and  name HN   ) 4.3 1.9 0.0
assign (resid   20 and  name HB1  )(resid   20 and  name HD2* ) 4.2 1.6 0.0
assign (resid   20 and  name HB1  )(resid   20 and  name HN   ) 4.2 2.0 0.0
assign (resid   20 and  name HB1  )(resid   21 and  name HN   ) 5.2 2.6 0.0
assign (resid   20 and  name HB2  )(resid   21 and  name HN   ) 4.9 2.4 0.0
assign (resid   20 and  name HB2  )(resid   39 and  name HD1* ) 4.2 1.8 0.0
assign (resid   20 and  name HB*  )(resid   30 and  name HG1* ) 4.5 1.6 0.0
assign (resid   20 and  name HD1* )(resid   20 and  name HN   ) 4.6 1.4 0.0
assign (resid   20 and  name HD1* )(resid   24 and  name HN   ) 5.4 1.4 0.0
assign (resid   20 and  name HD1* )(resid   48 and  name HG   ) 3.8 1.4 0.0
assign (resid   20 and  name HD1* )(resid   74 and  name HA   ) 4.6 1.4 0.0
assign (resid   20 and  name HD1* )(resid   77 and  name HB2  ) 4.4 1.4 0.0
assign (resid   20 and  name HD2* )(resid   20 and  name HN   ) 4.4 1.4 0.0
assign (resid   20 and  name HD2* )(resid   21 and  name HN   ) 5.2 1.8 0.0
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assign (resid   20 and  name HD2* )(resid   24 and  name HN   ) 5.4 1.4 0.0
assign (resid   20 and  name HD2* )(resid   77 and  name HB1  ) 4.4 1.6 0.0
assign (resid   20 and  name HG   )(resid   20 and  name HN   ) 4.1 1.9 0.0
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assign (resid   20 and  name HN   )(resid   22 and  name HN   ) 5.2 1.4 0.0
assign (resid   20 and  name HN   )(resid   23 and  name HN   ) 5.2 1.4 0.0
assign (resid   21 and  name HA   )(resid   21 and  name HN   ) 4.0 1.5 0.0
assign (resid   21 and  name HA   )(resid   22 and  name HN   ) 4.4 1.4 0.0
assign (resid   21 and  name HA   )(resid   23 and  name HN   ) 4.6 1.4 0.0
assign (resid   21 and  name HA   )(resid   24 and  name HN   ) 4.0 1.4 0.0
assign (resid   21 and  name HA   )(resid   39 and  name HD1* ) 3.9 1.7 0.0
assign (resid   21 and  name HA   )(resid   39 and  name HG2* ) 5.5 1.4 0.0
assign (resid   21 and  name HB*  )(resid   21 and  name HN   ) 4.4 1.9 0.0
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assign (resid    7 and  name HB*  )(resid    8 and  name HN   ) 4.6 1.4 0.0
assign (resid    7 and  name HD*  )(resid   56 and  name HD*  ) 4.7 1.4 0.0
assign (resid    7 and  name HD*  )(resid    9 and  name HD*  ) 3.9 1.4 0.0
assign (resid    7 and  name HD*  )(resid    9 and  name HG*  ) 4.9 1.4 0.0
assign (resid    7 and  name HN   )(resid   89 and  name HG2* ) 5.9 1.4 0.0
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 4.8 1.5 0.0
assign (resid    7 and  name HN   )(resid   92 and  name HN   ) 5.8 1.4 0.0
assign (resid   80 and  name HA   )(resid   80 and  name HD*  ) 4.7 1.4 0.0
assign (resid   80 and  name HA   )(resid   80 and  name HG1  ) 3.8 2.0 0.0
assign (resid   80 and  name HA   )(resid   80 and  name HG2  ) 3.9 2.0 0.0
assign (resid   80 and  name HA   )(resid   80 and  name HN   ) 3.7 1.5 0.0
assign (resid   80 and  name HB*  )(resid   80 and  name HD1  ) 3.8 1.4 0.0
assign (resid   80 and  name HB*  )(resid   80 and  name HD2  ) 3.7 1.4 0.0
assign (resid   80 and  name HB*  )(resid   81 and  name HN   ) 3.7 1.4 0.0
assign (resid   80 and  name HD*  )(resid   80 and  name HN   ) 4.4 1.4 0.0
assign (resid   80 and  name HG2  )(resid   80 and  name HN   ) 4.2 1.6 0.0
assign (resid   80 and  name HG2  )(resid   81 and  name HN   ) 4.4 1.4 0.0
assign (resid   80 and  name HG*  )(resid   80 and  name HN   ) 4.0 2.1 0.0
assign (resid   80 and  name HN   )(resid   81 and  name HN   ) 4.0 1.6 0.0
assign (resid   80 and  name HN   )(resid   82 and  name HN   ) 4.9 1.5 0.0
assign (resid   81 and  name HA   )(resid   81 and  name HG*  ) 4.5 1.4 0.0
assign (resid   81 and  name HA   )(resid   81 and  name HN   ) 3.9 1.5 0.0
assign (resid   81 and  name HA   )(resid   82 and  name HN   ) 4.8 1.4 0.0
assign (resid   81 and  name HB1  )(resid   82 and  name HN   ) 4.2 1.4 0.0
assign (resid   81 and  name HB*  )(resid   81 and  name HN   ) 4.2 1.7 0.0
assign (resid   81 and  name HG2  )(resid   81 and  name HN   ) 4.2 1.5 0.0
assign (resid   81 and  name HG2  )(resid   82 and  name HN   ) 4.8 1.4 0.0
assign (resid   81 and  name HG*  )(resid   81 and  name HN   ) 6.0 4.2 0.0
assign (resid   81 and  name HG*  )(resid   82 and  name HN   ) 5.7 2.6 0.0
assign (resid   81 and  name HN   )(resid   80 and  name HB*  ) 6.0 4.2 0.0
assign (resid   81 and  name HN   )(resid   82 and  name HN   ) 3.9 1.4 0.0
assign (resid   82 and  name HA   )(resid   82 and  name HN   ) 4.4 1.4 0.0
assign (resid   82 and  name HB*  )(resid   82 and  name HN   ) 3.9 1.5 0.0
assign (resid   82 and  name HN   )(resid   81 and  name HA   ) 6.0 4.2 0.0
assign (resid   82 and  name HN   )(resid   82 and  name HA   ) 6.0 4.2 0.0
assign (resid   82 and  name HN   )(resid   87 and  name HD*  ) 5.1 1.4 0.0
assign (resid   82 and  name HN   )(resid   87 and  name HG   ) 6.0 4.2 0.0
assign (resid   84 and  name HA   )(resid   85 and  name HN   ) 4.7 1.4 0.0
assign (resid   85 and  name HA   )(resid   85 and  name HG*  ) 4.2 1.4 0.0
assign (resid   85 and  name HG*  )(resid   87 and  name HD*  ) 3.8 1.4 0.0
assign (resid   85 and  name HG*  )(resid   87 and  name HG   ) 6.0 4.2 0.0
assign (resid   86 and  name HA   )(resid   87 and  name HN   ) 3.5 1.5 0.0
assign (resid   86 and  name HB1  )(resid   87 and  name HN   ) 4.6 1.5 0.0
assign (resid   86 and  name HB2  )(resid   87 and  name HN   ) 4.6 1.7 0.0
assign (resid   87 and  name HA   )(resid   87 and  name HG   ) 3.9 1.4 0.0
assign (resid   87 and  name HA   )(resid   88 and  name HN   ) 4.0 2.0 0.0
assign (resid   87 and  name HB1  )(resid   87 and  name HN   ) 4.6 2.2 0.0
assign (resid   87 and  name HB1  )(resid   88 and  name HN   ) 3.9 1.4 0.0
assign (resid   87 and  name HB1  )(resid   89 and  name HA   ) 5.0 1.4 0.0
assign (resid   87 and  name HB2  )(resid   87 and  name HN   ) 5.3 2.4 0.0
assign (resid   87 and  name HB2  )(resid   88 and  name HN   ) 6.0 4.2 0.0
assign (resid   87 and  name HB*  )(resid   89 and  name HG11 ) 5.1 3.0 0.0
assign (resid   87 and  name HD*  )(resid   87 and  name HN   ) 4.1 1.4 0.0
assign (resid   87 and  name HD*  )(resid   88 and  name HB*  ) 3.9 1.4 0.0
assign (resid   87 and  name HD*  )(resid   88 and  name HN   ) 4.2 1.6 0.0
assign (resid   87 and  name HG   )(resid   87 and  name HN   ) 4.2 1.6 0.0
assign (resid   88 and  name HA   )(resid   88 and  name HG2  ) 3.7 1.5 0.0
assign (resid   88 and  name HB*  )(resid   88 and  name HN   ) 3.9 1.6 0.0
assign (resid   88 and  name HG*  )(resid   88 and  name HN   ) 4.3 1.4 0.0
assign (resid   88 and  name HN   )(resid   88 and  name HG1  ) 6.0 4.2 0.0
assign (resid   88 and  name HN   )(resid   88 and  name HG2  ) 6.0 4.2 0.0
assign (resid   89 and  name HA   )(resid   89 and  name HD1* ) 6.0 4.2 0.0
assign (resid   89 and  name HA   )(resid   89 and  name HG11 ) 4.4 1.5 0.0
assign (resid   89 and  name HA   )(resid   89 and  name HG2* ) 4.1 1.5 0.0
assign (resid   89 and  name HA   )(resid   90 and  name HN   ) 3.7 1.4 0.0
assign (resid   89 and  name HB   )(resid   89 and  name HD1* ) 3.8 1.6 0.0
assign (resid   89 and  name HB   )(resid   90 and  name HN   ) 4.8 1.4 0.0
assign (resid   89 and  name HG2* )(resid   90 and  name HN   ) 4.4 1.5 0.0
assign (resid   89 and  name HG2* )(resid   91 and  name HN   ) 5.9 2.2 0.0
assign (resid    8 and  name HA   )(resid    8 and  name HG*  ) 3.6 1.4 0.0
assign (resid    8 and  name HA   )(resid    8 and  name HN   ) 4.3 1.4 0.0
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.6 1.5 0.0
assign (resid    8 and  name HB   )(resid    8 and  name HN   ) 4.0 1.6 0.0
assign (resid    8 and  name HB   )(resid    9 and  name HN   ) 4.8 1.4 0.0
assign (resid    8 and  name HG*  )(resid   89 and  name HA   ) 3.9 1.6 0.0
assign (resid    8 and  name HG*  )(resid    8 and  name HN   ) 4.1 1.7 0.0
assign (resid    8 and  name HG*  )(resid   90 and  name HN   ) 4.3 1.6 0.0
assign (resid    8 and  name HN   )(resid   54 and  name HB1  ) 6.0 4.2 0.0
assign (resid    8 and  name HN   )(resid   54 and  name HB2  ) 4.7 1.4 0.0
assign (resid    8 and  name HN   )(resid   55 and  name HB   ) 5.2 2.1 0.0
assign (resid    8 and  name HN   )(resid   55 and  name HN   ) 4.5 1.6 0.0
assign (resid    8 and  name HN   )(resid   56 and  name HA   ) 4.4 1.4 0.0
assign (resid   90 and  name HB*  )(resid   90 and  name HN   ) 4.0 1.5 0.0
assign (resid   90 and  name HB*  )(resid   91 and  name HN   ) 4.0 1.6 0.0
assign (resid   90 and  name HB*  )(resid   92 and  name HN   ) 5.1 1.5 0.0
assign (resid   90 and  name HN   )(resid   91 and  name HN   ) 5.1 1.8 0.0
assign (resid   91 and  name HA   )(resid   91 and  name HN   ) 4.4 1.7 0.0
assign (resid   91 and  name HA   )(resid   92 and  name HN   ) 3.6 1.5 0.0
assign (resid   91 and  name HB1  )(resid   91 and  name HN   ) 4.6 1.9 0.0
assign (resid   91 and  name HB1  )(resid   92 and  name HN   ) 4.8 1.9 0.0
assign (resid   91 and  name HB2  )(resid   91 and  name HN   ) 4.4 1.9 0.0
assign (resid   91 and  name HB2  )(resid   92 and  name HN   ) 4.7 1.7 0.0
assign (resid   91 and  name HE*  )(resid   91 and  name HN   ) 5.0 1.4 0.0
assign (resid   91 and  name HN   )(resid   92 and  name HN   ) 4.8 1.4 0.0
assign (resid   92 and  name HA   )(resid   93 and  name HD1  ) 3.4 1.4 0.0
assign (resid   92 and  name HA   )(resid   93 and  name HD2  ) 3.4 1.4 0.0
assign (resid   92 and  name HA   )(resid   93 and  name HG*  ) 4.0 1.4 0.0
assign (resid   92 and  name HB1  )(resid   92 and  name HN   ) 4.3 1.6 0.0
assign (resid   92 and  name HB2  )(resid   92 and  name HN   ) 4.2 1.8 0.0
assign (resid   92 and  name HG*  )(resid   92 and  name HN   ) 4.0 1.6 0.0
assign (resid   92 and  name HG*  )(resid   93 and  name HD1  ) 3.7 1.4 0.0
assign (resid   92 and  name HG*  )(resid   93 and  name HD2  ) 3.6 1.4 0.0
assign (resid   92 and  name HG*  )(resid   94 and  name HN   ) 5.4 1.4 0.0
assign (resid   92 and  name HN   )(resid    4 and  name HB1  ) 6.0 4.2 0.0
assign (resid   92 and  name HN   )(resid   93 and  name HD1  ) 6.0 4.2 0.0
assign (resid   92 and  name HN   )(resid   93 and  name HD*  ) 5.4 1.4 0.0
assign (resid   92 and  name HN   )(resid   94 and  name HB*  ) 6.0 1.4 0.0
assign (resid   93 and  name HA   )(resid   93 and  name HG*  ) 3.8 1.4 0.0
assign (resid   93 and  name HA   )(resid   94 and  name HN   ) 3.6 1.7 0.0
assign (resid   93 and  name HB1  )(resid   94 and  name HB*  ) 5.3 1.4 0.0
assign (resid   93 and  name HB1  )(resid   94 and  name HN   ) 4.0 1.4 0.0
assign (resid   93 and  name HB2  )(resid   94 and  name HN   ) 4.0 1.4 0.0
assign (resid   93 and  name HB*  )(resid   93 and  name HD1  ) 3.6 1.4 0.0
assign (resid   93 and  name HB*  )(resid   93 and  name HD2  ) 3.5 1.4 0.0
assign (resid   93 and  name HG*  )(resid   94 and  name HN   ) 4.8 2.0 0.0
assign (resid   94 and  name HA   )(resid   94 and  name HN   ) 6.0 4.2 0.0
assign (resid   94 and  name HA   )(resid   95 and  name HN   ) 5.4 2.8 0.0
assign (resid   94 and  name HB*  )(resid    3 and  name HD1  ) 6.0 4.2 0.0
assign (resid   94 and  name HB*  )(resid    3 and  name HD2  ) 6.0 4.2 0.0
assign (resid   94 and  name HB*  )(resid   94 and  name HN   ) 3.9 1.5 0.0
assign (resid   94 and  name HN   )(resid   93 and  name HG1  ) 6.0 4.2 0.0
assign (resid   94 and  name HN   )(resid   93 and  name HG2  ) 6.0 4.2 0.0
assign (resid   95 and  name HA   )(resid   95 and  name HG*  ) 3.2 1.4 0.0
assign (resid   95 and  name HB*  )(resid   95 and  name HN   ) 4.0 1.4 0.0
assign (resid   95 and  name HG*  )(resid   95 and  name HN   ) 5.5 2.3 0.0
assign (resid    9 and  name HA   )(resid   10 and  name HN   ) 3.7 1.5 0.0
assign (resid    9 and  name HA   )(resid   54 and  name HA   ) 4.2 1.4 0.0
assign (resid    9 and  name HA   )(resid   54 and  name HB*  ) 3.7 1.4 0.0
assign (resid    9 and  name HA   )(resid   55 and  name HN   ) 4.2 1.4 0.0
assign (resid    9 and  name HA   )(resid    9 and  name HD*  ) 3.8 1.4 0.0
assign (resid    9 and  name HA   )(resid    9 and  name HG1  ) 4.2 1.9 0.0
assign (resid    9 and  name HA   )(resid    9 and  name HG2  ) 4.1 1.8 0.0
assign (resid    9 and  name HB*  )(resid   10 and  name HN   ) 4.5 1.4 0.0
assign (resid    9 and  name HB*  )(resid    9 and  name HD*  ) 3.8 2.0 0.0
assign (resid    9 and  name HB*  )(resid    9 and  name HN   ) 3.8 1.4 0.0
assign (resid    9 and  name HD*  )(resid   10 and  name HN   ) 4.6 1.6 0.0
assign (resid    9 and  name HD*  )(resid   54 and  name HA   ) 5.1 1.4 0.0
assign (resid    9 and  name HD*  )(resid   54 and  name HB2  ) 4.2 1.4 0.0
assign (resid    9 and  name HD*  )(resid   55 and  name HN   ) 4.8 1.4 0.0
assign (resid    9 and  name HD*  )(resid    9 and  name HN   ) 4.6 1.8 0.0
assign (resid    9 and  name HG*  )(resid   10 and  name HN   ) 4.7 1.4 0.0
assign (resid    9 and  name HG1  )(resid   54 and  name HA   ) 4.0 1.4 0.0
assign (resid    9 and  name HG2  )(resid   10 and  name HN   ) 6.0 4.2 0.0
assign (resid    9 and  name HG*  )(resid    9 and  name HN   ) 4.1 1.4 0.0
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 5.0 1.4 0.0
set message=off echo=off end 

!! Phi restraints: minimum deviation = 3 degrees
!!                 maximum deviation = 29 degrees 

  !!    2  
 assign (resid   1   and name c )   (resid   2   and name n )
        (resid   2   and name ca)   (resid   2   and name c )  1.0 -102.0 26.0 2
  !!    3  
 assign (resid   2   and name c )   (resid   3   and name n )
        (resid   3   and name ca)   (resid   3   and name c )  1.0 -132.0 36.0 2
  !!    4  
 assign (resid   3   and name c )   (resid   4   and name n )
        (resid   4   and name ca)   (resid   4   and name c )  1.0 -126.0 26.0 2
  !!    5  
 assign (resid   4   and name c )   (resid   5   and name n )
        (resid   5   and name ca)   (resid   5   and name c )  1.0 -125.0 20.0 2
  !!    6  
 assign (resid   5   and name c )   (resid   6   and name n )
        (resid   6   and name ca)   (resid   6   and name c )  1.0 -126.0 48.0 2
  !!    7  
 assign (resid   6   and name c )   (resid   7   and name n )
        (resid   7   and name ca)   (resid   7   and name c )  1.0 -102.0 40.0 2
  !!    8  
 assign (resid   7   and name c )   (resid   8   and name n )
        (resid   8   and name ca)   (resid   8   and name c )  1.0 -107.0 32.0 2
  !!    9  
 assign (resid   8   and name c )   (resid   9   and name n )
        (resid   9   and name ca)   (resid   9   and name c )  1.0 -90.0  44.0 2
  !!    10 
 assign (resid   9   and name c )   (resid   10  and name n )
        (resid   10  and name ca)   (resid   10  and name c )  1.0 -89.0  38.0 2
  !!    13 
 assign (resid   12  and name c )   (resid   13  and name n )
        (resid   13  and name ca)   (resid   13  and name c )  1.0 -59.0  20.0 2
  !!    14 
 assign (resid   13  and name c )   (resid   14  and name n )
        (resid   14  and name ca)   (resid   14  and name c )  1.0 -62.0  20.0 2
  !!    15 
 assign (resid   14  and name c )   (resid   15  and name n )
        (resid   15  and name ca)   (resid   15  and name c )  1.0 -61.0  20.0 2
  !!    16 
 assign (resid   15  and name c )   (resid   16  and name n )
        (resid   16  and name ca)   (resid   16  and name c )  1.0 -65.0  20.0 2
  !!    17 
 assign (resid   16  and name c )   (resid   17  and name n )
        (resid   17  and name ca)   (resid   17  and name c )  1.0 -64.0  20.0 2
  !!    18 
 assign (resid   17  and name c )   (resid   18  and name n )
        (resid   18  and name ca)   (resid   18  and name c )  1.0 -61.0  20.0 2
  !!    19 
 assign (resid   18  and name c )   (resid   19  and name n )
        (resid   19  and name ca)   (resid   19  and name c )  1.0 -67.0  20.0 2
  !!    20 
 assign (resid   19  and name c )   (resid   20  and name n )
        (resid   20  and name ca)   (resid   20  and name c )  1.0 -64.0  20.0 2
  !!    21 
 assign (resid   20  and name c )   (resid   21  and name n )
        (resid   21  and name ca)   (resid   21  and name c )  1.0 -65.0  20.0 2
  !!    22 
 assign (resid   21  and name c )   (resid   22  and name n )
        (resid   22  and name ca)   (resid   22  and name c )  1.0 -64.0  20.0 2
  !!    23 
 assign (resid   22  and name c )   (resid   23  and name n )
        (resid   23  and name ca)   (resid   23  and name c )  1.0 -64.0  20.0 2
  !!    24 
 assign (resid   23  and name c )   (resid   24  and name n )
        (resid   24  and name ca)   (resid   24  and name c )  1.0 -79.0  28.0 2
  !!    26 
 assign (resid   25  and name c )   (resid   26  and name n )
        (resid   26  and name ca)   (resid   26  and name c )  1.0 -83.0  44.0 2
  !!    28 
 assign (resid   27  and name c )   (resid   28  and name n )
        (resid   28  and name ca)   (resid   28  and name c )  1.0 -102.0 38.0 2
  !!    29 
 assign (resid   28  and name c )   (resid   29  and name n )
        (resid   29  and name ca)   (resid   29  and name c )  1.0 -105.0 32.0 2
  !!    30 
 assign (resid   29  and name c )   (resid   30  and name n )
        (resid   30  and name ca)   (resid   30  and name c )  1.0 -127.0 22.0 2
  !!    31 
 assign (resid   30  and name c )   (resid   31  and name n )
        (resid   31  and name ca)   (resid   31  and name c )  1.0 -131.0 38.0 2
  !!    32 
 assign (resid   31  and name c )   (resid   32  and name n )
        (resid   32  and name ca)   (resid   32  and name c )  1.0 -117.0 32.0 2
  !!    33 
 assign (resid   32  and name c )   (resid   33  and name n )
        (resid   33  and name ca)   (resid   33  and name c )  1.0 -117.0 42.0 2
  !!    36 
 assign (resid   35  and name c )   (resid   36  and name n )
        (resid   36  and name ca)   (resid   36  and name c )  1.0 -123.0 46.0 2
  !!    37 
 assign (resid   36  and name c )   (resid   37  and name n )
        (resid   37  and name ca)   (resid   37  and name c )  1.0 -128.0 32.0 2
  !!    38 
 assign (resid   37  and name c )   (resid   38  and name n )
        (resid   38  and name ca)   (resid   38  and name c )  1.0 -122.0 22.0 2
  !!    39 
 assign (resid   38  and name c )   (resid   39  and name n )
        (resid   39  and name ca)   (resid   39  and name c )  1.0 -123.0 36.0 2
  !!    40 
 assign (resid   39  and name c )   (resid   40  and name n )
        (resid   40  and name ca)   (resid   40  and name c )  1.0 -99.0  52.0 2
  !!    45 
 assign (resid   44  and name c )   (resid   45  and name n )
        (resid   45  and name ca)   (resid   45  and name c )  1.0 -147.0 20.0 2
  !!    46 
 assign (resid   45  and name c )   (resid   46  and name n )
        (resid   46  and name ca)   (resid   46  and name c )  1.0 -128.0 42.0 2
  !!    47 
 assign (resid   46  and name c )   (resid   47  and name n )
        (resid   47  and name ca)   (resid   47  and name c )  1.0 -115.0 38.0 2
  !!    48 
 assign (resid   47  and name c )   (resid   48  and name n )
        (resid   48  and name ca)   (resid   48  and name c )  1.0 -124.0 20.0 2
  !!    49 
 assign (resid   48  and name c )   (resid   49  and name n )
        (resid   49  and name ca)   (resid   49  and name c )  1.0 -112.0 40.0 2
  !!    50 
 assign (resid   49  and name c )   (resid   50  and name n )
        (resid   50  and name ca)   (resid   50  and name c )  1.0 -104.0 40.0 2
  !!    55 
 assign (resid   54  and name c )   (resid   55  and name n )
        (resid   55  and name ca)   (resid   55  and name c )  1.0 -130.0 24.0 2
  !!    56 
 assign (resid   55  and name c )   (resid   56  and name n )
        (resid   56  and name ca)   (resid   56  and name c )  1.0 -118.0 26.0 2
  !!    57 
 assign (resid   56  and name c )   (resid   57  and name n )
        (resid   57  and name ca)   (resid   57  and name c )  1.0 -123.0 26.0 2
  !!    58 
 assign (resid   57  and name c )   (resid   58  and name n )
        (resid   58  and name ca)   (resid   58  and name c )  1.0 -123.0 28.0 2
  !!    59 
 assign (resid   58  and name c )   (resid   59  and name n )
        (resid   59  and name ca)   (resid   59  and name c )  1.0 -127.0 24.0 2
  !!    60 
 assign (resid   59  and name c )   (resid   60  and name n )
        (resid   60  and name ca)   (resid   60  and name c )  1.0 -123.0 28.0 2
  !!    61 
 assign (resid   60  and name c )   (resid   61  and name n )
        (resid   61  and name ca)   (resid   61  and name c )  1.0 -137.0 26.0 2
  !!    63 
 assign (resid   62  and name c )   (resid   63  and name n )
        (resid   63  and name ca)   (resid   63  and name c )  1.0 -118.0 56.0 2
  !!    64 
 assign (resid   63  and name c )   (resid   64  and name n )
        (resid   64  and name ca)   (resid   64  and name c )  1.0 -57.0  20.0 2
  !!    65 
 assign (resid   64  and name c )   (resid   65  and name n )
        (resid   65  and name ca)   (resid   65  and name c )  1.0 -67.0  20.0 2
  !!    66 
 assign (resid   65  and name c )   (resid   66  and name n )
        (resid   66  and name ca)   (resid   66  and name c )  1.0 -69.0  20.0 2
  !!    67 
 assign (resid   66  and name c )   (resid   67  and name n )
        (resid   67  and name ca)   (resid   67  and name c )  1.0 -61.0  20.0 2
  !!    68 
 assign (resid   67  and name c )   (resid   68  and name n )
        (resid   68  and name ca)   (resid   68  and name c )  1.0 -64.0  20.0 2
  !!    69 
 assign (resid   68  and name c )   (resid   69  and name n )
        (resid   69  and name ca)   (resid   69  and name c )  1.0 -66.0  20.0 2
  !!    70 
 assign (resid   69  and name c )   (resid   70  and name n )
        (resid   70  and name ca)   (resid   70  and name c )  1.0 -67.0  20.0 2
  !!    71 
 assign (resid   70  and name c )   (resid   71  and name n )
        (resid   71  and name ca)   (resid   71  and name c )  1.0 -65.0  20.0 2
  !!    72 
 assign (resid   71  and name c )   (resid   72  and name n )
        (resid   72  and name ca)   (resid   72  and name c )  1.0 -62.0  20.0 2
  !!    73 
 assign (resid   72  and name c )   (resid   73  and name n )
        (resid   73  and name ca)   (resid   73  and name c )  1.0 -64.0  20.0 2
  !!    74 
 assign (resid   73  and name c )   (resid   74  and name n )
        (resid   74  and name ca)   (resid   74  and name c )  1.0 -63.0  20.0 2
  !!    75 
 assign (resid   74  and name c )   (resid   75  and name n )
        (resid   75  and name ca)   (resid   75  and name c )  1.0 -62.0  20.0 2
  !!    76 
 assign (resid   75  and name c )   (resid   76  and name n )
        (resid   76  and name ca)   (resid   76  and name c )  1.0 -64.0  20.0 2
  !!    77 
 assign (resid   76  and name c )   (resid   77  and name n )
        (resid   77  and name ca)   (resid   77  and name c )  1.0 -64.0  20.0 2
  !!    78 
 assign (resid   77  and name c )   (resid   78  and name n )
        (resid   78  and name ca)   (resid   78  and name c )  1.0 -63.0  20.0 2
  !!    79 
 assign (resid   78  and name c )   (resid   79  and name n )
        (resid   79  and name ca)   (resid   79  and name c )  1.0 -63.0  20.0 2
  !!    80 
 assign (resid   79  and name c )   (resid   80  and name n )
        (resid   80  and name ca)   (resid   80  and name c )  1.0 -69.0  20.0 2
  !!    81 
 assign (resid   80  and name c )   (resid   81  and name n )
        (resid   81  and name ca)   (resid   81  and name c )  1.0 -81.0  26.0 2
  !!    85 
 assign (resid   84  and name c )   (resid   85  and name n )
        (resid   85  and name ca)   (resid   85  and name c )  1.0 -114.0 56.0 2
  !!    86 
 assign (resid   85  and name c )   (resid   86  and name n )
        (resid   86  and name ca)   (resid   86  and name c )  1.0 -100.0 42.0 2
  !!    88 
 assign (resid   87  and name c )   (resid   88  and name n )
        (resid   88  and name ca)   (resid   88  and name c )  1.0 -87.0  36.0 2
  !!    89 
 assign (resid   88  and name c )   (resid   89  and name n )
        (resid   89  and name ca)   (resid   89  and name c )  1.0 -106.0 58.0 2
  !!    90 
 assign (resid   89  and name c )   (resid   90  and name n )
        (resid   90  and name ca)   (resid   90  and name c )  1.0 -104.0 20.0 2
  !!    91 
 assign (resid   90  and name c )   (resid   91  and name n )
        (resid   91  and name ca)   (resid   91  and name c )  1.0 -108.0 22.0 2
  !!    92 
 assign (resid   91  and name c )   (resid   92  and name n )
        (resid   92  and name ca)   (resid   92  and name c )  1.0 -122.0 32.0 2

 !! Psi restraints: minimum deviation = 3 degrees
!!                 maximum deviation = 30 degrees 

  !!    2  
 assign (resid   2   and name n )   (resid   2   and name ca)
        (resid   2   and name c )   (resid   3   and name n )  1.0 138.0  32.0 2
  !!    3  
 assign (resid   3   and name n )   (resid   3   and name ca)
        (resid   3   and name c )   (resid   4   and name n )  1.0 148.0  30.0 2
  !!    4  
 assign (resid   4   and name n )   (resid   4   and name ca)
        (resid   4   and name c )   (resid   5   and name n )  1.0 144.0  36.0 2
  !!    5  
 assign (resid   5   and name n )   (resid   5   and name ca)
        (resid   5   and name c )   (resid   6   and name n )  1.0 143.0  24.0 2
  !!    6  
 assign (resid   6   and name n )   (resid   6   and name ca)
        (resid   6   and name c )   (resid   7   and name n )  1.0 132.0  30.0 2
  !!    7  
 assign (resid   7   and name n )   (resid   7   and name ca)
        (resid   7   and name c )   (resid   8   and name n )  1.0 125.0  20.0 2
  !!    8  
 assign (resid   8   and name n )   (resid   8   and name ca)
        (resid   8   and name c )   (resid   9   and name n )  1.0 129.0  24.0 2
  !!    9  
 assign (resid   9   and name n )   (resid   9   and name ca)
        (resid   9   and name c )   (resid   10  and name n )  1.0 129.0  20.0 2
  !!    10 
 assign (resid   10  and name n )   (resid   10  and name ca)
        (resid   10  and name c )   (resid   11  and name n )  1.0 119.0  36.0 2
  !!    13 
 assign (resid   13  and name n )   (resid   13  and name ca)
        (resid   13  and name c )   (resid   14  and name n )  1.0 -41.0  20.0 2
  !!    14 
 assign (resid   14  and name n )   (resid   14  and name ca)
        (resid   14  and name c )   (resid   15  and name n )  1.0 -43.0  20.0 2
  !!    15 
 assign (resid   15  and name n )   (resid   15  and name ca)
        (resid   15  and name c )   (resid   16  and name n )  1.0 -45.0  20.0 2
  !!    16 
 assign (resid   16  and name n )   (resid   16  and name ca)
        (resid   16  and name c )   (resid   17  and name n )  1.0 -44.0  20.0 2
  !!    17 
 assign (resid   17  and name n )   (resid   17  and name ca)
        (resid   17  and name c )   (resid   18  and name n )  1.0 -46.0  20.0 2
  !!    18 
 assign (resid   18  and name n )   (resid   18  and name ca)
        (resid   18  and name c )   (resid   19  and name n )  1.0 -42.0  20.0 2
  !!    19 
 assign (resid   19  and name n )   (resid   19  and name ca)
        (resid   19  and name c )   (resid   20  and name n )  1.0 -39.0  20.0 2
  !!    20 
 assign (resid   20  and name n )   (resid   20  and name ca)
        (resid   20  and name c )   (resid   21  and name n )  1.0 -41.0  20.0 2
  !!    21 
 assign (resid   21  and name n )   (resid   21  and name ca)
        (resid   21  and name c )   (resid   22  and name n )  1.0 -41.0  20.0 2
  !!    22 
 assign (resid   22  and name n )   (resid   22  and name ca)
        (resid   22  and name c )   (resid   23  and name n )  1.0 -41.0  20.0 2
  !!    23 
 assign (resid   23  and name n )   (resid   23  and name ca)
        (resid   23  and name c )   (resid   24  and name n )  1.0 -43.0  22.0 2
  !!    24 
 assign (resid   24  and name n )   (resid   24  and name ca)
        (resid   24  and name c )   (resid   25  and name n )  1.0 -18.0  52.0 2
  !!    26 
 assign (resid   26  and name n )   (resid   26  and name ca)
        (resid   26  and name c )   (resid   27  and name n )  1.0 -30.0  20.0 2
  !!    28 
 assign (resid   28  and name n )   (resid   28  and name ca)
        (resid   28  and name c )   (resid   29  and name n )  1.0 145.0  26.0 2
  !!    29 
 assign (resid   29  and name n )   (resid   29  and name ca)
        (resid   29  and name c )   (resid   30  and name n )  1.0 125.0  36.0 2
  !!    30 
 assign (resid   30  and name n )   (resid   30  and name ca)
        (resid   30  and name c )   (resid   31  and name n )  1.0 144.0  32.0 2
  !!    31 
 assign (resid   31  and name n )   (resid   31  and name ca)
        (resid   31  and name c )   (resid   32  and name n )  1.0 133.0  24.0 2
  !!    32 
 assign (resid   32  and name n )   (resid   32  and name ca)
        (resid   32  and name c )   (resid   33  and name n )  1.0 129.0  20.0 2
  !!    33 
 assign (resid   33  and name n )   (resid   33  and name ca)
        (resid   33  and name c )   (resid   34  and name n )  1.0 133.0  36.0 2
  !!    36 
 assign (resid   36  and name n )   (resid   36  and name ca)
        (resid   36  and name c )   (resid   37  and name n )  1.0 141.0  28.0 2
  !!    37 
 assign (resid   37  and name n )   (resid   37  and name ca)
        (resid   37  and name c )   (resid   38  and name n )  1.0 140.0  28.0 2
  !!    38 
 assign (resid   38  and name n )   (resid   38  and name ca)
        (resid   38  and name c )   (resid   39  and name n )  1.0 133.0  30.0 2
  !!    39 
 assign (resid   39  and name n )   (resid   39  and name ca)
        (resid   39  and name c )   (resid   40  and name n )  1.0 132.0  28.0 2
  !!    40 
 assign (resid   40  and name n )   (resid   40  and name ca)
        (resid   40  and name c )   (resid   41  and name n )  1.0 126.0  34.0 2
  !!    45 
 assign (resid   45  and name n )   (resid   45  and name ca)
        (resid   45  and name c )   (resid   46  and name n )  1.0 153.0  24.0 2
  !!    46 
 assign (resid   46  and name n )   (resid   46  and name ca)
        (resid   46  and name c )   (resid   47  and name n )  1.0 127.0  24.0 2
  !!    47 
 assign (resid   47  and name n )   (resid   47  and name ca)
        (resid   47  and name c )   (resid   48  and name n )  1.0 130.0  24.0 2
  !!    48 
 assign (resid   48  and name n )   (resid   48  and name ca)
        (resid   48  and name c )   (resid   49  and name n )  1.0 142.0  36.0 2
  !!    49 
 assign (resid   49  and name n )   (resid   49  and name ca)
        (resid   49  and name c )   (resid   50  and name n )  1.0 127.0  22.0 2
  !!    50 
 assign (resid   50  and name n )   (resid   50  and name ca)
        (resid   50  and name c )   (resid   51  and name n )  1.0 113.0  34.0 2
  !!    55 
 assign (resid   55  and name n )   (resid   55  and name ca)
        (resid   55  and name c )   (resid   56  and name n )  1.0 137.0  20.0 2
  !!    56 
 assign (resid   56  and name n )   (resid   56  and name ca)
        (resid   56  and name c )   (resid   57  and name n )  1.0 134.0  20.0 2
  !!    57 
 assign (resid   57  and name n )   (resid   57  and name ca)
        (resid   57  and name c )   (resid   58  and name n )  1.0 135.0  20.0 2
  !!    58 
 assign (resid   58  and name n )   (resid   58  and name ca)
        (resid   58  and name c )   (resid   59  and name n )  1.0 122.0  20.0 2
  !!    59 
 assign (resid   59  and name n )   (resid   59  and name ca)
        (resid   59  and name c )   (resid   60  and name n )  1.0 137.0  24.0 2
  !!    60 
 assign (resid   60  and name n )   (resid   60  and name ca)
        (resid   60  and name c )   (resid   61  and name n )  1.0 138.0  34.0 2
  !!    61 
 assign (resid   61  and name n )   (resid   61  and name ca)
        (resid   61  and name c )   (resid   62  and name n )  1.0 140.0  20.0 2
  !!    63 
 assign (resid   63  and name n )   (resid   63  and name ca)
        (resid   63  and name c )   (resid   64  and name n )  1.0 153.0  44.0 2
  !!    64 
 assign (resid   64  and name n )   (resid   64  and name ca)
        (resid   64  and name c )   (resid   65  and name n )  1.0 -39.0  20.0 2
  !!    65 
 assign (resid   65  and name n )   (resid   65  and name ca)
        (resid   65  and name c )   (resid   66  and name n )  1.0 -33.0  20.0 2
  !!    66 
 assign (resid   66  and name n )   (resid   66  and name ca)
        (resid   66  and name c )   (resid   67  and name n )  1.0 -40.0  20.0 2
  !!    67 
 assign (resid   67  and name n )   (resid   67  and name ca)
        (resid   67  and name c )   (resid   68  and name n )  1.0 -40.0  20.0 2
  !!    68 
 assign (resid   68  and name n )   (resid   68  and name ca)
        (resid   68  and name c )   (resid   69  and name n )  1.0 -40.0  20.0 2
  !!    69 
 assign (resid   69  and name n )   (resid   69  and name ca)
        (resid   69  and name c )   (resid   70  and name n )  1.0 -42.0  20.0 2
  !!    70 
 assign (resid   70  and name n )   (resid   70  and name ca)
        (resid   70  and name c )   (resid   71  and name n )  1.0 -37.0  20.0 2
  !!    71 
 assign (resid   71  and name n )   (resid   71  and name ca)
        (resid   71  and name c )   (resid   72  and name n )  1.0 -41.0  20.0 2
  !!    72 
 assign (resid   72  and name n )   (resid   72  and name ca)
        (resid   72  and name c )   (resid   73  and name n )  1.0 -42.0  20.0 2
  !!    73 
 assign (resid   73  and name n )   (resid   73  and name ca)
        (resid   73  and name c )   (resid   74  and name n )  1.0 -46.0  20.0 2
  !!    74 
 assign (resid   74  and name n )   (resid   74  and name ca)
        (resid   74  and name c )   (resid   75  and name n )  1.0 -45.0  20.0 2
  !!    75 
 assign (resid   75  and name n )   (resid   75  and name ca)
        (resid   75  and name c )   (resid   76  and name n )  1.0 -38.0  20.0 2
  !!    76 
 assign (resid   76  and name n )   (resid   76  and name ca)
        (resid   76  and name c )   (resid   77  and name n )  1.0 -42.0  20.0 2
  !!    77 
 assign (resid   77  and name n )   (resid   77  and name ca)
        (resid   77  and name c )   (resid   78  and name n )  1.0 -46.0  20.0 2
  !!    78 
 assign (resid   78  and name n )   (resid   78  and name ca)
        (resid   78  and name c )   (resid   79  and name n )  1.0 -40.0  20.0 2
  !!    79 
 assign (resid   79  and name n )   (resid   79  and name ca)
        (resid   79  and name c )   (resid   80  and name n )  1.0 -41.0  20.0 2
  !!    80 
 assign (resid   80  and name n )   (resid   80  and name ca)
        (resid   80  and name c )   (resid   81  and name n )  1.0 -30.0  22.0 2
  !!    81 
 assign (resid   81  and name n )   (resid   81  and name ca)
        (resid   81  and name c )   (resid   82  and name n )  1.0 -19.0  38.0 2
  !!    85 
 assign (resid   85  and name n )   (resid   85  and name ca)
        (resid   85  and name c )   (resid   86  and name n )  1.0 151.0  34.0 2
  !!    86 
 assign (resid   86  and name n )   (resid   86  and name ca)
        (resid   86  and name c )   (resid   87  and name n )  1.0 126.0  54.0 2
  !!    88 
 assign (resid   88  and name n )   (resid   88  and name ca)
        (resid   88  and name c )   (resid   89  and name n )  1.0 126.0  26.0 2
  !!    89 
 assign (resid   89  and name n )   (resid   89  and name ca)
        (resid   89  and name c )   (resid   90  and name n )  1.0 130.0  20.0 2
  !!    90 
 assign (resid   90  and name n )   (resid   90  and name ca)
        (resid   90  and name c )   (resid   91  and name n )  1.0 133.0  20.0 2
  !!    91 
 assign (resid   91  and name n )   (resid   91  and name ca)
        (resid   91  and name c )   (resid   92  and name n )  1.0 132.0  20.0 2
  !!    92 
 assign (resid   92  and name n )   (resid   92  and name ca)
        (resid   92  and name c )   (resid   93  and name n )  1.0 139.0  38.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1   6.811  13.552  -5.109
    2    HB2  MET   1           2HB      MET   1   7.435  13.948  -2.807
    3    HB3  MET   1           1HB      MET   1   8.711  14.508  -3.880
    4    HG2  MET   1           2HG      MET   1   6.808  16.602  -3.230
    5    HG3  MET   1           1HG      MET   1   7.572  15.914  -1.802
    6    HE1  MET   1           3HE      MET   1   7.457  18.070  -4.510
    7    HE2  MET   1           1HE      MET   1   9.013  18.049  -5.341
    8    HE3  MET   1           2HE      MET   1   8.718  19.213  -4.049
    9    H    PHE   2           H        PHE   2   4.712  13.466  -5.634
   10    HA   PHE   2           HA       PHE   2   2.811  15.201  -4.223
   11    HD1  PHE   2           1HD      PHE   2   3.196  16.592  -6.668
   12    HD2  PHE   2           2HD      PHE   2   2.908  12.581  -8.067
   13    HE1  PHE   2           1HE      PHE   2   4.480  17.203  -8.675
   14    HE2  PHE   2           2HE      PHE   2   4.186  13.188 -10.074
   15    HZ   PHE   2           HZ       PHE   2   4.977  15.499 -10.382
   16    HB2  PHE   2           2HB      PHE   2   1.803  13.175  -6.141
   17    HB3  PHE   2           1HB      PHE   2   1.336  14.859  -5.943
   18    H    ARG   3           H        ARG   3   0.722  13.945  -3.458
   19    HA   ARG   3           HA       ARG   3   1.377  11.256  -2.577
   20    HE   ARG   3           HE       ARG   3   4.518  10.861   1.562
   21    HB2  ARG   3           2HB      ARG   3   1.852  13.404  -0.836
   22    HB3  ARG   3           1HB      ARG   3   0.360  12.661  -0.268
   23    HG2  ARG   3           2HG      ARG   3   1.667  11.225   0.799
   24    HG3  ARG   3           1HG      ARG   3   1.965  10.499  -0.765
   25    HD2  ARG   3           2HD      ARG   3   4.107  11.085  -0.679
   26    HD3  ARG   3           1HD      ARG   3   3.675  12.772  -0.413
   27   HH11  ARG   3          1HH1      ARG   3   2.761  13.827   1.016
   28   HH12  ARG   3          2HH1      ARG   3   2.962  14.392   2.640
   29   HH21  ARG   3          1HH2      ARG   3   4.782  11.602   3.700
   30   HH22  ARG   3          2HH2      ARG   3   4.109  13.129   4.164
   31    H    SER   4           H        SER   4  -0.306   9.983  -2.729
   32    HA   SER   4           HA       SER   4  -3.029  11.098  -2.624
   33    HG   SER   4           HG       SER   4  -4.441   8.795  -4.390
   34    HB2  SER   4           2HB      SER   4  -3.025  10.284  -4.783
   35    HB3  SER   4           1HB      SER   4  -1.739   9.120  -4.449
   36    H    THR   5           H        THR   5  -4.680   9.480  -1.821
   37    HA   THR   5           HA       THR   5  -3.525   7.385  -0.174
   38    HB   THR   5           HB       THR   5  -4.534   8.099   1.888
   39    HG1  THR   5           1HG      THR   5  -5.589  10.261   0.393
   40   HG21  THR   5          3HG2      THR   5  -3.399  10.693   0.956
   41   HG22  THR   5          1HG2      THR   5  -2.352   9.280   1.097
   42   HG23  THR   5          2HG2      THR   5  -3.225   9.874   2.506
   43    H    SER   6           H        SER   6  -4.661   5.594  -0.241
   44    HA   SER   6           HA       SER   6  -7.474   5.756  -1.112
   45    HG   SER   6           HG       SER   6  -7.908   2.955  -1.267
   46    HB2  SER   6           2HB      SER   6  -5.915   4.479  -2.591
   47    HB3  SER   6           1HB      SER   6  -5.613   3.370  -1.254
   48    H    HIS   7           H        HIS   7  -9.072   4.972   0.169
   49    HA   HIS   7           HA       HIS   7  -8.264   3.604   2.660
   50    HD1  HIS   7           1HD      HIS   7  -9.671   6.104   5.478
   51    HD2  HIS   7           2HD      HIS   7 -11.509   2.816   3.725
   52    HE1  HIS   7           1HE      HIS   7 -10.863   4.923   7.349
   53    HE2  HIS   7           2HE      HIS   7 -11.894   2.889   6.280
   54    HB2  HIS   7           2HB      HIS   7  -9.073   5.883   3.090
   55    HB3  HIS   7           1HB      HIS   7 -10.578   5.513   2.259
   56    H    VAL   8           H        VAL   8  -9.181   1.675   3.097
   57    HA   VAL   8           HA       VAL   8 -11.678   0.931   1.747
   58    HB   VAL   8           HB       VAL   8  -9.468  -1.090   1.876
   59   HG11  VAL   8          1HG1      VAL   8 -10.670  -2.149   0.095
   60   HG12  VAL   8          2HG1      VAL   8 -11.735  -0.757  -0.081
   61   HG13  VAL   8          3HG1      VAL   8 -11.812  -1.748   1.376
   62   HG21  VAL   8          3HG2      VAL   8  -8.555   0.903   0.708
   63   HG22  VAL   8          1HG2      VAL   8  -9.873   0.777  -0.457
   64   HG23  VAL   8          2HG2      VAL   8  -8.688  -0.521  -0.321
   65    H    ARG   9           H        ARG   9 -12.830  -0.822   2.789
   66    HA   ARG   9           HA       ARG   9 -12.069  -1.071   5.615
   67    HE   ARG   9           HE       ARG   9 -15.574   1.990   6.799
   68    HB2  ARG   9           2HB      ARG   9 -14.670  -1.119   4.196
   69    HB3  ARG   9           1HB      ARG   9 -14.508  -2.237   5.541
   70    HG2  ARG   9           2HG      ARG   9 -15.456  -0.251   6.399
   71    HG3  ARG   9           1HG      ARG   9 -13.779  -0.299   6.948
   72    HD2  ARG   9           2HD      ARG   9 -13.170   1.482   5.681
   73    HD3  ARG   9           1HD      ARG   9 -14.300   1.084   4.387
   74   HH11  ARG   9          1HH1      ARG   9 -14.093   2.982   3.799
   75   HH12  ARG   9          2HH1      ARG   9 -14.933   4.495   3.739
   76   HH21  ARG   9          1HH2      ARG   9 -16.681   3.979   6.722
   77   HH22  ARG   9          2HH2      ARG   9 -16.402   5.062   5.399
   78    H    THR  10           H        THR  10 -10.744  -2.754   5.916
   79    HA   THR  10           HA       THR  10 -11.569  -5.366   4.840
   80    HB   THR  10           HB       THR  10  -9.301  -3.938   4.054
   81    HG1  THR  10           1HG      THR  10  -9.981  -5.390   2.659
   82   HG21  THR  10          3HG2      THR  10  -8.226  -6.394   5.294
   83   HG22  THR  10          1HG2      THR  10  -8.408  -4.965   6.316
   84   HG23  THR  10          2HG2      THR  10  -7.417  -4.889   4.854
   85    H    GLU  11           H        GLU  11 -10.823  -7.234   6.092
   86    HA   GLU  11           HA       GLU  11 -10.490  -6.536   8.933
   87    HB2  GLU  11           2HB      GLU  11 -12.202  -8.364   7.586
   88    HB3  GLU  11           1HB      GLU  11 -11.111  -9.298   8.601
   89    HG2  GLU  11           2HG      GLU  11 -12.177  -8.696  10.446
   90    HG3  GLU  11           1HG      GLU  11 -12.120  -6.991   9.999
   91    H    SER  12           H        SER  12  -8.904  -7.530  10.216
   92    HA   SER  12           HA       SER  12  -6.871  -8.403  10.700
   93    HG   SER  12           HG       SER  12  -5.533 -10.485   8.585
   94    HB2  SER  12           2HB      SER  12  -7.802 -10.537  10.273
   95    HB3  SER  12           1HB      SER  12  -7.748 -10.300   8.526
   96    H    ALA  13           H        ALA  13  -7.149  -6.293   8.685
   97    HA   ALA  13           HA       ALA  13  -5.442  -6.443   6.519
   98    HB1  ALA  13           3HB      ALA  13  -5.282  -4.080   6.587
   99    HB2  ALA  13           1HB      ALA  13  -5.661  -4.069   8.301
  100    HB3  ALA  13           2HB      ALA  13  -6.897  -4.518   7.139
  101    H    ALA  14           H        ALA  14  -4.530  -5.387   9.781
  102    HA   ALA  14           HA       ALA  14  -1.942  -4.679   9.452
  103    HB1  ALA  14           3HB      ALA  14  -3.044  -4.527  11.561
  104    HB2  ALA  14           1HB      ALA  14  -1.532  -5.414  11.764
  105    HB3  ALA  14           2HB      ALA  14  -3.066  -6.284  11.732
  106    H    ARG  15           H        ARG  15  -3.056  -7.992   9.171
  107    HA   ARG  15           HA       ARG  15  -0.399  -9.100   9.408
  108    HE   ARG  15           HE       ARG  15   0.988 -13.468   8.375
  109    HB2  ARG  15           2HB      ARG  15  -2.695 -10.244   9.890
  110    HB3  ARG  15           1HB      ARG  15  -2.713 -10.551   8.163
  111    HG2  ARG  15           2HG      ARG  15  -1.070 -11.759  10.288
  112    HG3  ARG  15           1HG      ARG  15  -1.765 -12.473   8.838
  113    HD2  ARG  15           2HD      ARG  15  -0.003 -11.581   7.471
  114    HD3  ARG  15           1HD      ARG  15   0.620 -10.628   8.815
  115   HH11  ARG  15          1HH1      ARG  15   1.262 -10.793  10.605
  116   HH12  ARG  15          2HH1      ARG  15   2.428 -11.589  11.606
  117   HH21  ARG  15          1HH2      ARG  15   2.518 -14.512   9.694
  118   HH22  ARG  15          2HH2      ARG  15   3.141 -13.699  11.091
  119    H    TYR  16           H        TYR  16  -2.596  -8.290   6.765
  120    HA   TYR  16           HA       TYR  16  -0.947  -9.416   4.743
  121    HD1  TYR  16           1HD      TYR  16  -2.572 -10.809   4.963
  122    HD2  TYR  16           2HD      TYR  16  -5.174  -7.725   3.585
  123    HE1  TYR  16           1HE      TYR  16  -4.466 -12.346   5.100
  124    HE2  TYR  16           2HE      TYR  16  -7.074  -9.268   3.731
  125    HH   TYR  16           HH       TYR  16  -7.351 -11.857   3.635
  126    HB2  TYR  16           2HB      TYR  16  -2.957  -7.170   4.471
  127    HB3  TYR  16           1HB      TYR  16  -2.259  -8.090   3.148
  128    H    VAL  17           H        VAL  17  -0.772  -6.482   6.571
  129    HA   VAL  17           HA       VAL  17   1.006  -5.165   4.716
  130    HB   VAL  17           HB       VAL  17   0.008  -4.485   7.455
  131   HG11  VAL  17          1HG1      VAL  17   1.657  -2.383   6.860
  132   HG12  VAL  17          2HG1      VAL  17   2.662  -3.762   6.437
  133   HG13  VAL  17          3HG1      VAL  17   1.997  -3.614   8.067
  134   HG21  VAL  17          3HG2      VAL  17   0.257  -2.857   4.952
  135   HG22  VAL  17          1HG2      VAL  17  -0.649  -2.447   6.406
  136   HG23  VAL  17          2HG2      VAL  17  -1.169  -3.798   5.392
  137    H    ASN  18           H        ASN  18   1.311  -6.884   7.814
  138    HA   ASN  18           HA       ASN  18   4.130  -6.616   7.937
  139    HB2  ASN  18           2HB      ASN  18   2.490  -8.775   9.263
  140    HB3  ASN  18           1HB      ASN  18   4.047  -8.137   9.782
  141   HD21  ASN  18          1HD2      ASN  18   3.425  -5.386   9.340
  142   HD22  ASN  18          2HD2      ASN  18   2.295  -4.915  10.558
  143    H    ARG  19           H        ARG  19   2.015  -8.883   6.332
  144    HA   ARG  19           HA       ARG  19   4.028 -10.881   5.956
  145    HE   ARG  19           HE       ARG  19   1.495 -15.462   5.555
  146    HB2  ARG  19           2HB      ARG  19   1.353 -10.960   5.891
  147    HB3  ARG  19           1HB      ARG  19   1.663 -10.779   4.169
  148    HG2  ARG  19           2HG      ARG  19   2.142 -12.923   4.007
  149    HG3  ARG  19           1HG      ARG  19   3.421 -12.751   5.206
  150    HD2  ARG  19           2HD      ARG  19   2.189 -13.679   6.822
  151    HD3  ARG  19           1HD      ARG  19   0.738 -12.801   6.344
  152   HH11  ARG  19          1HH1      ARG  19  -0.429 -12.664   4.748
  153   HH12  ARG  19          2HH1      ARG  19  -1.561 -13.562   3.795
  154   HH21  ARG  19          1HH2      ARG  19   0.007 -16.645   4.300
  155   HH22  ARG  19          2HH2      ARG  19  -1.314 -15.822   3.540
  156    H    LEU  20           H        LEU  20   3.250  -7.951   4.346
  157    HA   LEU  20           HA       LEU  20   4.127  -8.672   1.741
  158    HG   LEU  20           HG       LEU  20   1.735  -6.730   2.945
  159    HB2  LEU  20           2HB      LEU  20   3.949  -5.961   3.043
  160    HB3  LEU  20           1HB      LEU  20   4.219  -6.235   1.334
  161   HD11  LEU  20          1HD1      LEU  20   2.278  -4.498   1.863
  162   HD12  LEU  20          2HD1      LEU  20   0.720  -5.212   1.445
  163   HD13  LEU  20          3HD1      LEU  20   2.070  -5.314   0.314
  164   HD21  LEU  20          3HD2      LEU  20   2.425  -7.862   0.231
  165   HD22  LEU  20          1HD2      LEU  20   0.769  -7.668   0.800
  166   HD23  LEU  20          2HD2      LEU  20   1.876  -8.731   1.665
  167    H    CYS  21           H        CYS  21   5.749  -6.977   4.431
  168    HA   CYS  21           HA       CYS  21   8.136  -6.445   3.093
  169    HG   CYS  21           HG       CYS  21   6.501  -4.853   4.887
  170    HB2  CYS  21           2HB      CYS  21   8.012  -7.166   6.025
  171    HB3  CYS  21           1HB      CYS  21   9.143  -6.087   5.224
  172    H    LYS  22           H        LYS  22   6.960  -9.376   4.569
  173    HA   LYS  22           HA       LYS  22   9.488 -10.753   4.245
  174    HB2  LYS  22           2HB      LYS  22   6.778 -11.859   4.984
  175    HB3  LYS  22           1HB      LYS  22   8.320 -12.690   5.137
  176    HG2  LYS  22           2HG      LYS  22   8.752 -11.741   7.105
  177    HG3  LYS  22           1HG      LYS  22   8.298 -10.137   6.528
  178    HD2  LYS  22           2HD      LYS  22   6.785 -10.672   8.273
  179    HD3  LYS  22           1HD      LYS  22   5.890 -10.866   6.763
  180    HE2  LYS  22           2HE      LYS  22   5.329 -12.747   8.035
  181    HE3  LYS  22           1HE      LYS  22   6.538 -13.322   6.887
  182    HZ1  LYS  22           3HZ      LYS  22   7.443 -14.180   8.744
  183    HZ2  LYS  22           1HZ      LYS  22   6.698 -13.065   9.777
  184    HZ3  LYS  22           2HZ      LYS  22   8.092 -12.629   8.925
  185    H    HIS  23           H        HIS  23   6.650 -10.146   2.410
  186    HA   HIS  23           HA       HIS  23   6.935 -12.431   0.677
  187    HD1  HIS  23           1HD      HIS  23   3.784 -13.463   0.422
  188    HD2  HIS  23           2HD      HIS  23   5.241 -10.939  -2.540
  189    HE1  HIS  23           1HE      HIS  23   3.035 -14.478  -1.754
  190    HE2  HIS  23           2HE      HIS  23   4.009 -12.985  -3.534
  191    HB2  HIS  23           2HB      HIS  23   4.732 -11.314   1.341
  192    HB3  HIS  23           1HB      HIS  23   5.158 -10.052   0.189
  193    H    TRP  24           H        TRP  24   6.962  -8.882   0.076
  194    HA   TRP  24           HA       TRP  24   8.369  -9.385  -2.425
  195    HD1  TRP  24           HD       TRP  24   4.760  -6.623  -1.634
  196    HE1  TRP  24           1HE      TRP  24   3.057  -7.687  -3.244
  197    HE3  TRP  24           3HE      TRP  24   7.942  -9.543  -4.371
  198    HZ2  TRP  24           2HZ      TRP  24   3.061  -9.522  -5.390
  199    HZ3  TRP  24           3HZ      TRP  24   7.012 -10.923  -6.184
  200    HH2  TRP  24           HH       TRP  24   4.622 -10.911  -6.681
  201    HB2  TRP  24           2HB      TRP  24   7.262  -6.858  -1.198
  202    HB3  TRP  24           1HB      TRP  24   8.093  -6.920  -2.750
  203    H    GLY  25           H        GLY  25   9.249  -8.730   0.803
  204    HA2  GLY  25           2HA      GLY  25  11.501  -7.054   0.327
  205    HA3  GLY  25           1HA      GLY  25  11.210  -8.008   1.767
  206    H    HIS  26           H        HIS  26  12.006  -8.602  -1.656
  207    HA   HIS  26           HA       HIS  26  13.922 -10.636  -0.738
  208    HD1  HIS  26           1HD      HIS  26  12.060 -13.355  -3.804
  209    HD2  HIS  26           2HD      HIS  26  15.070 -12.415  -1.098
  210    HE1  HIS  26           1HE      HIS  26  13.194 -15.537  -3.276
  211    HE2  HIS  26           2HE      HIS  26  14.954 -14.956  -1.569
  212    HB2  HIS  26           2HB      HIS  26  11.861 -10.964  -2.499
  213    HB3  HIS  26           1HB      HIS  26  13.195 -10.614  -3.593
  214    H    LYS  27           H        LYS  27  13.509  -7.698  -2.550
  215    HA   LYS  27           HA       LYS  27  16.407  -7.437  -2.740
  216    HB2  LYS  27           2HB      LYS  27  15.931  -8.560  -4.822
  217    HB3  LYS  27           1HB      LYS  27  14.600  -7.469  -5.168
  218    HG2  LYS  27           2HG      LYS  27  17.154  -6.090  -4.825
  219    HG3  LYS  27           1HG      LYS  27  17.151  -7.260  -6.145
  220    HD2  LYS  27           2HD      LYS  27  14.855  -5.376  -5.876
  221    HD3  LYS  27           1HD      LYS  27  16.379  -4.780  -6.536
  222    HE2  LYS  27           2HE      LYS  27  15.759  -7.281  -7.761
  223    HE3  LYS  27           1HE      LYS  27  14.342  -6.236  -7.855
  224    HZ1  LYS  27           3HZ      LYS  27  16.085  -6.104  -9.707
  225    HZ2  LYS  27           1HZ      LYS  27  17.012  -5.224  -8.598
  226    HZ3  LYS  27           2HZ      LYS  27  15.492  -4.654  -9.070
  227    H    PHE  28           H        PHE  28  13.958  -6.127  -1.470
  228    HA   PHE  28           HA       PHE  28  14.732  -3.413  -2.185
  229    HD1  PHE  28           1HD      PHE  28  13.394  -1.350  -3.502
  230    HD2  PHE  28           2HD      PHE  28  12.218  -5.300  -4.559
  231    HE1  PHE  28           1HE      PHE  28  13.678  -0.794  -5.882
  232    HE2  PHE  28           2HE      PHE  28  12.492  -4.750  -6.942
  233    HZ   PHE  28           HZ       PHE  28  13.227  -2.494  -7.606
  234    HB2  PHE  28           2HB      PHE  28  11.971  -4.550  -2.343
  235    HB3  PHE  28           1HB      PHE  28  12.192  -2.852  -1.923
  236    H    GLU  29           H        GLU  29  13.893  -1.802  -0.607
  237    HA   GLU  29           HA       GLU  29  14.407  -2.851   2.055
  238    HB2  GLU  29           2HB      GLU  29  14.160  -0.363   2.669
  239    HB3  GLU  29           1HB      GLU  29  15.538  -0.844   1.689
  240    HG2  GLU  29           2HG      GLU  29  13.138  -0.056   0.193
  241    HG3  GLU  29           1HG      GLU  29  13.919   1.221   1.124
  242    H    VAL  30           H        VAL  30  12.754  -3.814   3.039
  243    HA   VAL  30           HA       VAL  30  10.152  -2.442   3.006
  244    HB   VAL  30           HB       VAL  30   9.424  -4.930   3.726
  245   HG11  VAL  30          1HG1      VAL  30   8.985  -5.304   1.215
  246   HG12  VAL  30          2HG1      VAL  30   9.661  -3.689   1.020
  247   HG13  VAL  30          3HG1      VAL  30   8.227  -3.932   2.021
  248   HG21  VAL  30          3HG2      VAL  30  11.528  -5.490   1.661
  249   HG22  VAL  30          1HG2      VAL  30  10.588  -6.630   2.629
  250   HG23  VAL  30          2HG2      VAL  30  11.845  -5.653   3.390
  251    H    GLU  31           H        GLU  31   9.732  -1.494   4.888
  252    HA   GLU  31           HA       GLU  31  10.906  -2.554   7.340
  253    HB2  GLU  31           2HB      GLU  31  10.234   0.051   6.389
  254    HB3  GLU  31           1HB      GLU  31   9.278  -0.260   7.831
  255    HG2  GLU  31           2HG      GLU  31  11.108  -0.368   9.194
  256    HG3  GLU  31           1HG      GLU  31  12.183  -0.881   7.894
  257    H    LEU  32           H        LEU  32   9.721  -3.386   9.012
  258    HA   LEU  32           HA       LEU  32   6.816  -3.658   8.546
  259    HG   LEU  32           HG       LEU  32   5.955  -6.327   8.487
  260    HB2  LEU  32           2HB      LEU  32   8.205  -5.756   8.211
  261    HB3  LEU  32           1HB      LEU  32   8.515  -5.736   9.936
  262   HD11  LEU  32          1HD1      LEU  32   6.312  -8.395   9.217
  263   HD12  LEU  32          2HD1      LEU  32   6.601  -7.840  10.865
  264   HD13  LEU  32          3HD1      LEU  32   7.923  -7.862   9.699
  265   HD21  LEU  32          3HD2      LEU  32   5.190  -4.721  10.068
  266   HD22  LEU  32          1HD2      LEU  32   6.227  -5.376  11.335
  267   HD23  LEU  32          2HD2      LEU  32   4.849  -6.307  10.755
  268    H    THR  33           H        THR  33   5.830  -2.380   9.919
  269    HA   THR  33           HA       THR  33   6.597  -2.537  12.781
  270    HB   THR  33           HB       THR  33   5.537  -0.114  12.764
  271    HG1  THR  33           1HG      THR  33   5.372   0.783  10.885
  272   HG21  THR  33          3HG2      THR  33   8.302  -0.388  11.635
  273   HG22  THR  33          1HG2      THR  33   7.915  -0.717  13.323
  274   HG23  THR  33          2HG2      THR  33   7.658   0.896  12.658
  275    HA   PRO  34           HA       PRO  34   2.328  -3.490  13.345
  276    HB2  PRO  34           2HB      PRO  34   1.741  -2.430  15.745
  277    HB3  PRO  34           1HB      PRO  34   2.834  -3.801  15.552
  278    HG2  PRO  34           2HG      PRO  34   3.475  -0.924  16.015
  279    HG3  PRO  34           1HG      PRO  34   4.250  -2.368  16.689
  280    HD2  PRO  34           2HD      PRO  34   5.238  -0.907  14.568
  281    HD3  PRO  34           1HD      PRO  34   5.626  -2.610  14.881
  282    H    GLU  35           H        GLU  35   2.605  -1.360  11.634
  283    HA   GLU  35           HA       GLU  35   0.131   0.044  12.077
  284    HB2  GLU  35           2HB      GLU  35   2.744   1.547  11.822
  285    HB3  GLU  35           1HB      GLU  35   1.152   2.284  11.709
  286    HG2  GLU  35           2HG      GLU  35   2.161   0.808  14.128
  287    HG3  GLU  35           1HG      GLU  35   2.279   2.550  13.906
  288    H    ARG  36           H        ARG  36   2.978  -0.476   9.994
  289    HA   ARG  36           HA       ARG  36   1.347  -0.836   7.722
  290    HE   ARG  36           HE       ARG  36   3.404   4.880   9.496
  291    HB2  ARG  36           2HB      ARG  36   2.180   1.116   6.413
  292    HB3  ARG  36           1HB      ARG  36   1.107   1.553   7.732
  293    HG2  ARG  36           2HG      ARG  36   3.962   1.514   8.413
  294    HG3  ARG  36           1HG      ARG  36   3.485   2.737   7.233
  295    HD2  ARG  36           2HD      ARG  36   1.545   2.775   9.272
  296    HD3  ARG  36           1HD      ARG  36   3.111   2.705  10.073
  297   HH11  ARG  36          1HH1      ARG  36   1.197   3.458   7.196
  298   HH12  ARG  36          2HH1      ARG  36   0.949   4.937   6.331
  299   HH21  ARG  36          1HH2      ARG  36   3.077   6.825   8.360
  300   HH22  ARG  36          2HH2      ARG  36   2.016   6.848   6.991
  301    H    GLY  37           H        GLY  37   2.605  -0.901   5.679
  302    HA2  GLY  37           2HA      GLY  37   5.256  -2.098   6.195
  303    HA3  GLY  37           1HA      GLY  37   4.194  -2.544   4.866
  304    H    PHE  38           H        PHE  38   6.932  -0.751   5.565
  305    HA   PHE  38           HA       PHE  38   6.401   1.285   3.519
  306    HD1  PHE  38           1HD      PHE  38   7.120   3.889   3.815
  307    HD2  PHE  38           2HD      PHE  38  10.646   1.614   4.585
  308    HE1  PHE  38           1HE      PHE  38   8.491   5.653   2.797
  309    HE2  PHE  38           2HE      PHE  38  12.009   3.368   3.541
  310    HZ   PHE  38           HZ       PHE  38  10.932   5.392   2.642
  311    HB2  PHE  38           2HB      PHE  38   7.293   2.067   5.644
  312    HB3  PHE  38           1HB      PHE  38   8.636   0.943   5.533
  313    H    ILE  39           H        ILE  39   7.084   0.985   1.513
  314    HA   ILE  39           HA       ILE  39   9.514  -0.631   1.063
  315    HB   ILE  39           HB       ILE  39   7.276  -0.898  -0.899
  316   HG12  ILE  39          2HG1      ILE  39   7.459  -2.334   1.746
  317   HG13  ILE  39          1HG1      ILE  39   6.054  -1.589   0.995
  318   HG21  ILE  39          1HG2      ILE  39   9.892  -1.966  -0.545
  319   HG22  ILE  39          2HG2      ILE  39   8.776  -2.187  -1.889
  320   HG23  ILE  39          3HG2      ILE  39   8.730  -3.292  -0.518
  321   HD11  ILE  39          3HD1      ILE  39   7.392  -4.068  -0.053
  322   HD12  ILE  39          1HD1      ILE  39   5.857  -3.371  -0.575
  323   HD13  ILE  39          2HD1      ILE  39   6.008  -4.065   1.039
  324    H    ASP  40           H        ASP  40  10.841   0.997   0.337
  325    HA   ASP  40           HA       ASP  40   9.745   2.828  -1.671
  326    HB2  ASP  40           2HB      ASP  40  11.984   4.053  -1.228
  327    HB3  ASP  40           1HB      ASP  40  10.713   4.146  -0.018
  328    H    PHE  41           H        PHE  41  10.454   2.878  -3.681
  329    HA   PHE  41           HA       PHE  41  12.279   0.756  -4.519
  330    HD1  PHE  41           1HD      PHE  41  11.785  -0.673  -6.979
  331    HD2  PHE  41           2HD      PHE  41   8.396   1.182  -5.198
  332    HE1  PHE  41           1HE      PHE  41  10.532  -2.781  -7.178
  333    HE2  PHE  41           2HE      PHE  41   7.139  -0.922  -5.390
  334    HZ   PHE  41           HZ       PHE  41   8.206  -2.908  -6.382
  335    HB2  PHE  41           2HB      PHE  41  10.240   2.485  -5.886
  336    HB3  PHE  41           1HB      PHE  41  11.536   1.799  -6.856
  337    H    GLY  42           H        GLY  42  12.683   3.781  -3.441
  338    HA2  GLY  42           2HA      GLY  42  14.957   4.663  -3.548
  339    HA3  GLY  42           1HA      GLY  42  14.941   4.306  -5.268
  340    H    ASP  43           H        ASP  43  13.369   5.525  -6.598
  341    HA   ASP  43           HA       ASP  43  13.250   8.303  -5.685
  342    HB2  ASP  43           2HB      ASP  43  13.075   6.996  -8.393
  343    HB3  ASP  43           1HB      ASP  43  12.601   8.675  -8.155
  344    H    SER  44           H        SER  44  11.462   6.773  -4.382
  345    HA   SER  44           HA       SER  44   9.056   8.054  -4.590
  346    HG   SER  44           HG       SER  44   8.685   4.484  -5.727
  347    HB2  SER  44           2HB      SER  44   7.852   7.110  -6.240
  348    HB3  SER  44           1HB      SER  44   9.306   6.285  -6.755
  349    H    ASN  45           H        ASN  45   7.176   6.197  -3.713
  350    HA   ASN  45           HA       ASN  45   8.390   4.396  -1.824
  351    HB2  ASN  45           2HB      ASN  45   7.067   6.944  -0.872
  352    HB3  ASN  45           1HB      ASN  45   7.326   5.553   0.170
  353   HD21  ASN  45          1HD2      ASN  45   8.898   8.057  -1.707
  354   HD22  ASN  45          2HD2      ASN  45  10.409   7.997  -0.873
  355    H    CYS  46           H        CYS  46   6.734   3.192  -0.559
  356    HA   CYS  46           HA       CYS  46   3.974   3.594  -1.332
  357    HG   CYS  46           HG       CYS  46   2.427   1.420  -2.638
  358    HB2  CYS  46           2HB      CYS  46   4.796   2.177  -3.143
  359    HB3  CYS  46           1HB      CYS  46   5.425   1.020  -1.976
  360    H    GLU  47           H        GLU  47   3.283   3.813   0.709
  361    HA   GLU  47           HA       GLU  47   4.092   1.832   2.710
  362    HB2  GLU  47           2HB      GLU  47   4.167   4.484   2.913
  363    HB3  GLU  47           1HB      GLU  47   2.492   4.263   3.395
  364    HG2  GLU  47           2HG      GLU  47   3.060   3.228   5.365
  365    HG3  GLU  47           1HG      GLU  47   4.616   2.664   4.754
  366    H    LEU  48           H        LEU  48   2.461   0.876   4.079
  367    HA   LEU  48           HA       LEU  48  -0.275   1.020   3.031
  368    HG   LEU  48           HG       LEU  48  -1.036  -2.151   3.894
  369    HB2  LEU  48           2HB      LEU  48   0.825  -0.885   1.902
  370    HB3  LEU  48           1HB      LEU  48   1.209  -1.588   3.460
  371   HD11  LEU  48          1HD1      LEU  48  -2.354  -0.330   3.394
  372   HD12  LEU  48          2HD1      LEU  48  -2.809  -1.461   2.121
  373   HD13  LEU  48          3HD1      LEU  48  -1.683  -0.151   1.772
  374   HD21  LEU  48          3HD2      LEU  48  -1.750  -3.312   1.742
  375   HD22  LEU  48          1HD2      LEU  48  -0.173  -3.733   2.408
  376   HD23  LEU  48          2HD2      LEU  48  -0.285  -2.637   1.031
  377    H    LEU  49           H        LEU  49  -1.473   1.621   4.685
  378    HA   LEU  49           HA       LEU  49  -0.723   0.856   7.410
  379    HG   LEU  49           HG       LEU  49  -1.896   1.839   9.177
  380    HB2  LEU  49           2HB      LEU  49  -1.599   3.200   6.657
  381    HB3  LEU  49           1HB      LEU  49  -3.174   2.435   6.720
  382   HD11  LEU  49          1HD1      LEU  49  -0.951   3.735   9.964
  383   HD12  LEU  49          2HD1      LEU  49  -1.970   4.786   8.981
  384   HD13  LEU  49          3HD1      LEU  49  -0.582   3.975   8.256
  385   HD21  LEU  49          3HD2      LEU  49  -3.724   3.242  10.080
  386   HD22  LEU  49          1HD2      LEU  49  -4.278   2.061   8.894
  387   HD23  LEU  49          2HD2      LEU  49  -4.104   3.755   8.437
  388    H    ALA  50           H        ALA  50  -1.732  -0.728   8.552
  389    HA   ALA  50           HA       ALA  50  -4.284  -1.723   7.539
  390    HB1  ALA  50           3HB      ALA  50  -3.481  -4.014   7.498
  391    HB2  ALA  50           1HB      ALA  50  -1.857  -3.454   7.880
  392    HB3  ALA  50           2HB      ALA  50  -2.625  -2.993   6.360
  393    H    HIS  51           H        HIS  51  -5.625  -1.727   9.153
  394    HA   HIS  51           HA       HIS  51  -4.702  -2.579  11.783
  395    HD1  HIS  51           1HD      HIS  51  -7.707  -0.037  13.869
  396    HD2  HIS  51           2HD      HIS  51  -3.780  -1.345  13.464
  397    HE1  HIS  51           1HE      HIS  51  -6.671   0.226  16.144
  398    HE2  HIS  51           2HE      HIS  51  -4.320  -0.642  15.892
  399    HB2  HIS  51           2HB      HIS  51  -5.876  -0.177  11.151
  400    HB3  HIS  51           1HB      HIS  51  -7.271  -1.127  11.638
  401    HA   PRO  52           HA       PRO  52  -7.263  -6.136  11.991
  402    HB2  PRO  52           2HB      PRO  52  -8.997  -4.708  13.966
  403    HB3  PRO  52           1HB      PRO  52  -8.298  -6.331  14.043
  404    HG2  PRO  52           2HG      PRO  52  -7.188  -4.351  15.399
  405    HG3  PRO  52           1HG      PRO  52  -6.172  -5.533  14.556
  406    HD2  PRO  52           2HD      PRO  52  -6.818  -2.719  13.809
  407    HD3  PRO  52           1HD      PRO  52  -5.319  -3.629  13.562
  408    H    ASP  53           H        ASP  53  -8.897  -3.090  11.337
  409    HA   ASP  53           HA       ASP  53 -10.828  -4.619   9.773
  410    HB2  ASP  53           2HB      ASP  53 -11.696  -3.921  12.128
  411    HB3  ASP  53           1HB      ASP  53 -11.852  -2.323  11.404
  412    H    HIS  54           H        HIS  54  -8.595  -2.216   9.645
  413    HA   HIS  54           HA       HIS  54  -9.890  -1.215   7.253
  414    HD1  HIS  54           1HD      HIS  54  -7.239   1.956   8.816
  415    HD2  HIS  54           2HD      HIS  54  -9.795   0.117  11.526
  416    HE1  HIS  54           1HE      HIS  54  -6.295   2.475  11.087
  417    HE2  HIS  54           2HE      HIS  54  -7.951   1.492  12.709
  418    HB2  HIS  54           2HB      HIS  54  -9.428   1.158   7.778
  419    HB3  HIS  54           1HB      HIS  54 -10.622   0.429   8.836
  420    H    VAL  55           H        VAL  55  -8.433  -0.067   5.764
  421    HA   VAL  55           HA       VAL  55  -5.594  -0.413   6.336
  422    HB   VAL  55           HB       VAL  55  -6.735  -2.391   5.025
  423   HG11  VAL  55          1HG1      VAL  55  -7.541  -0.597   3.291
  424   HG12  VAL  55          2HG1      VAL  55  -7.030  -2.200   2.765
  425   HG13  VAL  55          3HG1      VAL  55  -5.925  -0.832   2.625
  426   HG21  VAL  55          3HG2      VAL  55  -4.628  -2.910   3.989
  427   HG22  VAL  55          1HG2      VAL  55  -4.343  -2.164   5.561
  428   HG23  VAL  55          2HG2      VAL  55  -4.128  -1.221   4.085
  429    H    LEU  56           H        LEU  56  -4.313   1.103   5.422
  430    HA   LEU  56           HA       LEU  56  -5.588   3.065   3.626
  431    HG   LEU  56           HG       LEU  56  -6.368   4.658   5.564
  432    HB2  LEU  56           2HB      LEU  56  -4.326   3.445   6.194
  433    HB3  LEU  56           1HB      LEU  56  -3.422   4.309   4.973
  434   HD11  LEU  56          1HD1      LEU  56  -5.834   6.628   6.701
  435   HD12  LEU  56          2HD1      LEU  56  -4.178   6.637   6.097
  436   HD13  LEU  56          3HD1      LEU  56  -4.674   5.441   7.296
  437   HD21  LEU  56          3HD2      LEU  56  -5.802   6.831   4.196
  438   HD22  LEU  56          1HD2      LEU  56  -6.245   5.339   3.370
  439   HD23  LEU  56          2HD2      LEU  56  -4.549   5.810   3.496
  440    H    MET  57           H        MET  57  -4.329   3.921   1.964
  441    HA   MET  57           HA       MET  57  -1.718   2.637   1.554
  442    HB2  MET  57           2HB      MET  57  -3.595   3.182  -0.721
  443    HB3  MET  57           1HB      MET  57  -2.210   2.099  -0.673
  444    HG2  MET  57           2HG      MET  57  -3.410   0.610   0.848
  445    HG3  MET  57           1HG      MET  57  -4.797   1.701   0.811
  446    HE1  MET  57           3HE      MET  57  -6.458   1.748  -0.461
  447    HE2  MET  57           1HE      MET  57  -6.902   0.076  -0.802
  448    HE3  MET  57           2HE      MET  57  -6.667   1.213  -2.129
  449    H    ILE  58           H        ILE  58  -0.180   4.189   1.562
  450    HA   ILE  58           HA       ILE  58  -0.799   6.721   0.199
  451    HB   ILE  58           HB       ILE  58   1.014   6.404   2.595
  452   HG12  ILE  58          2HG1      ILE  58  -1.849   6.627   2.481
  453   HG13  ILE  58          1HG1      ILE  58  -0.816   6.492   3.889
  454   HG21  ILE  58          1HG2      ILE  58   1.639   8.196   1.057
  455   HG22  ILE  58          2HG2      ILE  58   1.075   8.832   2.602
  456   HG23  ILE  58          3HG2      ILE  58   0.015   8.875   1.192
  457   HD11  ILE  58          3HD1      ILE  58  -2.400   8.519   3.648
  458   HD12  ILE  58          1HD1      ILE  58  -1.162   9.142   2.556
  459   HD13  ILE  58          2HD1      ILE  58  -0.755   8.768   4.231
  460    H    LEU  59           H        LEU  59   0.702   7.466  -1.226
  461    HA   LEU  59           HA       LEU  59   3.226   5.957  -1.424
  462    HG   LEU  59           HG       LEU  59   1.407   6.909  -5.168
  463    HB2  LEU  59           2HB      LEU  59   3.105   5.863  -3.743
  464    HB3  LEU  59           1HB      LEU  59   1.473   5.498  -3.230
  465   HD11  LEU  59          1HD1      LEU  59  -0.329   7.230  -3.513
  466   HD12  LEU  59          2HD1      LEU  59   0.057   8.748  -4.326
  467   HD13  LEU  59          3HD1      LEU  59   0.660   8.442  -2.700
  468   HD21  LEU  59          3HD2      LEU  59   3.699   8.070  -4.284
  469   HD22  LEU  59          1HD2      LEU  59   2.508   9.318  -3.933
  470   HD23  LEU  59          2HD2      LEU  59   2.677   8.704  -5.570
  471    H    ASN  60           H        ASN  60   5.070   7.097  -1.920
  472    HA   ASN  60           HA       ASN  60   4.785  10.027  -2.082
  473    HB2  ASN  60           2HB      ASN  60   7.282   8.833  -0.948
  474    HB3  ASN  60           1HB      ASN  60   6.534  10.387  -0.607
  475   HD21  ASN  60          1HD2      ASN  60   7.523   8.538   1.305
  476   HD22  ASN  60          2HD2      ASN  60   6.188   8.034   2.280
  477    H    SER  61           H        SER  61   5.068  10.370  -4.207
  478    HA   SER  61           HA       SER  61   7.598   9.391  -5.382
  479    HG   SER  61           HG       SER  61   5.798   7.304  -5.182
  480    HB2  SER  61           2HB      SER  61   5.212   9.275  -7.138
  481    HB3  SER  61           1HB      SER  61   6.639   8.247  -7.116
  482    HA   PRO  62           HA       PRO  62   7.825  13.539  -6.967
  483    HB2  PRO  62           2HB      PRO  62   9.839  13.143  -8.712
  484    HB3  PRO  62           1HB      PRO  62  10.070  13.202  -6.964
  485    HG2  PRO  62           2HG      PRO  62   9.807  10.796  -8.735
  486    HG3  PRO  62           1HG      PRO  62  11.009  11.121  -7.469
  487    HD2  PRO  62           2HD      PRO  62   8.872   9.580  -7.014
  488    HD3  PRO  62           1HD      PRO  62   9.515  10.659  -5.765
  489    H    ASP  63           H        ASP  63   6.780  10.828  -8.777
  490    HA   ASP  63           HA       ASP  63   5.812  12.664 -10.838
  491    HB2  ASP  63           2HB      ASP  63   6.426  11.071 -12.635
  492    HB3  ASP  63           1HB      ASP  63   7.834  11.722 -11.802
  493    H    GLU  64           H        GLU  64   3.812  12.021 -11.796
  494    HA   GLU  64           HA       GLU  64   2.159  10.409 -10.141
  495    HB2  GLU  64           2HB      GLU  64   1.757  11.627 -12.846
  496    HB3  GLU  64           1HB      GLU  64   0.695  10.315 -12.365
  497    HG2  GLU  64           2HG      GLU  64  -0.495  12.059 -11.555
  498    HG3  GLU  64           1HG      GLU  64   0.507  11.708 -10.142
  499    H    ASP  65           H        ASP  65   3.852   9.553 -13.192
  500    HA   ASP  65           HA       ASP  65   2.840   7.032 -13.628
  501    HB2  ASP  65           2HB      ASP  65   4.644   8.226 -14.953
  502    HB3  ASP  65           1HB      ASP  65   5.786   7.693 -13.721
  503    H    SER  66           H        SER  66   5.589   7.908 -11.567
  504    HA   SER  66           HA       SER  66   5.935   5.389 -10.342
  505    HG   SER  66           HG       SER  66   8.071   5.869  -8.641
  506    HB2  SER  66           2HB      SER  66   7.621   7.217 -10.237
  507    HB3  SER  66           1HB      SER  66   6.530   8.126  -9.188
  508    H    LEU  67           H        LEU  67   4.421   8.326  -9.196
  509    HA   LEU  67           HA       LEU  67   3.293   7.695  -6.840
  510    HG   LEU  67           HG       LEU  67   1.041   9.384  -6.426
  511    HB2  LEU  67           2HB      LEU  67   3.102   9.880  -7.698
  512    HB3  LEU  67           1HB      LEU  67   2.306   9.336  -9.144
  513   HD11  LEU  67          1HD1      LEU  67   0.914  11.568  -6.737
  514   HD12  LEU  67          2HD1      LEU  67  -0.256  11.202  -8.005
  515   HD13  LEU  67          3HD1      LEU  67   1.442  11.439  -8.414
  516   HD21  LEU  67          3HD2      LEU  67   0.077   8.572  -9.121
  517   HD22  LEU  67          1HD2      LEU  67  -1.046   9.322  -7.989
  518   HD23  LEU  67          2HD2      LEU  67  -0.225   7.826  -7.551
  519    H    ALA  68           H        ALA  68   1.497   7.246  -9.909
  520    HA   ALA  68           HA       ALA  68  -0.599   5.804  -8.670
  521    HB1  ALA  68           3HB      ALA  68  -1.192   6.730 -10.715
  522    HB2  ALA  68           1HB      ALA  68  -0.994   5.025 -11.120
  523    HB3  ALA  68           2HB      ALA  68   0.281   6.178 -11.513
  524    H    HIS  69           H        HIS  69   2.435   4.839 -10.173
  525    HA   HIS  69           HA       HIS  69   2.034   2.102 -10.419
  526    HD1  HIS  69           1HD      HIS  69   6.575   2.117 -11.170
  527    HD2  HIS  69           2HD      HIS  69   3.122   0.015 -10.210
  528    HE1  HIS  69           1HE      HIS  69   7.125  -0.303 -11.579
  529    HE2  HIS  69           2HE      HIS  69   5.049  -1.562 -10.907
  530    HB2  HIS  69           2HB      HIS  69   4.066   3.470 -11.140
  531    HB3  HIS  69           1HB      HIS  69   4.630   3.321  -9.479
  532    H    MET  70           H        MET  70   2.905   4.041  -7.626
  533    HA   MET  70           HA       MET  70   3.240   1.778  -5.878
  534    HB2  MET  70           2HB      MET  70   2.898   4.676  -5.118
  535    HB3  MET  70           1HB      MET  70   3.638   3.415  -4.146
  536    HG2  MET  70           2HG      MET  70   4.706   4.580  -6.696
  537    HG3  MET  70           1HG      MET  70   5.333   4.825  -5.068
  538    HE1  MET  70           3HE      MET  70   7.699   2.556  -7.488
  539    HE2  MET  70           1HE      MET  70   6.944   4.150  -7.484
  540    HE3  MET  70           2HE      MET  70   6.146   2.798  -8.288
  541    H    GLN  71           H        GLN  71   0.820   4.452  -5.933
  542    HA   GLN  71           HA       GLN  71  -0.840   3.365  -3.996
  543    HB2  GLN  71           2HB      GLN  71  -2.702   4.688  -5.272
  544    HB3  GLN  71           1HB      GLN  71  -1.446   5.535  -4.392
  545    HG2  GLN  71           2HG      GLN  71  -0.782   6.566  -6.233
  546    HG3  GLN  71           1HG      GLN  71  -0.690   5.056  -7.134
  547   HE21  GLN  71          1HE2      GLN  71  -2.301   4.519  -8.514
  548   HE22  GLN  71          2HE2      GLN  71  -3.669   5.522  -8.839
  549    H    ASN  72           H        ASN  72  -0.570   2.511  -7.363
  550    HA   ASN  72           HA       ASN  72  -3.065   1.056  -7.378
  551    HB2  ASN  72           2HB      ASN  72  -1.772   2.183  -9.385
  552    HB3  ASN  72           1HB      ASN  72  -0.968   0.618  -9.458
  553   HD21  ASN  72          1HD2      ASN  72  -2.954   2.065 -11.207
  554   HD22  ASN  72          2HD2      ASN  72  -4.199   0.900 -11.484
  555    H    VAL  73           H        VAL  73   0.392   0.226  -7.357
  556    HA   VAL  73           HA       VAL  73   0.322  -2.493  -7.523
  557    HB   VAL  73           HB       VAL  73   2.090  -0.632  -5.984
  558   HG11  VAL  73          1HG1      VAL  73   2.241  -3.640  -5.857
  559   HG12  VAL  73          2HG1      VAL  73   2.035  -2.521  -4.509
  560   HG13  VAL  73          3HG1      VAL  73   3.556  -2.556  -5.401
  561   HG21  VAL  73          3HG2      VAL  73   3.525  -0.902  -7.704
  562   HG22  VAL  73          1HG2      VAL  73   2.062  -1.381  -8.564
  563   HG23  VAL  73          2HG2      VAL  73   3.138  -2.611  -7.901
  564    H    VAL  74           H        VAL  74  -0.384  -0.530  -4.669
  565    HA   VAL  74           HA       VAL  74  -0.717  -2.757  -2.914
  566    HB   VAL  74           HB       VAL  74  -1.730   0.073  -2.637
  567   HG11  VAL  74          1HG1      VAL  74  -2.142  -0.370  -0.333
  568   HG12  VAL  74          2HG1      VAL  74  -1.424  -1.975  -0.448
  569   HG13  VAL  74          3HG1      VAL  74  -2.953  -1.633  -1.256
  570   HG21  VAL  74          3HG2      VAL  74   0.306  -0.385  -0.797
  571   HG22  VAL  74          1HG2      VAL  74   0.412   0.577  -2.269
  572   HG23  VAL  74          2HG2      VAL  74   0.882  -1.123  -2.290
  573    H    ALA  75           H        ALA  75  -3.029  -0.673  -4.691
  574    HA   ALA  75           HA       ALA  75  -5.417  -1.680  -3.789
  575    HB1  ALA  75           3HB      ALA  75  -5.395   0.152  -5.339
  576    HB2  ALA  75           1HB      ALA  75  -6.324  -1.164  -6.056
  577    HB3  ALA  75           2HB      ALA  75  -4.674  -0.856  -6.596
  578    H    ASP  76           H        ASP  76  -3.035  -3.170  -5.804
  579    HA   ASP  76           HA       ASP  76  -4.716  -5.312  -6.729
  580    HB2  ASP  76           2HB      ASP  76  -2.364  -4.303  -7.610
  581    HB3  ASP  76           1HB      ASP  76  -1.780  -5.695  -6.704
  582    H    HIS  77           H        HIS  77  -2.296  -4.901  -4.170
  583    HA   HIS  77           HA       HIS  77  -2.174  -7.568  -3.332
  584    HD1  HIS  77           1HD      HIS  77  -0.610  -6.375  -4.688
  585    HD2  HIS  77           2HD      HIS  77   1.102  -4.679  -1.303
  586    HE1  HIS  77           1HE      HIS  77   1.658  -5.568  -5.414
  587    HE2  HIS  77           2HE      HIS  77   2.707  -4.619  -3.329
  588    HB2  HIS  77           2HB      HIS  77  -1.853  -5.134  -1.566
  589    HB3  HIS  77           1HB      HIS  77  -1.214  -6.741  -1.272
  590    H    LEU  78           H        LEU  78  -4.379  -4.960  -2.339
  591    HA   LEU  78           HA       LEU  78  -5.683  -6.404  -0.302
  592    HG   LEU  78           HG       LEU  78  -4.972  -3.199  -0.580
  593    HB2  LEU  78           2HB      LEU  78  -6.588  -4.101  -2.031
  594    HB3  LEU  78           1HB      LEU  78  -7.549  -4.742  -0.715
  595   HD11  LEU  78          1HD1      LEU  78  -7.539  -2.891   0.956
  596   HD12  LEU  78          2HD1      LEU  78  -7.208  -2.075  -0.572
  597   HD13  LEU  78          3HD1      LEU  78  -6.201  -1.749   0.838
  598   HD21  LEU  78          3HD2      LEU  78  -4.447  -4.937   0.903
  599   HD22  LEU  78          1HD2      LEU  78  -6.112  -5.079   1.468
  600   HD23  LEU  78          2HD2      LEU  78  -5.138  -3.684   1.933
  601    H    GLN  79           H        GLN  79  -5.950  -6.404  -3.761
  602    HA   GLN  79           HA       GLN  79  -8.526  -7.622  -3.895
  603    HB2  GLN  79           2HB      GLN  79  -7.837  -6.391  -5.798
  604    HB3  GLN  79           1HB      GLN  79  -6.310  -7.251  -5.901
  605    HG2  GLN  79           2HG      GLN  79  -7.401  -9.238  -6.652
  606    HG3  GLN  79           1HG      GLN  79  -8.989  -8.537  -6.350
  607   HE21  GLN  79          1HE2      GLN  79  -8.897  -6.120  -7.448
  608   HE22  GLN  79          2HE2      GLN  79  -8.576  -6.207  -9.144
  609    H    ARG  80           H        ARG  80  -5.212  -8.901  -4.091
  610    HA   ARG  80           HA       ARG  80  -5.889 -11.553  -4.696
  611    HE   ARG  80           HE       ARG  80  -0.523 -10.227  -6.455
  612    HB2  ARG  80           2HB      ARG  80  -3.535 -10.628  -3.040
  613    HB3  ARG  80           1HB      ARG  80  -3.667 -12.138  -3.932
  614    HG2  ARG  80           2HG      ARG  80  -4.102 -10.306  -5.886
  615    HG3  ARG  80           1HG      ARG  80  -2.948  -9.460  -4.855
  616    HD2  ARG  80           2HD      ARG  80  -1.549 -11.570  -4.929
  617    HD3  ARG  80           1HD      ARG  80  -2.626 -12.130  -6.207
  618   HH11  ARG  80          1HH1      ARG  80  -3.680 -11.067  -7.683
  619   HH12  ARG  80          2HH1      ARG  80  -3.423 -10.304  -9.217
  620   HH21  ARG  80          1HH2      ARG  80  -0.184  -9.223  -8.471
  621   HH22  ARG  80          2HH2      ARG  80  -1.439  -9.258  -9.664
  622    H    MET  81           H        MET  81  -5.655  -9.814  -1.679
  623    HA   MET  81           HA       MET  81  -6.111 -12.174  -0.079
  624    HB2  MET  81           2HB      MET  81  -6.117 -10.648   1.832
  625    HB3  MET  81           1HB      MET  81  -4.720 -10.409   0.803
  626    HG2  MET  81           2HG      MET  81  -5.410  -8.268   1.428
  627    HG3  MET  81           1HG      MET  81  -5.961  -8.468  -0.231
  628    HE1  MET  81           3HE      MET  81  -6.409  -6.780   2.396
  629    HE2  MET  81           1HE      MET  81  -7.812  -7.210   3.373
  630    HE3  MET  81           2HE      MET  81  -7.996  -6.126   1.994
  631    H    ALA  82           H        ALA  82  -8.105 -10.048  -1.792
  632    HA   ALA  82           HA       ALA  82 -10.454 -11.072  -0.335
  633    HB1  ALA  82           3HB      ALA  82  -9.804  -8.235  -1.010
  634    HB2  ALA  82           1HB      ALA  82 -10.494  -8.912   0.466
  635    HB3  ALA  82           2HB      ALA  82 -11.488  -8.759  -0.983
  636    H    ASN  83           H        ASN  83 -10.807 -12.614  -1.939
  637    HA   ASN  83           HA       ASN  83 -11.074 -11.796  -4.703
  638    HB2  ASN  83           2HB      ASN  83 -11.741 -14.487  -3.503
  639    HB3  ASN  83           1HB      ASN  83 -11.410 -14.120  -5.193
  640   HD21  ASN  83          1HD2      ASN  83  -9.243 -13.396  -5.727
  641   HD22  ASN  83          2HD2      ASN  83  -7.908 -13.988  -4.804
  642    H    SER  84           H        SER  84 -12.863 -10.899  -5.452
  643    HA   SER  84           HA       SER  84 -15.396 -11.982  -5.377
  644    HG   SER  84           HG       SER  84 -14.856  -8.932  -3.276
  645    HB2  SER  84           2HB      SER  84 -16.507 -10.279  -3.799
  646    HB3  SER  84           1HB      SER  84 -15.651 -11.629  -3.056
  647    H    GLU  85           H        GLU  85 -13.503  -9.029  -5.368
  648    HA   GLU  85           HA       GLU  85 -14.653  -8.187  -7.857
  649    HB2  GLU  85           2HB      GLU  85 -15.595  -6.094  -7.116
  650    HB3  GLU  85           1HB      GLU  85 -16.350  -7.398  -6.210
  651    HG2  GLU  85           2HG      GLU  85 -14.026  -6.416  -4.823
  652    HG3  GLU  85           1HG      GLU  85 -15.137  -5.099  -5.196
  653    H    SER  86           H        SER  86 -13.655  -6.059  -8.574
  654    HA   SER  86           HA       SER  86 -10.841  -6.174  -8.091
  655    HG   SER  86           HG       SER  86 -13.179  -3.672  -9.030
  656    HB2  SER  86           2HB      SER  86 -10.875  -4.034  -9.528
  657    HB3  SER  86           1HB      SER  86 -11.441  -5.524 -10.283
  658    H    LEU  87           H        LEU  87 -11.180  -5.915  -5.735
  659    HA   LEU  87           HA       LEU  87 -11.570  -4.623  -3.814
  660    HG   LEU  87           HG       LEU  87  -8.133  -4.718  -2.966
  661    HB2  LEU  87           2HB      LEU  87  -8.993  -4.366  -5.027
  662    HB3  LEU  87           1HB      LEU  87  -9.411  -2.837  -4.275
  663   HD11  LEU  87          1HD1      LEU  87 -10.251  -2.848  -1.971
  664   HD12  LEU  87          2HD1      LEU  87  -8.498  -2.650  -1.949
  665   HD13  LEU  87          3HD1      LEU  87  -9.269  -3.805  -0.862
  666   HD21  LEU  87          3HD2      LEU  87  -9.498  -6.122  -1.616
  667   HD22  LEU  87          1HD2      LEU  87  -9.957  -6.397  -3.293
  668   HD23  LEU  87          2HD2      LEU  87 -10.974  -5.402  -2.252
  669    H    GLU  88           H        GLU  88 -13.192  -3.248  -3.495
  670    HA   GLU  88           HA       GLU  88 -13.532  -0.890  -5.095
  671    HB2  GLU  88           2HB      GLU  88 -14.842  -1.953  -2.600
  672    HB3  GLU  88           1HB      GLU  88 -15.141  -0.302  -3.119
  673    HG2  GLU  88           2HG      GLU  88 -15.486  -1.945  -5.383
  674    HG3  GLU  88           1HG      GLU  88 -16.331  -2.720  -4.043
  675    H    ILE  89           H        ILE  89 -11.763   0.428  -4.963
  676    HA   ILE  89           HA       ILE  89 -11.195   1.529  -2.309
  677    HB   ILE  89           HB       ILE  89  -8.869   1.416  -2.526
  678   HG12  ILE  89          2HG1      ILE  89  -8.930   2.169  -5.012
  679   HG13  ILE  89          1HG1      ILE  89  -7.605   1.153  -4.474
  680   HG21  ILE  89          1HG2      ILE  89  -8.370  -0.947  -3.178
  681   HG22  ILE  89          2HG2      ILE  89 -10.054  -1.081  -3.683
  682   HG23  ILE  89          3HG2      ILE  89  -9.665  -0.741  -1.999
  683   HD11  ILE  89          3HD1      ILE  89  -8.676  -0.796  -5.425
  684   HD12  ILE  89          1HD1      ILE  89  -8.463   0.461  -6.644
  685   HD13  ILE  89          2HD1      ILE  89 -10.052   0.187  -5.930
  686    H    ALA  90           H        ALA  90 -11.222   3.758  -2.248
  687    HA   ALA  90           HA       ALA  90 -11.454   5.104  -4.837
  688    HB1  ALA  90           3HB      ALA  90 -12.381   6.964  -3.711
  689    HB2  ALA  90           1HB      ALA  90 -11.806   6.406  -2.141
  690    HB3  ALA  90           2HB      ALA  90 -13.114   5.547  -2.961
  691    H    TRP  91           H        TRP  91  -9.614   5.695  -5.710
  692    HA   TRP  91           HA       TRP  91  -7.357   6.435  -4.016
  693    HD1  TRP  91           HD       TRP  91  -8.869   4.109  -7.378
  694    HE1  TRP  91           1HE      TRP  91  -9.552   4.852  -9.746
  695    HE3  TRP  91           3HE      TRP  91  -6.140   8.420  -7.695
  696    HZ2  TRP  91           2HZ      TRP  91  -9.005   6.983 -11.514
  697    HZ3  TRP  91           3HZ      TRP  91  -6.275   9.753  -9.759
  698    HH2  TRP  91           HH       TRP  91  -7.679   9.048 -11.628
  699    HB2  TRP  91           2HB      TRP  91  -6.061   6.384  -6.142
  700    HB3  TRP  91           1HB      TRP  91  -6.861   4.858  -5.778
  701    H    GLN  92           H        GLN  92  -6.602   8.444  -3.803
  702    HA   GLN  92           HA       GLN  92  -8.120  10.602  -5.028
  703    HB2  GLN  92           2HB      GLN  92  -5.975  10.582  -2.900
  704    HB3  GLN  92           1HB      GLN  92  -6.741  12.046  -3.501
  705    HG2  GLN  92           2HG      GLN  92  -8.884  11.317  -2.687
  706    HG3  GLN  92           1HG      GLN  92  -8.208   9.763  -2.203
  707   HE21  GLN  92          1HE2      GLN  92  -9.083  10.302  -0.103
  708   HE22  GLN  92          2HE2      GLN  92  -8.176  11.315   0.962
  709    HA   PRO  93           HA       PRO  93  -5.452  11.782  -8.314
  710    HB2  PRO  93           2HB      PRO  93  -5.283  14.420  -6.941
  711    HB3  PRO  93           1HB      PRO  93  -5.640  14.060  -8.634
  712    HG2  PRO  93           2HG      PRO  93  -7.592  14.728  -6.945
  713    HG3  PRO  93           1HG      PRO  93  -7.842  13.490  -8.189
  714    HD2  PRO  93           2HD      PRO  93  -7.493  13.182  -5.256
  715    HD3  PRO  93           1HD      PRO  93  -8.395  12.170  -6.401
  716    H    ALA  94           H        ALA  94  -4.501  12.877  -5.079
  717    HA   ALA  94           HA       ALA  94  -2.484  12.352  -4.012
  718    HB1  ALA  94           3HB      ALA  94  -0.665  11.410  -5.047
  719    HB2  ALA  94           1HB      ALA  94  -0.937  12.290  -6.549
  720    HB3  ALA  94           2HB      ALA  94  -1.948  10.904  -6.148
  721    H    GLU  95           H        GLU  95  -3.682  14.873  -5.078
  722    HA   GLU  95           HA       GLU  95  -3.213  17.097  -5.144
  723    HB2  GLU  95           2HB      GLU  95  -1.864  16.085  -3.004
  724    HB3  GLU  95           1HB      GLU  95  -0.554  16.844  -3.898
  725    HG2  GLU  95           2HG      GLU  95  -2.139  18.891  -3.989
  726    HG3  GLU  95           1HG      GLU  95  -2.962  18.090  -2.651
  727    H    SER  96           H        SER  96  -1.551  18.761  -5.885
  728    HA   SER  96           HA       SER  96   0.076  17.615  -8.060
  729    HG   SER  96           HG       SER  96   0.542  20.100  -9.403
  730    HB2  SER  96           2HB      SER  96  -1.936  18.818  -8.882
  731    HB3  SER  96           1HB      SER  96  -1.365  20.278  -8.075
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1   7.002  13.223  -5.191
    2    HB2  MET   1           2HB      MET   1   7.494  12.733  -2.895
    3    HB3  MET   1           1HB      MET   1   8.895  13.513  -3.621
    4    HG2  MET   1           2HG      MET   1   8.832  15.198  -2.172
    5    HG3  MET   1           1HG      MET   1   7.097  15.416  -2.371
    6    HE1  MET   1           3HE      MET   1   8.936  12.015  -0.797
    7    HE2  MET   1           1HE      MET   1   9.318  12.885   0.688
    8    HE3  MET   1           2HE      MET   1   9.909  13.484  -0.861
    9    H    PHE   2           H        PHE   2   4.938  13.331  -5.663
   10    HA   PHE   2           HA       PHE   2   3.115  15.034  -4.158
   11    HD1  PHE   2           2HD      PHE   2   3.758  16.442  -6.377
   12    HD2  PHE   2           1HD      PHE   2   2.993  12.687  -8.232
   13    HE1  PHE   2           2HE      PHE   2   5.097  17.133  -8.320
   14    HE2  PHE   2           1HE      PHE   2   4.324  13.375 -10.178
   15    HZ   PHE   2           HZ       PHE   2   5.382  15.599 -10.226
   16    HB2  PHE   2           2HB      PHE   2   2.076  13.113  -6.181
   17    HB3  PHE   2           1HB      PHE   2   1.634  14.793  -5.905
   18    H    ARG   3           H        ARG   3   0.938  13.853  -3.463
   19    HA   ARG   3           HA       ARG   3   1.493  11.118  -2.653
   20    HE   ARG   3           HE       ARG   3   4.459  10.539   1.586
   21    HB2  ARG   3           2HB      ARG   3   2.017  13.197  -0.855
   22    HB3  ARG   3           1HB      ARG   3   0.487  12.505  -0.323
   23    HG2  ARG   3           2HG      ARG   3   1.713  10.980   0.716
   24    HG3  ARG   3           1HG      ARG   3   2.006  10.298  -0.872
   25    HD2  ARG   3           2HD      ARG   3   4.168  10.742  -0.684
   26    HD3  ARG   3           1HD      ARG   3   3.816  12.456  -0.471
   27   HH11  ARG   3          1HH1      ARG   3   3.022  13.640   0.880
   28   HH12  ARG   3          2HH1      ARG   3   3.243  14.247   2.486
   29   HH21  ARG   3          1HH2      ARG   3   4.749  11.336   3.699
   30   HH22  ARG   3          2HH2      ARG   3   4.223  12.941   4.085
   31    H    SER   4           H        SER   4  -0.215   9.883  -2.864
   32    HA   SER   4           HA       SER   4  -2.909  11.072  -2.764
   33    HG   SER   4           HG       SER   4  -4.292   8.743  -4.702
   34    HB2  SER   4           2HB      SER   4  -2.897  10.276  -4.927
   35    HB3  SER   4           1HB      SER   4  -1.644   9.076  -4.584
   36    H    THR   5           H        THR   5  -4.612   9.512  -1.973
   37    HA   THR   5           HA       THR   5  -3.534   7.382  -0.315
   38    HB   THR   5           HB       THR   5  -4.537   8.131   1.735
   39    HG1  THR   5           1HG      THR   5  -5.599  10.220   0.156
   40   HG21  THR   5          3HG2      THR   5  -2.326   9.274   0.943
   41   HG22  THR   5          1HG2      THR   5  -3.189   9.869   2.360
   42   HG23  THR   5          2HG2      THR   5  -3.351  10.705   0.819
   43    H    SER   6           H        SER   6  -4.743   5.632  -0.307
   44    HA   SER   6           HA       SER   6  -7.546   5.882  -1.200
   45    HG   SER   6           HG       SER   6  -7.610   3.356  -3.214
   46    HB2  SER   6           2HB      SER   6  -5.967   4.571  -2.684
   47    HB3  SER   6           1HB      SER   6  -5.832   3.397  -1.375
   48    H    HIS   7           H        HIS   7  -9.135   5.223   0.131
   49    HA   HIS   7           HA       HIS   7  -8.351   3.807   2.603
   50    HD1  HIS   7           1HD      HIS   7  -9.877   6.955   5.035
   51    HD2  HIS   7           2HD      HIS   7 -10.252   2.855   4.471
   52    HE1  HIS   7           1HE      HIS   7 -10.135   5.979   7.338
   53    HE2  HIS   7           2HE      HIS   7 -10.445   3.508   6.965
   54    HB2  HIS   7           2HB      HIS   7  -9.345   6.219   2.666
   55    HB3  HIS   7           1HB      HIS   7 -10.878   5.409   2.370
   56    H    VAL   8           H        VAL   8  -9.257   1.871   3.052
   57    HA   VAL   8           HA       VAL   8 -11.733   1.095   1.679
   58    HB   VAL   8           HB       VAL   8  -9.481  -0.881   1.836
   59   HG11  VAL   8          1HG1      VAL   8 -10.670  -2.009   0.089
   60   HG12  VAL   8          2HG1      VAL   8 -11.776  -0.650  -0.102
   61   HG13  VAL   8          3HG1      VAL   8 -11.812  -1.614   1.373
   62   HG21  VAL   8          3HG2      VAL   8  -8.701  -0.322  -0.346
   63   HG22  VAL   8          1HG2      VAL   8  -8.678   1.155   0.616
   64   HG23  VAL   8          2HG2      VAL   8  -9.968   0.886  -0.556
   65    H    ARG   9           H        ARG   9 -12.883  -0.663   2.719
   66    HA   ARG   9           HA       ARG   9 -12.132  -0.907   5.550
   67    HE   ARG   9           HE       ARG   9 -15.491   2.269   6.716
   68    HB2  ARG   9           2HB      ARG   9 -14.736  -0.944   4.128
   69    HB3  ARG   9           1HB      ARG   9 -14.581  -2.022   5.505
   70    HG2  ARG   9           2HG      ARG   9 -15.511   0.011   6.289
   71    HG3  ARG   9           1HG      ARG   9 -13.843  -0.063   6.862
   72    HD2  ARG   9           2HD      ARG   9 -13.150   1.629   5.488
   73    HD3  ARG   9           1HD      ARG   9 -14.379   1.289   4.270
   74   HH11  ARG   9          1HH1      ARG   9 -13.966   3.224   3.726
   75   HH12  ARG   9          2HH1      ARG   9 -14.672   4.805   3.725
   76   HH21  ARG   9          1HH2      ARG   9 -16.422   4.348   6.716
   77   HH22  ARG   9          2HH2      ARG   9 -16.066   5.444   5.422
   78    H    THR  10           H        THR  10 -10.830  -2.608   5.847
   79    HA   THR  10           HA       THR  10 -11.691  -5.211   4.782
   80    HB   THR  10           HB       THR  10  -9.398  -3.807   4.000
   81    HG1  THR  10           1HG      THR  10  -9.891  -5.214   2.538
   82   HG21  THR  10          3HG2      THR  10  -8.538  -4.921   6.251
   83   HG22  THR  10          1HG2      THR  10  -7.539  -4.785   4.801
   84   HG23  THR  10          2HG2      THR  10  -8.357  -6.305   5.166
   85    H    GLU  11           H        GLU  11 -10.953  -7.086   6.032
   86    HA   GLU  11           HA       GLU  11 -10.603  -6.393   8.874
   87    HB2  GLU  11           2HB      GLU  11 -12.333  -8.205   7.533
   88    HB3  GLU  11           1HB      GLU  11 -11.239  -9.151   8.533
   89    HG2  GLU  11           2HG      GLU  11 -12.292  -8.559  10.387
   90    HG3  GLU  11           1HG      GLU  11 -12.222  -6.851   9.956
   91    H    SER  12           H        SER  12  -9.015  -7.409  10.150
   92    HA   SER  12           HA       SER  12  -6.981  -8.288  10.616
   93    HG   SER  12           HG       SER  12  -6.055 -11.207   8.621
   94    HB2  SER  12           2HB      SER  12  -7.945 -10.415  10.210
   95    HB3  SER  12           1HB      SER  12  -7.889 -10.192   8.461
   96    H    ALA  13           H        ALA  13  -7.241  -6.178   8.630
   97    HA   ALA  13           HA       ALA  13  -5.568  -6.366   6.430
   98    HB1  ALA  13           3HB      ALA  13  -5.798  -3.981   8.202
   99    HB2  ALA  13           1HB      ALA  13  -7.006  -4.432   7.013
  100    HB3  ALA  13           2HB      ALA  13  -5.380  -3.991   6.498
  101    H    ALA  14           H        ALA  14  -4.633  -5.388   9.706
  102    HA   ALA  14           HA       ALA  14  -2.065  -4.601   9.382
  103    HB1  ALA  14           3HB      ALA  14  -1.610  -5.530  11.653
  104    HB2  ALA  14           1HB      ALA  14  -3.201  -6.289  11.587
  105    HB3  ALA  14           2HB      ALA  14  -3.057  -4.532  11.512
  106    H    ARG  15           H        ARG  15  -3.086  -7.929   8.961
  107    HA   ARG  15           HA       ARG  15  -0.403  -8.961   9.137
  108    HE   ARG  15           HE       ARG  15  -1.320 -13.210   6.224
  109    HB2  ARG  15           2HB      ARG  15  -2.612 -10.167   9.686
  110    HB3  ARG  15           1HB      ARG  15  -2.749 -10.418   7.952
  111    HG2  ARG  15           2HG      ARG  15  -0.398 -11.274   9.614
  112    HG3  ARG  15           1HG      ARG  15  -1.754 -12.315   9.195
  113    HD2  ARG  15           2HD      ARG  15  -0.751 -11.100   6.817
  114    HD3  ARG  15           1HD      ARG  15   0.597 -11.797   7.703
  115   HH11  ARG  15          1HH1      ARG  15   0.333 -13.380   9.295
  116   HH12  ARG  15          2HH1      ARG  15   0.196 -15.102   9.414
  117   HH21  ARG  15          1HH2      ARG  15  -1.498 -15.474   6.381
  118   HH22  ARG  15          2HH2      ARG  15  -0.841 -16.290   7.760
  119    H    TYR  16           H        TYR  16  -2.639  -8.146   6.545
  120    HA   TYR  16           HA       TYR  16  -1.079  -9.260   4.453
  121    HD1  TYR  16           1HD      TYR  16  -2.694 -10.644   4.703
  122    HD2  TYR  16           2HD      TYR  16  -5.317  -7.543   3.414
  123    HE1  TYR  16           1HE      TYR  16  -4.583 -12.184   4.849
  124    HE2  TYR  16           2HE      TYR  16  -7.213  -9.088   3.570
  125    HH   TYR  16           HH       TYR  16  -6.809 -12.460   3.973
  126    HB2  TYR  16           2HB      TYR  16  -3.083  -7.001   4.294
  127    HB3  TYR  16           1HB      TYR  16  -2.425  -7.877   2.923
  128    H    VAL  17           H        VAL  17  -0.770  -6.356   6.283
  129    HA   VAL  17           HA       VAL  17   0.962  -5.085   4.330
  130    HB   VAL  17           HB       VAL  17   0.082  -4.340   7.108
  131   HG11  VAL  17          1HG1      VAL  17   2.564  -3.522   5.773
  132   HG12  VAL  17          2HG1      VAL  17   2.097  -3.401   7.471
  133   HG13  VAL  17          3HG1      VAL  17   1.549  -2.187   6.316
  134   HG21  VAL  17          3HG2      VAL  17  -0.040  -2.861   4.491
  135   HG22  VAL  17          1HG2      VAL  17  -0.719  -2.329   6.029
  136   HG23  VAL  17          2HG2      VAL  17  -1.369  -3.762   5.222
  137    H    ASN  18           H        ASN  18   1.272  -6.707   7.469
  138    HA   ASN  18           HA       ASN  18   4.081  -6.398   7.655
  139    HB2  ASN  18           2HB      ASN  18   2.354  -8.462   9.028
  140    HB3  ASN  18           1HB      ASN  18   3.946  -7.909   9.537
  141   HD21  ASN  18          1HD2      ASN  18   1.602  -7.868  11.114
  142   HD22  ASN  18          2HD2      ASN  18   1.240  -6.218  11.479
  143    H    ARG  19           H        ARG  19   2.059  -8.857   6.153
  144    HA   ARG  19           HA       ARG  19   4.173 -10.767   5.967
  145    HE   ARG  19           HE       ARG  19   2.620 -11.112   7.488
  146    HB2  ARG  19           2HB      ARG  19   1.471 -10.913   5.792
  147    HB3  ARG  19           1HB      ARG  19   1.920 -11.011   4.093
  148    HG2  ARG  19           2HG      ARG  19   1.920 -13.214   4.693
  149    HG3  ARG  19           1HG      ARG  19   3.612 -12.788   4.925
  150    HD2  ARG  19           2HD      ARG  19   1.503 -13.364   6.945
  151    HD3  ARG  19           1HD      ARG  19   3.167 -13.927   6.867
  152   HH11  ARG  19          1HH1      ARG  19   3.824 -14.237   8.492
  153   HH12  ARG  19          2HH1      ARG  19   4.619 -13.611   9.894
  154   HH21  ARG  19          1HH2      ARG  19   3.664 -10.299   9.332
  155   HH22  ARG  19          2HH2      ARG  19   4.529 -11.380  10.373
  156    H    LEU  20           H        LEU  20   3.307  -8.023   4.101
  157    HA   LEU  20           HA       LEU  20   4.299  -8.933   1.589
  158    HG   LEU  20           HG       LEU  20   1.804  -7.020   2.623
  159    HB2  LEU  20           2HB      LEU  20   3.978  -6.114   2.596
  160    HB3  LEU  20           1HB      LEU  20   4.242  -6.574   0.927
  161   HD11  LEU  20          1HD1      LEU  20   0.698  -5.714   0.961
  162   HD12  LEU  20          2HD1      LEU  20   2.117  -5.751  -0.086
  163   HD13  LEU  20          3HD1      LEU  20   2.165  -4.854   1.431
  164   HD21  LEU  20          3HD2      LEU  20   2.434  -8.267  -0.059
  165   HD22  LEU  20          1HD2      LEU  20   0.828  -8.205   0.665
  166   HD23  LEU  20          2HD2      LEU  20   2.115  -9.109   1.459
  167    H    CYS  21           H        CYS  21   5.738  -6.916   4.151
  168    HA   CYS  21           HA       CYS  21   8.109  -6.265   2.884
  169    HG   CYS  21           HG       CYS  21   7.741  -8.140   6.277
  170    HB2  CYS  21           2HB      CYS  21   9.092  -6.040   5.141
  171    HB3  CYS  21           1HB      CYS  21   7.490  -5.314   5.045
  172    H    LYS  22           H        LYS  22   7.305  -9.192   4.674
  173    HA   LYS  22           HA       LYS  22   9.913 -10.348   4.331
  174    HB2  LYS  22           2HB      LYS  22   7.306 -11.623   5.175
  175    HB3  LYS  22           1HB      LYS  22   8.893 -12.371   5.290
  176    HG2  LYS  22           2HG      LYS  22   9.379 -11.313   7.196
  177    HG3  LYS  22           1HG      LYS  22   8.745  -9.772   6.617
  178    HD2  LYS  22           2HD      LYS  22   7.395 -10.416   8.460
  179    HD3  LYS  22           1HD      LYS  22   6.436 -10.705   7.007
  180    HE2  LYS  22           2HE      LYS  22   6.113 -12.614   8.323
  181    HE3  LYS  22           1HE      LYS  22   7.301 -13.098   7.114
  182    HZ1  LYS  22           3HZ      LYS  22   8.911 -13.317   8.655
  183    HZ2  LYS  22           1HZ      LYS  22   7.607 -13.535   9.710
  184    HZ3  LYS  22           2HZ      LYS  22   8.363 -12.026   9.600
  185    H    HIS  23           H        HIS  23   7.048 -10.117   2.482
  186    HA   HIS  23           HA       HIS  23   7.545 -12.467   0.880
  187    HD1  HIS  23           1HD      HIS  23   6.612 -11.772  -2.081
  188    HD2  HIS  23           2HD      HIS  23   3.629 -13.351   0.344
  189    HE1  HIS  23           1HE      HIS  23   5.435 -13.486  -3.494
  190    HE2  HIS  23           2HE      HIS  23   3.578 -14.364  -2.035
  191    HB2  HIS  23           2HB      HIS  23   5.245 -11.514   1.468
  192    HB3  HIS  23           1HB      HIS  23   5.568 -10.290   0.245
  193    H    TRP  24           H        TRP  24   7.218  -8.987   0.027
  194    HA   TRP  24           HA       TRP  24   8.621  -9.483  -2.454
  195    HD1  TRP  24           HD       TRP  24   5.202  -8.467  -0.916
  196    HE1  TRP  24           1HE      TRP  24   3.345  -8.969  -2.626
  197    HE3  TRP  24           3HE      TRP  24   7.750  -7.399  -5.218
  198    HZ2  TRP  24           2HZ      TRP  24   3.006  -8.919  -5.428
  199    HZ3  TRP  24           3HZ      TRP  24   6.587  -7.653  -7.371
  200    HH2  TRP  24           HH       TRP  24   4.264  -8.398  -7.472
  201    HB2  TRP  24           2HB      TRP  24   7.505  -6.951  -1.242
  202    HB3  TRP  24           1HB      TRP  24   8.246  -7.048  -2.836
  203    H    GLY  25           H        GLY  25   9.581  -8.715   0.727
  204    HA2  GLY  25           2HA      GLY  25  11.759  -6.983   0.158
  205    HA3  GLY  25           1HA      GLY  25  11.551  -7.935   1.615
  206    H    HIS  26           H        HIS  26  12.339  -8.418  -1.822
  207    HA   HIS  26           HA       HIS  26  14.290 -10.456  -0.981
  208    HD1  HIS  26           1HD      HIS  26  13.138 -12.893  -1.105
  209    HD2  HIS  26           2HD      HIS  26  15.092 -12.269  -4.719
  210    HE1  HIS  26           1HE      HIS  26  14.332 -15.049  -1.605
  211    HE2  HIS  26           2HE      HIS  26  15.574 -14.620  -3.755
  212    HB2  HIS  26           2HB      HIS  26  12.262 -10.815  -2.721
  213    HB3  HIS  26           1HB      HIS  26  13.509 -10.265  -3.835
  214    H    LYS  27           H        LYS  27  13.817  -7.480  -2.736
  215    HA   LYS  27           HA       LYS  27  16.711  -7.115  -2.849
  216    HB2  LYS  27           2HB      LYS  27  16.321  -8.203  -4.964
  217    HB3  LYS  27           1HB      LYS  27  14.955  -7.160  -5.315
  218    HG2  LYS  27           2HG      LYS  27  17.458  -5.702  -4.893
  219    HG3  LYS  27           1HG      LYS  27  17.499  -6.827  -6.250
  220    HD2  LYS  27           2HD      LYS  27  15.139  -5.034  -5.946
  221    HD3  LYS  27           1HD      LYS  27  16.649  -4.354  -6.556
  222    HE2  LYS  27           2HE      LYS  27  16.251  -6.775  -7.933
  223    HE3  LYS  27           1HE      LYS  27  14.692  -5.950  -7.917
  224    HZ1  LYS  27           3HZ      LYS  27  16.191  -5.401  -9.828
  225    HZ2  LYS  27           1HZ      LYS  27  17.211  -4.615  -8.728
  226    HZ3  LYS  27           2HZ      LYS  27  15.627  -4.066  -8.956
  227    H    PHE  28           H        PHE  28  14.167  -5.915  -1.630
  228    HA   PHE  28           HA       PHE  28  14.875  -3.155  -2.242
  229    HD1  PHE  28           2HD      PHE  28  13.596  -1.298  -3.898
  230    HD2  PHE  28           1HD      PHE  28  12.305  -5.307  -4.512
  231    HE1  PHE  28           2HE      PHE  28  13.836  -1.000  -6.329
  232    HE2  PHE  28           1HE      PHE  28  12.544  -5.016  -6.942
  233    HZ   PHE  28           HZ       PHE  28  13.310  -2.861  -7.855
  234    HB2  PHE  28           2HB      PHE  28  12.103  -4.313  -2.383
  235    HB3  PHE  28           1HB      PHE  28  12.386  -2.591  -2.146
  236    H    GLU  29           H        GLU  29  14.084  -1.610  -0.629
  237    HA   GLU  29           HA       GLU  29  14.505  -2.695   2.007
  238    HB2  GLU  29           2HB      GLU  29  14.390  -0.396   2.784
  239    HB3  GLU  29           1HB      GLU  29  15.414  -0.494   1.358
  240    HG2  GLU  29           2HG      GLU  29  13.551   0.317  -0.015
  241    HG3  GLU  29           1HG      GLU  29  12.564   0.459   1.437
  242    H    VAL  30           H        VAL  30  12.965  -3.573   3.204
  243    HA   VAL  30           HA       VAL  30  10.236  -2.514   2.950
  244    HB   VAL  30           HB       VAL  30   9.665  -5.045   3.603
  245   HG11  VAL  30          1HG1      VAL  30   8.553  -4.112   1.784
  246   HG12  VAL  30          2HG1      VAL  30   9.441  -5.460   1.080
  247   HG13  VAL  30          3HG1      VAL  30  10.050  -3.817   0.897
  248   HG21  VAL  30          3HG2      VAL  30  12.226  -5.480   3.393
  249   HG22  VAL  30          1HG2      VAL  30  11.885  -5.523   1.660
  250   HG23  VAL  30          2HG2      VAL  30  11.074  -6.652   2.753
  251    H    GLU  31           H        GLU  31   9.706  -1.579   4.821
  252    HA   GLU  31           HA       GLU  31  10.819  -2.579   7.326
  253    HB2  GLU  31           2HB      GLU  31  10.368  -0.034   6.419
  254    HB3  GLU  31           1HB      GLU  31   8.953  -0.305   7.427
  255    HG2  GLU  31           2HG      GLU  31  10.336  -0.785   9.331
  256    HG3  GLU  31           1HG      GLU  31  11.792  -0.697   8.340
  257    H    LEU  32           H        LEU  32   9.398  -2.957   9.181
  258    HA   LEU  32           HA       LEU  32   6.623  -3.586   8.474
  259    HG   LEU  32           HG       LEU  32   5.904  -6.162   8.309
  260    HB2  LEU  32           2HB      LEU  32   8.214  -5.574   8.260
  261    HB3  LEU  32           1HB      LEU  32   8.318  -5.536  10.006
  262   HD11  LEU  32          1HD1      LEU  32   6.329  -7.973  10.433
  263   HD12  LEU  32          2HD1      LEU  32   7.886  -7.706   9.649
  264   HD13  LEU  32          3HD1      LEU  32   6.503  -8.255   8.702
  265   HD21  LEU  32          3HD2      LEU  32   4.965  -4.799   9.980
  266   HD22  LEU  32          1HD2      LEU  32   6.051  -5.424  11.221
  267   HD23  LEU  32          2HD2      LEU  32   4.765  -6.445  10.581
  268    H    THR  33           H        THR  33   5.464  -2.393   9.821
  269    HA   THR  33           HA       THR  33   6.113  -2.536  12.711
  270    HB   THR  33           HB       THR  33   4.980  -0.171  12.721
  271    HG1  THR  33           1HG      THR  33   4.808   0.797  10.871
  272   HG21  THR  33          3HG2      THR  33   7.794  -0.646  11.797
  273   HG22  THR  33          1HG2      THR  33   7.223  -0.319  13.433
  274   HG23  THR  33          2HG2      THR  33   7.165   0.949  12.210
  275    HA   PRO  34           HA       PRO  34   1.903  -3.850  13.024
  276    HB2  PRO  34           2HB      PRO  34   1.242  -3.010  15.514
  277    HB3  PRO  34           1HB      PRO  34   2.319  -4.373  15.207
  278    HG2  PRO  34           2HG      PRO  34   2.987  -1.569  15.975
  279    HG3  PRO  34           1HG      PRO  34   3.736  -3.084  16.504
  280    HD2  PRO  34           2HD      PRO  34   4.800  -1.429  14.590
  281    HD3  PRO  34           1HD      PRO  34   5.120  -3.173  14.680
  282    H    GLU  35           H        GLU  35   2.016  -1.715  11.462
  283    HA   GLU  35           HA       GLU  35  -0.461  -0.378  11.926
  284    HB2  GLU  35           2HB      GLU  35   2.122   1.193  12.043
  285    HB3  GLU  35           1HB      GLU  35   0.535   1.924  11.827
  286    HG2  GLU  35           2HG      GLU  35  -0.092   0.765  14.013
  287    HG3  GLU  35           1HG      GLU  35   1.640   0.510  14.224
  288    H    ARG  36           H        ARG  36   2.532  -0.639  10.052
  289    HA   ARG  36           HA       ARG  36   1.134  -0.774   7.605
  290    HE   ARG  36           HE       ARG  36   4.523   3.822   7.779
  291    HB2  ARG  36           2HB      ARG  36   2.267   1.301   6.630
  292    HB3  ARG  36           1HB      ARG  36   0.878   1.571   7.666
  293    HG2  ARG  36           2HG      ARG  36   2.496   1.946   9.556
  294    HG3  ARG  36           1HG      ARG  36   3.781   1.921   8.346
  295    HD2  ARG  36           2HD      ARG  36   1.864   3.677   7.336
  296    HD3  ARG  36           1HD      ARG  36   1.960   4.043   9.059
  297   HH11  ARG  36          1HH1      ARG  36   1.871   5.963   8.524
  298   HH12  ARG  36          2HH1      ARG  36   2.834   7.398   8.411
  299   HH21  ARG  36          1HH2      ARG  36   5.792   5.708   7.630
  300   HH22  ARG  36          2HH2      ARG  36   5.060   7.254   7.903
  301    H    GLY  37           H        GLY  37   2.631  -0.668   5.718
  302    HA2  GLY  37           2HA      GLY  37   5.248  -1.815   6.461
  303    HA3  GLY  37           1HA      GLY  37   4.330  -2.297   5.034
  304    H    PHE  38           H        PHE  38   7.062  -1.168   5.143
  305    HA   PHE  38           HA       PHE  38   6.548   1.206   3.473
  306    HD1  PHE  38           1HD      PHE  38   7.322   3.542   3.392
  307    HD2  PHE  38           2HD      PHE  38  10.777   1.683   5.068
  308    HE1  PHE  38           1HE      PHE  38   8.752   5.273   2.392
  309    HE2  PHE  38           2HE      PHE  38  12.201   3.408   4.055
  310    HZ   PHE  38           HZ       PHE  38  11.189   5.206   2.713
  311    HB2  PHE  38           2HB      PHE  38   7.403   1.952   5.617
  312    HB3  PHE  38           1HB      PHE  38   8.724   0.797   5.536
  313    H    ILE  39           H        ILE  39   7.150   0.815   1.459
  314    HA   ILE  39           HA       ILE  39   9.580  -0.809   1.028
  315    HB   ILE  39           HB       ILE  39   7.296  -0.990  -0.905
  316   HG12  ILE  39          2HG1      ILE  39   7.614  -2.501   1.683
  317   HG13  ILE  39          1HG1      ILE  39   6.161  -1.788   0.996
  318   HG21  ILE  39          1HG2      ILE  39   8.919  -3.347  -0.545
  319   HG22  ILE  39          2HG2      ILE  39   9.920  -1.933  -0.860
  320   HG23  ILE  39          3HG2      ILE  39   8.645  -2.378  -1.992
  321   HD11  ILE  39          3HD1      ILE  39   7.553  -4.219  -0.099
  322   HD12  ILE  39          1HD1      ILE  39   6.018  -3.542  -0.641
  323   HD13  ILE  39          2HD1      ILE  39   6.152  -4.244   0.970
  324    H    ASP  40           H        ASP  40  11.037   0.616   0.180
  325    HA   ASP  40           HA       ASP  40  10.040   2.619  -1.717
  326    HB2  ASP  40           2HB      ASP  40  11.475   4.047  -0.768
  327    HB3  ASP  40           1HB      ASP  40  12.006   2.797   0.343
  328    H    PHE  41           H        PHE  41  10.502   2.536  -3.810
  329    HA   PHE  41           HA       PHE  41  12.124   0.261  -4.712
  330    HD1  PHE  41           1HD      PHE  41  11.235  -1.482  -6.798
  331    HD2  PHE  41           2HD      PHE  41   8.192   0.673  -4.749
  332    HE1  PHE  41           1HE      PHE  41   9.977  -3.572  -6.479
  333    HE2  PHE  41           2HE      PHE  41   6.928  -1.413  -4.424
  334    HZ   PHE  41           HZ       PHE  41   7.820  -3.539  -5.290
  335    HB2  PHE  41           2HB      PHE  41   9.873   1.832  -5.922
  336    HB3  PHE  41           1HB      PHE  41  10.996   0.993  -6.985
  337    H    GLY  42           H        GLY  42  12.718   3.343  -4.003
  338    HA2  GLY  42           2HA      GLY  42  15.024   4.009  -4.688
  339    HA3  GLY  42           1HA      GLY  42  14.480   3.751  -6.337
  340    H    ASP  43           H        ASP  43  13.152   5.278  -7.329
  341    HA   ASP  43           HA       ASP  43  13.281   7.922  -6.112
  342    HB2  ASP  43           2HB      ASP  43  13.756   7.120  -8.650
  343    HB3  ASP  43           1HB      ASP  43  12.066   7.595  -8.793
  344    H    SER  44           H        SER  44  11.531   6.430  -4.720
  345    HA   SER  44           HA       SER  44   9.243   7.910  -4.547
  346    HG   SER  44           HG       SER  44   6.844   7.143  -5.207
  347    HB2  SER  44           2HB      SER  44   8.515   7.196  -6.733
  348    HB3  SER  44           1HB      SER  44   8.852   5.525  -6.352
  349    H    ASN  45           H        ASN  45   7.316   5.947  -3.801
  350    HA   ASN  45           HA       ASN  45   8.498   3.945  -2.161
  351    HB2  ASN  45           2HB      ASN  45   8.204   6.607  -1.040
  352    HB3  ASN  45           1HB      ASN  45   7.252   5.431  -0.137
  353   HD21  ASN  45          1HD2      ASN  45  10.129   6.910  -0.223
  354   HD22  ASN  45          2HD2      ASN  45  11.115   5.720   0.549
  355    H    CYS  46           H        CYS  46   6.813   2.956  -0.664
  356    HA   CYS  46           HA       CYS  46   4.060   3.531  -1.379
  357    HG   CYS  46           HG       CYS  46   2.634   1.061  -3.232
  358    HB2  CYS  46           2HB      CYS  46   4.886   1.977  -3.146
  359    HB3  CYS  46           1HB      CYS  46   5.218   0.787  -1.894
  360    H    GLU  47           H        GLU  47   3.415   3.844   0.671
  361    HA   GLU  47           HA       GLU  47   4.083   1.825   2.696
  362    HB2  GLU  47           2HB      GLU  47   4.413   4.470   2.860
  363    HB3  GLU  47           1HB      GLU  47   2.741   4.399   3.392
  364    HG2  GLU  47           2HG      GLU  47   3.278   3.218   5.322
  365    HG3  GLU  47           1HG      GLU  47   4.833   2.683   4.683
  366    H    LEU  48           H        LEU  48   2.392   0.967   4.048
  367    HA   LEU  48           HA       LEU  48  -0.326   1.499   3.114
  368    HG   LEU  48           HG       LEU  48   1.589  -1.743   3.945
  369    HB2  LEU  48           2HB      LEU  48  -0.702  -1.068   3.341
  370    HB3  LEU  48           1HB      LEU  48  -0.112  -0.380   1.843
  371   HD11  LEU  48          1HD1      LEU  48   1.386  -3.670   2.821
  372   HD12  LEU  48          2HD1      LEU  48   1.385  -2.876   1.248
  373   HD13  LEU  48          3HD1      LEU  48  -0.099  -2.957   2.196
  374   HD21  LEU  48          3HD2      LEU  48   3.212  -0.511   2.984
  375   HD22  LEU  48          1HD2      LEU  48   2.229  -0.123   1.573
  376   HD23  LEU  48          2HD2      LEU  48   3.069  -1.672   1.667
  377    H    LEU  49           H        LEU  49  -1.659   1.851   4.704
  378    HA   LEU  49           HA       LEU  49  -0.866   1.089   7.427
  379    HG   LEU  49           HG       LEU  49  -2.275   1.878   9.190
  380    HB2  LEU  49           2HB      LEU  49  -1.872   3.394   6.712
  381    HB3  LEU  49           1HB      LEU  49  -3.400   2.535   6.768
  382   HD11  LEU  49          1HD1      LEU  49  -0.595   3.316   9.537
  383   HD12  LEU  49          2HD1      LEU  49  -1.876   4.488   9.845
  384   HD13  LEU  49          3HD1      LEU  49  -1.123   4.403   8.253
  385   HD21  LEU  49          3HD2      LEU  49  -3.887   3.556  10.099
  386   HD22  LEU  49          1HD2      LEU  49  -4.579   2.453   8.908
  387   HD23  LEU  49          2HD2      LEU  49  -4.166   4.104   8.445
  388    H    ALA  50           H        ALA  50  -1.757  -0.568   8.519
  389    HA   ALA  50           HA       ALA  50  -4.228  -1.728   7.461
  390    HB1  ALA  50           3HB      ALA  50  -1.573  -3.040   7.653
  391    HB2  ALA  50           1HB      ALA  50  -2.774  -3.103   6.366
  392    HB3  ALA  50           2HB      ALA  50  -3.034  -3.991   7.855
  393    H    HIS  51           H        HIS  51  -5.612  -1.650   9.065
  394    HA   HIS  51           HA       HIS  51  -4.741  -2.482  11.718
  395    HD1  HIS  51           1HD      HIS  51  -7.721   0.117  13.759
  396    HD2  HIS  51           2HD      HIS  51  -3.813  -1.250  13.377
  397    HE1  HIS  51           1HE      HIS  51  -6.684   0.395  16.032
  398    HE2  HIS  51           2HE      HIS  51  -4.347  -0.514  15.795
  399    HB2  HIS  51           2HB      HIS  51  -5.901  -0.078  11.046
  400    HB3  HIS  51           1HB      HIS  51  -7.296  -1.024  11.547
  401    HA   PRO  52           HA       PRO  52  -7.308  -6.027  11.927
  402    HB2  PRO  52           2HB      PRO  52  -9.021  -4.591  13.912
  403    HB3  PRO  52           1HB      PRO  52  -8.324  -6.215  13.987
  404    HG2  PRO  52           2HG      PRO  52  -7.205  -4.227  15.328
  405    HG3  PRO  52           1HG      PRO  52  -6.200  -5.423  14.496
  406    HD2  PRO  52           2HD      PRO  52  -6.816  -2.608  13.732
  407    HD3  PRO  52           1HD      PRO  52  -5.333  -3.544  13.478
  408    H    ASP  53           H        ASP  53  -8.946  -2.975  11.289
  409    HA   ASP  53           HA       ASP  53 -10.891  -4.506   9.745
  410    HB2  ASP  53           2HB      ASP  53 -11.715  -3.779  12.126
  411    HB3  ASP  53           1HB      ASP  53 -11.931  -2.210  11.356
  412    H    HIS  54           H        HIS  54  -8.677  -2.079   9.613
  413    HA   HIS  54           HA       HIS  54  -9.992  -1.101   7.225
  414    HD1  HIS  54           1HD      HIS  54  -7.273   1.981   8.799
  415    HD2  HIS  54           2HD      HIS  54  -9.986   0.339  11.482
  416    HE1  HIS  54           1HE      HIS  54  -6.369   2.521  11.081
  417    HE2  HIS  54           2HE      HIS  54  -8.119   1.669  12.679
  418    HB2  HIS  54           2HB      HIS  54  -9.504   1.281   7.734
  419    HB3  HIS  54           1HB      HIS  54 -10.721   0.566   8.777
  420    H    VAL  55           H        VAL  55  -8.551   0.024   5.713
  421    HA   VAL  55           HA       VAL  55  -5.714  -0.312   6.286
  422    HB   VAL  55           HB       VAL  55  -6.847  -2.297   4.982
  423   HG11  VAL  55          1HG1      VAL  55  -6.049  -0.716   2.588
  424   HG12  VAL  55          2HG1      VAL  55  -7.677  -0.540   3.242
  425   HG13  VAL  55          3HG1      VAL  55  -7.108  -2.120   2.710
  426   HG21  VAL  55          3HG2      VAL  55  -4.733  -2.809   3.958
  427   HG22  VAL  55          1HG2      VAL  55  -4.456  -2.050   5.524
  428   HG23  VAL  55          2HG2      VAL  55  -4.245  -1.115   4.044
  429    H    LEU  56           H        LEU  56  -4.455   1.213   5.406
  430    HA   LEU  56           HA       LEU  56  -5.713   3.149   3.576
  431    HG   LEU  56           HG       LEU  56  -6.480   4.788   5.471
  432    HB2  LEU  56           2HB      LEU  56  -4.447   3.562   6.134
  433    HB3  LEU  56           1HB      LEU  56  -3.532   4.393   4.900
  434   HD11  LEU  56          1HD1      LEU  56  -4.760   5.574   7.195
  435   HD12  LEU  56          2HD1      LEU  56  -5.940   6.744   6.606
  436   HD13  LEU  56          3HD1      LEU  56  -4.290   6.768   5.984
  437   HD21  LEU  56          3HD2      LEU  56  -4.626   5.897   3.407
  438   HD22  LEU  56          1HD2      LEU  56  -5.884   6.932   4.077
  439   HD23  LEU  56          2HD2      LEU  56  -6.323   5.431   3.265
  440    H    MET  57           H        MET  57  -4.450   3.970   1.903
  441    HA   MET  57           HA       MET  57  -1.872   2.623   1.485
  442    HB2  MET  57           2HB      MET  57  -3.788   3.170  -0.761
  443    HB3  MET  57           1HB      MET  57  -2.394   2.095  -0.742
  444    HG2  MET  57           2HG      MET  57  -3.547   0.635   0.864
  445    HG3  MET  57           1HG      MET  57  -4.953   1.699   0.789
  446    HE1  MET  57           3HE      MET  57  -7.038  -0.141  -1.410
  447    HE2  MET  57           1HE      MET  57  -6.746   1.577  -1.676
  448    HE3  MET  57           2HE      MET  57  -6.743   0.926  -0.038
  449    H    ILE  58           H        ILE  58  -0.301   4.130   1.478
  450    HA   ILE  58           HA       ILE  58  -0.848   6.672   0.105
  451    HB   ILE  58           HB       ILE  58   0.937   6.302   2.516
  452   HG12  ILE  58          2HG1      ILE  58  -1.916   6.602   2.378
  453   HG13  ILE  58          1HG1      ILE  58  -0.896   6.440   3.795
  454   HG21  ILE  58          1HG2      ILE  58   1.663   8.081   1.046
  455   HG22  ILE  58          2HG2      ILE  58   1.008   8.751   2.539
  456   HG23  ILE  58          3HG2      ILE  58   0.043   8.783   1.062
  457   HD11  ILE  58          3HD1      ILE  58  -2.423   8.506   3.555
  458   HD12  ILE  58          1HD1      ILE  58  -1.176   9.097   2.456
  459   HD13  ILE  58          2HD1      ILE  58  -0.770   8.718   4.130
  460    H    LEU  59           H        LEU  59   0.725   7.409  -1.281
  461    HA   LEU  59           HA       LEU  59   3.127   5.721  -1.526
  462    HG   LEU  59           HG       LEU  59   1.315   7.122  -5.141
  463    HB2  LEU  59           2HB      LEU  59   3.113   6.210  -3.937
  464    HB3  LEU  59           1HB      LEU  59   1.689   5.341  -3.415
  465   HD11  LEU  59          1HD1      LEU  59  -0.330   7.966  -2.859
  466   HD12  LEU  59          2HD1      LEU  59  -0.266   6.225  -3.134
  467   HD13  LEU  59          3HD1      LEU  59  -0.803   7.304  -4.423
  468   HD21  LEU  59          3HD2      LEU  59   1.376   9.392  -4.608
  469   HD22  LEU  59          1HD2      LEU  59   2.894   8.753  -3.979
  470   HD23  LEU  59          2HD2      LEU  59   1.549   9.081  -2.885
  471    H    ASN  60           H        ASN  60   5.002   6.799  -2.481
  472    HA   ASN  60           HA       ASN  60   5.040   9.712  -2.112
  473    HB2  ASN  60           2HB      ASN  60   6.395   7.827  -0.425
  474    HB3  ASN  60           1HB      ASN  60   7.603   8.680  -1.382
  475   HD21  ASN  60          1HD2      ASN  60   6.691   8.732   1.517
  476   HD22  ASN  60          2HD2      ASN  60   6.502  10.415   1.856
  477    H    SER  61           H        SER  61   5.225  10.236  -4.237
  478    HA   SER  61           HA       SER  61   7.601   9.137  -5.621
  479    HG   SER  61           HG       SER  61   4.393   8.252  -5.382
  480    HB2  SER  61           2HB      SER  61   5.141   9.333  -7.254
  481    HB3  SER  61           1HB      SER  61   6.456   8.164  -7.328
  482    HA   PRO  62           HA       PRO  62   7.958  13.357  -7.066
  483    HB2  PRO  62           2HB      PRO  62  10.011  13.042  -8.715
  484    HB3  PRO  62           1HB      PRO  62  10.186  12.855  -6.966
  485    HG2  PRO  62           2HG      PRO  62   9.868  10.727  -9.053
  486    HG3  PRO  62           1HG      PRO  62  11.041  10.816  -7.724
  487    HD2  PRO  62           2HD      PRO  62   8.750   9.373  -7.581
  488    HD3  PRO  62           1HD      PRO  62   9.510  10.113  -6.162
  489    H    ASP  63           H        ASP  63   6.777  10.771  -8.902
  490    HA   ASP  63           HA       ASP  63   5.860  12.651 -10.921
  491    HB2  ASP  63           2HB      ASP  63   7.794  11.875 -12.050
  492    HB3  ASP  63           1HB      ASP  63   7.527  10.214 -11.540
  493    H    GLU  64           H        GLU  64   3.870  11.994 -11.914
  494    HA   GLU  64           HA       GLU  64   2.217  10.405 -10.250
  495    HB2  GLU  64           2HB      GLU  64   1.819  11.578 -12.975
  496    HB3  GLU  64           1HB      GLU  64   0.746  10.287 -12.466
  497    HG2  GLU  64           2HG      GLU  64  -0.428  12.046 -11.675
  498    HG3  GLU  64           1HG      GLU  64   0.593  11.734 -10.267
  499    H    ASP  65           H        ASP  65   3.952   9.461 -13.241
  500    HA   ASP  65           HA       ASP  65   2.861   6.958 -13.657
  501    HB2  ASP  65           2HB      ASP  65   4.733   8.088 -14.964
  502    HB3  ASP  65           1HB      ASP  65   5.830   7.499 -13.717
  503    H    SER  66           H        SER  66   5.604   7.786 -11.581
  504    HA   SER  66           HA       SER  66   5.877   5.292 -10.303
  505    HG   SER  66           HG       SER  66   7.756   7.083 -11.208
  506    HB2  SER  66           2HB      SER  66   6.598   8.093  -9.432
  507    HB3  SER  66           1HB      SER  66   7.025   6.657  -8.500
  508    H    LEU  67           H        LEU  67   4.418   8.287  -9.227
  509    HA   LEU  67           HA       LEU  67   3.245   7.742  -6.868
  510    HG   LEU  67           HG       LEU  67   1.154   9.547  -6.475
  511    HB2  LEU  67           2HB      LEU  67   3.157   9.897  -7.854
  512    HB3  LEU  67           1HB      LEU  67   2.282   9.311  -9.237
  513   HD11  LEU  67          1HD1      LEU  67   1.028  11.703  -6.898
  514   HD12  LEU  67          2HD1      LEU  67  -0.161  11.299  -8.137
  515   HD13  LEU  67          3HD1      LEU  67   1.540  11.474  -8.569
  516   HD21  LEU  67          3HD2      LEU  67   0.041   8.583  -9.056
  517   HD22  LEU  67          1HD2      LEU  67  -1.011   9.440  -7.932
  518   HD23  LEU  67          2HD2      LEU  67  -0.205   7.957  -7.425
  519    H    ALA  68           H        ALA  68   1.498   7.256  -9.951
  520    HA   ALA  68           HA       ALA  68  -0.629   5.846  -8.709
  521    HB1  ALA  68           3HB      ALA  68  -1.245   6.762 -10.740
  522    HB2  ALA  68           1HB      ALA  68  -0.999   5.072 -11.181
  523    HB3  ALA  68           2HB      ALA  68   0.248   6.267 -11.540
  524    H    HIS  69           H        HIS  69   2.396   4.852 -10.221
  525    HA   HIS  69           HA       HIS  69   1.963   2.127 -10.480
  526    HD1  HIS  69           1HD      HIS  69   6.500   2.087 -11.240
  527    HD2  HIS  69           2HD      HIS  69   3.108   0.010 -10.033
  528    HE1  HIS  69           1HE      HIS  69   7.078  -0.348 -11.488
  529    HE2  HIS  69           2HE      HIS  69   5.035  -1.586 -10.685
  530    HB2  HIS  69           2HB      HIS  69   4.003   3.415 -11.229
  531    HB3  HIS  69           1HB      HIS  69   4.560   3.369  -9.560
  532    H    MET  70           H        MET  70   2.809   4.039  -7.654
  533    HA   MET  70           HA       MET  70   3.129   1.730  -5.954
  534    HB2  MET  70           2HB      MET  70   2.662   4.381  -4.721
  535    HB3  MET  70           1HB      MET  70   3.869   3.170  -4.337
  536    HG2  MET  70           2HG      MET  70   3.937   5.217  -6.524
  537    HG3  MET  70           1HG      MET  70   5.011   5.066  -5.139
  538    HE1  MET  70           3HE      MET  70   7.451   2.332  -6.009
  539    HE2  MET  70           1HE      MET  70   6.342   2.797  -4.718
  540    HE3  MET  70           2HE      MET  70   7.411   4.000  -5.439
  541    H    GLN  71           H        GLN  71   0.729   4.417  -5.960
  542    HA   GLN  71           HA       GLN  71  -0.958   3.328  -4.065
  543    HB2  GLN  71           2HB      GLN  71  -2.815   4.613  -5.429
  544    HB3  GLN  71           1HB      GLN  71  -1.632   5.465  -4.458
  545    HG2  GLN  71           2HG      GLN  71  -0.830   6.524  -6.239
  546    HG3  GLN  71           1HG      GLN  71  -0.749   5.039  -7.188
  547   HE21  GLN  71          1HE2      GLN  71  -2.394   4.529  -8.566
  548   HE22  GLN  71          2HE2      GLN  71  -3.703   5.598  -8.923
  549    H    ASN  72           H        ASN  72  -0.660   2.477  -7.431
  550    HA   ASN  72           HA       ASN  72  -3.132   0.992  -7.471
  551    HB2  ASN  72           2HB      ASN  72  -1.756   2.102  -9.456
  552    HB3  ASN  72           1HB      ASN  72  -1.014   0.506  -9.508
  553   HD21  ASN  72          1HD2      ASN  72  -4.181   2.081  -9.398
  554   HD22  ASN  72          2HD2      ASN  72  -4.976   0.943 -10.427
  555    H    VAL  73           H        VAL  73   0.326   0.202  -7.323
  556    HA   VAL  73           HA       VAL  73   0.276  -2.528  -7.470
  557    HB   VAL  73           HB       VAL  73   1.999  -0.651  -5.887
  558   HG11  VAL  73          1HG1      VAL  73   2.194  -3.660  -5.847
  559   HG12  VAL  73          2HG1      VAL  73   1.949  -2.586  -4.469
  560   HG13  VAL  73          3HG1      VAL  73   3.483  -2.569  -5.338
  561   HG21  VAL  73          3HG2      VAL  73   3.102  -2.559  -7.844
  562   HG22  VAL  73          1HG2      VAL  73   3.457  -0.849  -7.597
  563   HG23  VAL  73          2HG2      VAL  73   2.013  -1.330  -8.488
  564    H    VAL  74           H        VAL  74  -0.453  -0.530  -4.636
  565    HA   VAL  74           HA       VAL  74  -0.820  -2.745  -2.873
  566    HB   VAL  74           HB       VAL  74  -1.831   0.086  -2.607
  567   HG11  VAL  74          1HG1      VAL  74  -3.025  -1.659  -1.222
  568   HG12  VAL  74          2HG1      VAL  74  -2.275  -0.343  -0.322
  569   HG13  VAL  74          3HG1      VAL  74  -1.492  -1.920  -0.391
  570   HG21  VAL  74          3HG2      VAL  74   0.215  -0.383  -0.769
  571   HG22  VAL  74          1HG2      VAL  74   0.296   0.615  -2.218
  572   HG23  VAL  74          2HG2      VAL  74   0.789  -1.079  -2.282
  573    H    ALA  75           H        ALA  75  -3.099  -0.651  -4.677
  574    HA   ALA  75           HA       ALA  75  -5.503  -1.628  -3.784
  575    HB1  ALA  75           3HB      ALA  75  -4.741  -0.834  -6.594
  576    HB2  ALA  75           1HB      ALA  75  -5.440   0.198  -5.345
  577    HB3  ALA  75           2HB      ALA  75  -6.396  -1.105  -6.050
  578    H    ASP  76           H        ASP  76  -3.134  -3.138  -5.797
  579    HA   ASP  76           HA       ASP  76  -4.822  -5.269  -6.724
  580    HB2  ASP  76           2HB      ASP  76  -2.457  -4.278  -7.588
  581    HB3  ASP  76           1HB      ASP  76  -1.890  -5.675  -6.677
  582    H    HIS  77           H        HIS  77  -2.387  -4.896  -4.169
  583    HA   HIS  77           HA       HIS  77  -2.303  -7.557  -3.323
  584    HD1  HIS  77           1HD      HIS  77  -0.718  -6.392  -4.664
  585    HD2  HIS  77           2HD      HIS  77   0.975  -4.672  -1.281
  586    HE1  HIS  77           1HE      HIS  77   1.558  -5.600  -5.380
  587    HE2  HIS  77           2HE      HIS  77   2.601  -4.653  -3.291
  588    HB2  HIS  77           2HB      HIS  77  -1.974  -5.125  -1.553
  589    HB3  HIS  77           1HB      HIS  77  -1.348  -6.737  -1.257
  590    H    LEU  78           H        LEU  78  -4.492  -4.933  -2.353
  591    HA   LEU  78           HA       LEU  78  -5.840  -6.395  -0.346
  592    HG   LEU  78           HG       LEU  78  -5.014  -3.209  -0.607
  593    HB2  LEU  78           2HB      LEU  78  -6.716  -4.040  -2.025
  594    HB3  LEU  78           1HB      LEU  78  -7.641  -4.678  -0.683
  595   HD11  LEU  78          1HD1      LEU  78  -6.185  -1.705   0.829
  596   HD12  LEU  78          2HD1      LEU  78  -7.586  -2.773   0.893
  597   HD13  LEU  78          3HD1      LEU  78  -7.163  -1.962  -0.615
  598   HD21  LEU  78          3HD2      LEU  78  -6.285  -4.836   1.596
  599   HD22  LEU  78          1HD2      LEU  78  -4.994  -3.659   1.835
  600   HD23  LEU  78          2HD2      LEU  78  -4.704  -5.101   0.863
  601    H    GLN  79           H        GLN  79  -6.051  -6.303  -3.806
  602    HA   GLN  79           HA       GLN  79  -8.662  -7.434  -4.007
  603    HB2  GLN  79           2HB      GLN  79  -7.717  -6.113  -5.826
  604    HB3  GLN  79           1HB      GLN  79  -6.432  -7.292  -6.041
  605    HG2  GLN  79           2HG      GLN  79  -7.763  -8.755  -7.135
  606    HG3  GLN  79           1HG      GLN  79  -9.203  -8.299  -6.224
  607   HE21  GLN  79          1HE2      GLN  79  -9.057  -8.680  -9.030
  608   HE22  GLN  79          2HE2      GLN  79  -9.426  -7.171  -9.785
  609    H    ARG  80           H        ARG  80  -5.387  -8.820  -4.096
  610    HA   ARG  80           HA       ARG  80  -6.156 -11.430  -4.815
  611    HE   ARG  80           HE       ARG  80  -1.550 -12.790  -4.625
  612    HB2  ARG  80           2HB      ARG  80  -3.795 -10.570  -3.128
  613    HB3  ARG  80           1HB      ARG  80  -3.973 -12.120  -3.939
  614    HG2  ARG  80           2HG      ARG  80  -4.329 -10.227  -5.937
  615    HG3  ARG  80           1HG      ARG  80  -2.998  -9.609  -4.959
  616    HD2  ARG  80           2HD      ARG  80  -3.177 -12.371  -6.162
  617    HD3  ARG  80           1HD      ARG  80  -2.195 -11.041  -6.776
  618   HH11  ARG  80          1HH1      ARG  80  -1.161  -9.514  -5.764
  619   HH12  ARG  80          2HH1      ARG  80   0.314  -9.255  -4.895
  620   HH21  ARG  80          1HH2      ARG  80   0.391 -12.450  -3.482
  621   HH22  ARG  80          2HH2      ARG  80   1.196 -10.921  -3.600
  622    H    MET  81           H        MET  81  -5.922  -9.761  -1.761
  623    HA   MET  81           HA       MET  81  -6.522 -12.124  -0.210
  624    HB2  MET  81           2HB      MET  81  -6.517 -10.609   1.719
  625    HB3  MET  81           1HB      MET  81  -5.077 -10.440   0.735
  626    HG2  MET  81           2HG      MET  81  -5.658  -8.266   1.330
  627    HG3  MET  81           1HG      MET  81  -6.204  -8.437  -0.333
  628    HE1  MET  81           3HE      MET  81  -8.013  -7.000   3.202
  629    HE2  MET  81           1HE      MET  81  -8.152  -5.967   1.780
  630    HE3  MET  81           2HE      MET  81  -6.593  -6.671   2.211
  631    H    ALA  82           H        ALA  82  -8.366  -9.916  -1.967
  632    HA   ALA  82           HA       ALA  82 -10.811 -10.879  -0.646
  633    HB1  ALA  82           3HB      ALA  82 -10.019  -8.022  -1.053
  634    HB2  ALA  82           1HB      ALA  82 -10.740  -8.795   0.359
  635    HB3  ALA  82           2HB      ALA  82 -11.721  -8.481  -1.073
  636    H    ASN  83           H        ASN  83 -10.878 -12.273  -2.508
  637    HA   ASN  83           HA       ASN  83 -10.956 -11.334  -5.163
  638    HB2  ASN  83           2HB      ASN  83 -10.995 -13.815  -3.906
  639    HB3  ASN  83           1HB      ASN  83 -12.554 -13.729  -4.718
  640   HD21  ASN  83          1HD2      ASN  83 -12.523 -14.613  -6.640
  641   HD22  ASN  83          2HD2      ASN  83 -11.201 -14.607  -7.751
  642    H    SER  84           H        SER  84 -13.315 -12.530  -6.182
  643    HA   SER  84           HA       SER  84 -15.549 -12.201  -6.527
  644    HG   SER  84           HG       SER  84 -17.133 -12.771  -4.041
  645    HB2  SER  84           2HB      SER  84 -15.339 -11.736  -3.785
  646    HB3  SER  84           1HB      SER  84 -16.156 -10.303  -4.407
  647    H    GLU  85           H        GLU  85 -14.671  -9.112  -4.986
  648    HA   GLU  85           HA       GLU  85 -15.306  -7.784  -7.536
  649    HB2  GLU  85           2HB      GLU  85 -15.864  -5.810  -6.251
  650    HB3  GLU  85           1HB      GLU  85 -16.753  -7.187  -5.617
  651    HG2  GLU  85           2HG      GLU  85 -14.862  -7.382  -3.904
  652    HG3  GLU  85           1HG      GLU  85 -14.413  -5.756  -4.416
  653    H    SER  86           H        SER  86 -13.984  -6.068  -8.270
  654    HA   SER  86           HA       SER  86 -11.198  -6.444  -7.714
  655    HG   SER  86           HG       SER  86 -11.191  -6.429 -10.565
  656    HB2  SER  86           2HB      SER  86 -12.568  -4.335  -9.402
  657    HB3  SER  86           1HB      SER  86 -10.842  -4.692  -9.403
  658    H    LEU  87           H        LEU  87 -11.528  -5.956  -5.394
  659    HA   LEU  87           HA       LEU  87 -11.716  -4.528  -3.570
  660    HG   LEU  87           HG       LEU  87  -8.245  -4.676  -2.933
  661    HB2  LEU  87           2HB      LEU  87  -9.218  -4.412  -4.947
  662    HB3  LEU  87           1HB      LEU  87  -9.560  -2.824  -4.281
  663   HD11  LEU  87          1HD1      LEU  87 -10.168  -2.594  -1.972
  664   HD12  LEU  87          2HD1      LEU  87  -8.405  -2.539  -2.038
  665   HD13  LEU  87          3HD1      LEU  87  -9.212  -3.541  -0.831
  666   HD21  LEU  87          3HD2      LEU  87  -9.573  -5.893  -1.380
  667   HD22  LEU  87          1HD2      LEU  87 -10.181  -6.263  -2.991
  668   HD23  LEU  87          2HD2      LEU  87 -11.055  -5.134  -1.955
  669    H    GLU  88           H        GLU  88 -13.327  -3.119  -3.302
  670    HA   GLU  88           HA       GLU  88 -13.695  -0.859  -5.025
  671    HB2  GLU  88           2HB      GLU  88 -15.555  -1.942  -3.744
  672    HB3  GLU  88           1HB      GLU  88 -14.824  -1.353  -2.257
  673    HG2  GLU  88           2HG      GLU  88 -15.148   0.831  -4.064
  674    HG3  GLU  88           1HG      GLU  88 -16.671  -0.048  -3.935
  675    H    ILE  89           H        ILE  89 -11.894   0.439  -5.034
  676    HA   ILE  89           HA       ILE  89 -11.201   1.655  -2.459
  677    HB   ILE  89           HB       ILE  89  -8.879   1.516  -2.802
  678   HG12  ILE  89          2HG1      ILE  89  -9.130   2.040  -5.363
  679   HG13  ILE  89          1HG1      ILE  89  -7.738   1.144  -4.786
  680   HG21  ILE  89          1HG2      ILE  89  -8.466  -0.905  -3.309
  681   HG22  ILE  89          2HG2      ILE  89 -10.186  -1.036  -3.670
  682   HG23  ILE  89          3HG2      ILE  89  -9.658  -0.573  -2.054
  683   HD11  ILE  89          3HD1      ILE  89  -8.669   0.185  -6.823
  684   HD12  ILE  89          1HD1      ILE  89 -10.205  -0.076  -5.998
  685   HD13  ILE  89          2HD1      ILE  89  -8.761  -0.940  -5.466
  686    H    ALA  90           H        ALA  90 -11.194   3.881  -2.483
  687    HA   ALA  90           HA       ALA  90 -11.413   5.136  -5.129
  688    HB1  ALA  90           3HB      ALA  90 -11.862   6.535  -2.499
  689    HB2  ALA  90           1HB      ALA  90 -13.134   5.605  -3.298
  690    HB3  ALA  90           2HB      ALA  90 -12.420   7.002  -4.104
  691    H    TRP  91           H        TRP  91  -9.541   5.708  -5.947
  692    HA   TRP  91           HA       TRP  91  -7.351   6.503  -4.195
  693    HD1  TRP  91           HD       TRP  91  -8.481   3.847  -7.526
  694    HE1  TRP  91           1HE      TRP  91  -9.257   4.465  -9.902
  695    HE3  TRP  91           3HE      TRP  91  -6.452   8.530  -7.852
  696    HZ2  TRP  91           2HZ      TRP  91  -9.038   6.649 -11.677
  697    HZ3  TRP  91           3HZ      TRP  91  -6.782   9.817  -9.923
  698    HH2  TRP  91           HH       TRP  91  -8.048   8.894 -11.796
  699    HB2  TRP  91           2HB      TRP  91  -6.001   6.427  -6.313
  700    HB3  TRP  91           1HB      TRP  91  -6.744   4.895  -5.862
  701    H    GLN  92           H        GLN  92  -6.624   8.517  -3.987
  702    HA   GLN  92           HA       GLN  92  -8.066  10.637  -5.371
  703    HB2  GLN  92           2HB      GLN  92  -6.169  10.621  -3.028
  704    HB3  GLN  92           1HB      GLN  92  -6.634  12.116  -3.823
  705    HG2  GLN  92           2HG      GLN  92  -8.255  12.122  -2.278
  706    HG3  GLN  92           1HG      GLN  92  -9.061  11.047  -3.418
  707   HE21  GLN  92          1HE2      GLN  92  -9.247   8.878  -2.946
  708   HE22  GLN  92          2HE2      GLN  92  -8.911   8.230  -1.380
  709    HA   PRO  93           HA       PRO  93  -5.211  11.781  -8.495
  710    HB2  PRO  93           2HB      PRO  93  -5.066  14.431  -7.147
  711    HB3  PRO  93           1HB      PRO  93  -5.355  14.055  -8.849
  712    HG2  PRO  93           2HG      PRO  93  -7.368  14.775  -7.258
  713    HG3  PRO  93           1HG      PRO  93  -7.583  13.517  -8.489
  714    HD2  PRO  93           2HD      PRO  93  -7.346  13.257  -5.538
  715    HD3  PRO  93           1HD      PRO  93  -8.234  12.247  -6.695
  716    H    ALA  94           H        ALA  94  -4.379  12.901  -5.231
  717    HA   ALA  94           HA       ALA  94  -2.397  12.323  -4.096
  718    HB1  ALA  94           3HB      ALA  94  -0.476  11.526  -5.120
  719    HB2  ALA  94           1HB      ALA  94  -0.821  12.366  -6.629
  720    HB3  ALA  94           2HB      ALA  94  -1.742  10.929  -6.195
  721    H    GLU  95           H        GLU  95  -3.611  14.850  -4.953
  722    HA   GLU  95           HA       GLU  95  -1.566  16.603  -4.072
  723    HB2  GLU  95           2HB      GLU  95  -1.170  16.097  -6.652
  724    HB3  GLU  95           1HB      GLU  95  -2.409  17.332  -6.836
  725    HG2  GLU  95           2HG      GLU  95  -1.080  18.986  -5.917
  726    HG3  GLU  95           1HG      GLU  95  -0.034  17.830  -5.096
  727    H    SER  96           H        SER  96  -2.321  18.976  -4.352
  728    HA   SER  96           HA       SER  96  -5.053  19.076  -3.417
  729    HG   SER  96           HG       SER  96  -2.709  21.799  -4.494
  730    HB2  SER  96           2HB      SER  96  -4.480  21.586  -3.226
  731    HB3  SER  96           1HB      SER  96  -3.609  20.464  -2.181
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1   6.969  13.250  -5.152
    2    HB2  MET   1           2HB      MET   1   7.625  13.561  -2.846
    3    HB3  MET   1           1HB      MET   1   8.917  14.099  -3.912
    4    HG2  MET   1           2HG      MET   1   7.103  16.249  -3.197
    5    HG3  MET   1           1HG      MET   1   7.841  15.491  -1.790
    6    HE1  MET   1           3HE      MET   1   9.260  18.863  -3.815
    7    HE2  MET   1           1HE      MET   1   9.190  18.684  -2.062
    8    HE3  MET   1           2HE      MET   1   7.785  18.276  -3.047
    9    H    PHE   2           H        PHE   2   4.866  13.257  -5.657
   10    HA   PHE   2           HA       PHE   2   3.051  15.050  -4.206
   11    HD1  PHE   2           2HD      PHE   2   3.481  16.484  -6.646
   12    HD2  PHE   2           1HD      PHE   2   3.020  12.508  -8.095
   13    HE1  PHE   2           2HE      PHE   2   4.783  17.067  -8.650
   14    HE2  PHE   2           1HE      PHE   2   4.312  13.088 -10.101
   15    HZ   PHE   2           HZ       PHE   2   5.200  15.367 -10.383
   16    HB2  PHE   2           2HB      PHE   2   1.934  13.128  -6.166
   17    HB3  PHE   2           1HB      PHE   2   1.561  14.831  -5.929
   18    H    ARG   3           H        ARG   3   0.903  13.863  -3.473
   19    HA   ARG   3           HA       ARG   3   1.457  11.130  -2.666
   20    HE   ARG   3           HE       ARG   3   3.591  10.804   1.822
   21    HB2  ARG   3           2HB      ARG   3   2.005  13.220  -0.869
   22    HB3  ARG   3           1HB      ARG   3   0.500  12.495  -0.313
   23    HG2  ARG   3           2HG      ARG   3   1.780  10.994   0.699
   24    HG3  ARG   3           1HG      ARG   3   2.053  10.315  -0.890
   25    HD2  ARG   3           2HD      ARG   3   4.208  10.856  -0.807
   26    HD3  ARG   3           1HD      ARG   3   3.814  12.538  -0.458
   27   HH11  ARG   3          1HH1      ARG   3   5.767  12.766  -0.077
   28   HH12  ARG   3          2HH1      ARG   3   6.887  13.001   1.222
   29   HH21  ARG   3          1HH2      ARG   3   5.065  11.113   3.531
   30   HH22  ARG   3          2HH2      ARG   3   6.489  12.063   3.270
   31    H    SER   4           H        SER   4  -0.269   9.918  -2.832
   32    HA   SER   4           HA       SER   4  -2.952  11.122  -2.704
   33    HG   SER   4           HG       SER   4  -4.506   9.001  -4.229
   34    HB2  SER   4           2HB      SER   4  -2.959  10.334  -4.876
   35    HB3  SER   4           1HB      SER   4  -1.731   9.109  -4.542
   36    H    THR   5           H        THR   5  -4.657   9.500  -1.947
   37    HA   THR   5           HA       THR   5  -3.541   7.395  -0.290
   38    HB   THR   5           HB       THR   5  -4.569   8.105   1.760
   39    HG1  THR   5           1HG      THR   5  -5.522  10.390   0.389
   40   HG21  THR   5          3HG2      THR   5  -2.378   9.289   0.992
   41   HG22  THR   5          1HG2      THR   5  -3.262   9.867   2.400
   42   HG23  THR   5          2HG2      THR   5  -3.424  10.703   0.859
   43    H    SER   6           H        SER   6  -4.680   5.609  -0.374
   44    HA   SER   6           HA       SER   6  -7.490   5.783  -1.258
   45    HG   SER   6           HG       SER   6  -8.042   3.156  -1.470
   46    HB2  SER   6           2HB      SER   6  -5.915   4.516  -2.742
   47    HB3  SER   6           1HB      SER   6  -5.648   3.384  -1.416
   48    H    HIS   7           H        HIS   7  -9.070   5.113   0.083
   49    HA   HIS   7           HA       HIS   7  -8.269   3.691   2.546
   50    HD1  HIS   7           1HD      HIS   7  -9.873   6.829   5.011
   51    HD2  HIS   7           2HD      HIS   7 -10.101   2.723   4.412
   52    HE1  HIS   7           1HE      HIS   7 -10.131   5.828   7.303
   53    HE2  HIS   7           2HE      HIS   7 -10.358   3.351   6.907
   54    HB2  HIS   7           2HB      HIS   7  -9.238   6.106   2.644
   55    HB3  HIS   7           1HB      HIS   7 -10.782   5.323   2.332
   56    H    VAL   8           H        VAL   8  -9.169   1.748   2.967
   57    HA   VAL   8           HA       VAL   8 -11.674   1.008   1.627
   58    HB   VAL   8           HB       VAL   8  -9.433  -0.986   1.712
   59   HG11  VAL   8          1HG1      VAL   8 -11.780  -1.689   1.276
   60   HG12  VAL   8          2HG1      VAL   8 -10.660  -2.078  -0.029
   61   HG13  VAL   8          3HG1      VAL   8 -11.755  -0.706  -0.189
   62   HG21  VAL   8          3HG2      VAL   8  -8.707  -0.399  -0.491
   63   HG22  VAL   8          1HG2      VAL   8  -8.614   1.044   0.518
   64   HG23  VAL   8          2HG2      VAL   8  -9.945   0.849  -0.623
   65    H    ARG   9           H        ARG   9 -12.817  -0.755   2.665
   66    HA   ARG   9           HA       ARG   9 -12.023  -1.027   5.477
   67    HE   ARG   9           HE       ARG   9 -15.285   0.722   3.638
   68    HB2  ARG   9           2HB      ARG   9 -14.650  -1.112   4.088
   69    HB3  ARG   9           1HB      ARG   9 -14.452  -2.130   5.507
   70    HG2  ARG   9           2HG      ARG   9 -15.402  -0.031   6.166
   71    HG3  ARG   9           1HG      ARG   9 -13.757  -0.147   6.797
   72    HD2  ARG   9           2HD      ARG   9 -14.149   2.070   5.907
   73    HD3  ARG   9           1HD      ARG   9 -12.959   1.223   4.920
   74   HH11  ARG   9          1HH1      ARG   9 -13.767   3.660   4.754
   75   HH12  ARG   9          2HH1      ARG   9 -14.458   4.639   3.504
   76   HH21  ARG   9          1HH2      ARG   9 -16.194   2.009   1.993
   77   HH22  ARG   9          2HH2      ARG   9 -15.835   3.702   1.936
   78    H    THR  10           H        THR  10 -10.717  -2.724   5.762
   79    HA   THR  10           HA       THR  10 -11.576  -5.325   4.692
   80    HB   THR  10           HB       THR  10  -9.297  -3.918   3.895
   81    HG1  THR  10           1HG      THR  10 -10.119  -5.385   2.544
   82   HG21  THR  10          3HG2      THR  10  -8.228  -6.387   5.108
   83   HG22  THR  10          1HG2      THR  10  -8.411  -4.976   6.157
   84   HG23  THR  10          2HG2      THR  10  -7.420  -4.873   4.695
   85    H    GLU  11           H        GLU  11 -10.837  -7.201   5.938
   86    HA   GLU  11           HA       GLU  11 -10.489  -6.509   8.779
   87    HB2  GLU  11           2HB      GLU  11 -12.206  -8.332   7.433
   88    HB3  GLU  11           1HB      GLU  11 -11.109  -9.271   8.437
   89    HG2  GLU  11           2HG      GLU  11 -12.164  -8.679  10.291
   90    HG3  GLU  11           1HG      GLU  11 -12.114  -6.973   9.853
   91    H    SER  12           H        SER  12  -8.898  -7.503  10.054
   92    HA   SER  12           HA       SER  12  -6.864  -8.377  10.531
   93    HG   SER  12           HG       SER  12  -5.593 -10.704  10.139
   94    HB2  SER  12           2HB      SER  12  -7.800 -10.510  10.108
   95    HB3  SER  12           1HB      SER  12  -7.751 -10.274   8.360
   96    H    ALA  13           H        ALA  13  -7.142  -6.264   8.521
   97    HA   ALA  13           HA       ALA  13  -5.437  -6.426   6.350
   98    HB1  ALA  13           3HB      ALA  13  -5.273  -4.062   6.412
   99    HB2  ALA  13           1HB      ALA  13  -5.667  -4.046   8.122
  100    HB3  ALA  13           2HB      ALA  13  -6.892  -4.500   6.950
  101    H    ALA  14           H        ALA  14  -4.531  -5.357   9.609
  102    HA   ALA  14           HA       ALA  14  -1.942  -4.647   9.287
  103    HB1  ALA  14           3HB      ALA  14  -3.046  -4.495  11.396
  104    HB2  ALA  14           1HB      ALA  14  -1.538  -5.388  11.602
  105    HB3  ALA  14           2HB      ALA  14  -3.076  -6.252  11.563
  106    H    ARG  15           H        ARG  15  -3.053  -7.952   8.971
  107    HA   ARG  15           HA       ARG  15  -0.396  -9.062   9.234
  108    HE   ARG  15           HE       ARG  15   0.649 -13.357   9.286
  109    HB2  ARG  15           2HB      ARG  15  -2.664 -10.221   9.723
  110    HB3  ARG  15           1HB      ARG  15  -2.734 -10.483   7.991
  111    HG2  ARG  15           2HG      ARG  15  -1.184 -11.860  10.037
  112    HG3  ARG  15           1HG      ARG  15  -1.726 -12.409   8.456
  113    HD2  ARG  15           2HD      ARG  15   0.184 -11.562   7.381
  114    HD3  ARG  15           1HD      ARG  15   0.590 -10.516   8.739
  115   HH11  ARG  15          1HH1      ARG  15   2.471 -10.527   8.355
  116   HH12  ARG  15          2HH1      ARG  15   3.987 -11.182   8.872
  117   HH21  ARG  15          1HH2      ARG  15   2.645 -14.217   9.963
  118   HH22  ARG  15          2HH2      ARG  15   4.087 -13.276   9.782
  119    H    TYR  16           H        TYR  16  -2.563  -8.207   6.587
  120    HA   TYR  16           HA       TYR  16  -0.917  -9.347   4.566
  121    HD1  TYR  16           2HD      TYR  16  -2.536 -10.733   4.799
  122    HD2  TYR  16           1HD      TYR  16  -5.132  -7.670   3.360
  123    HE1  TYR  16           2HE      TYR  16  -4.421 -12.280   4.912
  124    HE2  TYR  16           1HE      TYR  16  -7.024  -9.228   3.481
  125    HH   TYR  16           HH       TYR  16  -7.481 -11.462   4.982
  126    HB2  TYR  16           2HB      TYR  16  -2.930  -7.102   4.304
  127    HB3  TYR  16           1HB      TYR  16  -2.221  -8.002   2.973
  128    H    VAL  17           H        VAL  17  -0.728  -6.415   6.398
  129    HA   VAL  17           HA       VAL  17   1.064  -5.111   4.544
  130    HB   VAL  17           HB       VAL  17   0.070  -4.425   7.287
  131   HG11  VAL  17          1HG1      VAL  17   2.722  -3.721   6.271
  132   HG12  VAL  17          2HG1      VAL  17   2.047  -3.536   7.893
  133   HG13  VAL  17          3HG1      VAL  17   1.727  -2.324   6.661
  134   HG21  VAL  17          3HG2      VAL  17   0.313  -2.771   4.801
  135   HG22  VAL  17          1HG2      VAL  17  -0.628  -2.412   6.246
  136   HG23  VAL  17          2HG2      VAL  17  -1.101  -3.751   5.196
  137    H    ASN  18           H        ASN  18   1.336  -6.826   7.639
  138    HA   ASN  18           HA       ASN  18   4.154  -6.599   7.801
  139    HB2  ASN  18           2HB      ASN  18   2.399  -8.696   9.088
  140    HB3  ASN  18           1HB      ASN  18   4.009  -8.204   9.605
  141   HD21  ASN  18          1HD2      ASN  18   2.748  -7.952  11.643
  142   HD22  ASN  18          2HD2      ASN  18   2.014  -6.417  11.937
  143    H    ARG  19           H        ARG  19   2.033  -8.846   6.161
  144    HA   ARG  19           HA       ARG  19   4.038 -10.856   5.796
  145    HE   ARG  19           HE       ARG  19  -0.164 -12.446   5.115
  146    HB2  ARG  19           2HB      ARG  19   1.357 -10.902   5.684
  147    HB3  ARG  19           1HB      ARG  19   1.710 -10.743   3.970
  148    HG2  ARG  19           2HG      ARG  19   2.112 -12.907   3.856
  149    HG3  ARG  19           1HG      ARG  19   3.431 -12.721   5.011
  150    HD2  ARG  19           2HD      ARG  19   1.837 -14.381   5.789
  151    HD3  ARG  19           1HD      ARG  19   1.850 -12.979   6.854
  152   HH11  ARG  19          1HH1      ARG  19   0.582 -15.149   7.192
  153   HH12  ARG  19          2HH1      ARG  19  -1.077 -15.580   7.437
  154   HH21  ARG  19          1HH2      ARG  19  -2.347 -13.011   5.436
  155   HH22  ARG  19          2HH2      ARG  19  -2.740 -14.367   6.440
  156    H    LEU  20           H        LEU  20   3.294  -7.918   4.186
  157    HA   LEU  20           HA       LEU  20   4.193  -8.644   1.588
  158    HG   LEU  20           HG       LEU  20   1.799  -6.678   2.779
  159    HB2  LEU  20           2HB      LEU  20   4.015  -5.931   2.881
  160    HB3  LEU  20           1HB      LEU  20   4.291  -6.211   1.174
  161   HD11  LEU  20          1HD1      LEU  20   2.262  -5.262   0.159
  162   HD12  LEU  20          2HD1      LEU  20   2.264  -4.466   1.732
  163   HD13  LEU  20          3HD1      LEU  20   0.794  -5.239   1.138
  164   HD21  LEU  20          3HD2      LEU  20   0.893  -7.581   0.524
  165   HD22  LEU  20          1HD2      LEU  20   1.782  -8.678   1.577
  166   HD23  LEU  20          2HD2      LEU  20   2.576  -7.962   0.174
  167    H    CYS  21           H        CYS  21   5.794  -6.958   4.287
  168    HA   CYS  21           HA       CYS  21   8.202  -6.393   3.011
  169    HG   CYS  21           HG       CYS  21   6.773  -7.879   6.349
  170    HB2  CYS  21           2HB      CYS  21   9.220  -6.324   5.237
  171    HB3  CYS  21           1HB      CYS  21   7.636  -5.556   5.267
  172    H    LYS  22           H        LYS  22   7.068  -9.333   4.519
  173    HA   LYS  22           HA       LYS  22   9.558 -10.735   4.157
  174    HB2  LYS  22           2HB      LYS  22   6.822 -11.801   4.860
  175    HB3  LYS  22           1HB      LYS  22   8.339 -12.679   4.991
  176    HG2  LYS  22           2HG      LYS  22   8.805 -11.784   6.979
  177    HG3  LYS  22           1HG      LYS  22   8.384 -10.156   6.445
  178    HD2  LYS  22           2HD      LYS  22   6.870 -10.710   8.185
  179    HD3  LYS  22           1HD      LYS  22   5.964 -10.835   6.675
  180    HE2  LYS  22           2HE      LYS  22   5.360 -12.742   7.885
  181    HE3  LYS  22           1HE      LYS  22   6.555 -13.312   6.721
  182    HZ1  LYS  22           3HZ      LYS  22   6.778 -13.030   9.628
  183    HZ2  LYS  22           1HZ      LYS  22   8.174 -12.805   8.698
  184    HZ3  LYS  22           2HZ      LYS  22   7.332 -14.270   8.620
  185    H    HIS  23           H        HIS  23   6.766 -10.072   2.287
  186    HA   HIS  23           HA       HIS  23   7.036 -12.347   0.537
  187    HD1  HIS  23           1HD      HIS  23   5.961 -11.187  -2.475
  188    HD2  HIS  23           2HD      HIS  23   3.296 -13.050   0.112
  189    HE1  HIS  23           1HE      HIS  23   4.664 -12.804  -3.898
  190    HE2  HIS  23           2HE      HIS  23   3.007 -13.868  -2.326
  191    HB2  HIS  23           2HB      HIS  23   4.855 -11.127   1.172
  192    HB3  HIS  23           1HB      HIS  23   5.339  -9.934  -0.029
  193    H    TRP  24           H        TRP  24   7.152  -8.795  -0.070
  194    HA   TRP  24           HA       TRP  24   8.640  -9.362  -2.520
  195    HD1  TRP  24           HD       TRP  24   7.736  -8.640  -4.863
  196    HE1  TRP  24           1HE      TRP  24   5.385  -8.941  -5.864
  197    HE3  TRP  24           3HE      TRP  24   4.967  -6.679  -1.036
  198    HZ2  TRP  24           2HZ      TRP  24   2.711  -8.419  -5.129
  199    HZ3  TRP  24           3HZ      TRP  24   2.518  -6.617  -1.267
  200    HH2  TRP  24           HH       TRP  24   1.415  -7.470  -3.271
  201    HB2  TRP  24           2HB      TRP  24   7.349  -6.876  -1.421
  202    HB3  TRP  24           1HB      TRP  24   8.472  -6.808  -2.774
  203    H    GLY  25           H        GLY  25   9.463  -8.750   0.709
  204    HA2  GLY  25           2HA      GLY  25  11.710  -7.049   0.307
  205    HA3  GLY  25           1HA      GLY  25  11.409  -8.047   1.716
  206    H    HIS  26           H        HIS  26  12.301  -8.456  -1.707
  207    HA   HIS  26           HA       HIS  26  14.179 -10.556  -0.855
  208    HD1  HIS  26           1HD      HIS  26  13.596 -12.771  -4.710
  209    HD2  HIS  26           2HD      HIS  26  13.919 -12.663  -0.569
  210    HE1  HIS  26           1HE      HIS  26  14.235 -15.105  -4.023
  211    HE2  HIS  26           2HE      HIS  26  14.507 -14.993  -1.521
  212    HB2  HIS  26           2HB      HIS  26  12.182 -10.694  -2.757
  213    HB3  HIS  26           1HB      HIS  26  13.621 -10.391  -3.725
  214    H    LYS  27           H        LYS  27  13.811  -7.547  -2.594
  215    HA   LYS  27           HA       LYS  27  16.701  -7.202  -2.583
  216    HB2  LYS  27           2HB      LYS  27  16.448  -8.290  -4.701
  217    HB3  LYS  27           1HB      LYS  27  15.053  -7.311  -5.115
  218    HG2  LYS  27           2HG      LYS  27  17.470  -5.744  -4.622
  219    HG3  LYS  27           1HG      LYS  27  17.613  -6.883  -5.961
  220    HD2  LYS  27           2HD      LYS  27  16.226  -5.705  -7.263
  221    HD3  LYS  27           1HD      LYS  27  15.072  -5.457  -5.954
  222    HE2  LYS  27           2HE      LYS  27  15.693  -3.308  -6.155
  223    HE3  LYS  27           1HE      LYS  27  17.060  -3.808  -5.167
  224    HZ1  LYS  27           3HZ      LYS  27  18.208  -4.302  -7.354
  225    HZ2  LYS  27           1HZ      LYS  27  17.982  -2.669  -6.970
  226    HZ3  LYS  27           2HZ      LYS  27  16.969  -3.420  -8.097
  227    H    PHE  28           H        PHE  28  14.195  -6.019  -1.391
  228    HA   PHE  28           HA       PHE  28  14.842  -3.252  -2.047
  229    HD1  PHE  28           2HD      PHE  28  13.435  -1.334  -3.546
  230    HD2  PHE  28           1HD      PHE  28  12.350  -5.369  -4.350
  231    HE1  PHE  28           2HE      PHE  28  13.631  -0.901  -5.960
  232    HE2  PHE  28           1HE      PHE  28  12.545  -4.945  -6.766
  233    HZ   PHE  28           HZ       PHE  28  13.186  -2.708  -7.574
  234    HB2  PHE  28           2HB      PHE  28  12.113  -4.495  -2.176
  235    HB3  PHE  28           1HB      PHE  28  12.314  -2.774  -1.853
  236    H    GLU  29           H        GLU  29  14.285  -1.728  -0.424
  237    HA   GLU  29           HA       GLU  29  14.628  -2.797   2.219
  238    HB2  GLU  29           2HB      GLU  29  14.353  -0.317   2.853
  239    HB3  GLU  29           1HB      GLU  29  15.752  -0.773   1.891
  240    HG2  GLU  29           2HG      GLU  29  13.394  -0.008   0.334
  241    HG3  GLU  29           1HG      GLU  29  14.078   1.275   1.331
  242    H    VAL  30           H        VAL  30  12.891  -3.893   2.943
  243    HA   VAL  30           HA       VAL  30  10.297  -2.507   2.914
  244    HB   VAL  30           HB       VAL  30   9.511  -4.962   3.533
  245   HG11  VAL  30          1HG1      VAL  30  10.111  -3.802   0.841
  246   HG12  VAL  30          2HG1      VAL  30   8.559  -4.010   1.652
  247   HG13  VAL  30          3HG1      VAL  30   9.398  -5.408   0.991
  248   HG21  VAL  30          3HG2      VAL  30  11.794  -5.657   1.727
  249   HG22  VAL  30          1HG2      VAL  30  10.801  -6.708   2.741
  250   HG23  VAL  30          2HG2      VAL  30  12.005  -5.652   3.479
  251    H    GLU  31           H        GLU  31   9.741  -1.629   4.803
  252    HA   GLU  31           HA       GLU  31  10.896  -2.668   7.273
  253    HB2  GLU  31           2HB      GLU  31  10.278  -0.094   6.364
  254    HB3  GLU  31           1HB      GLU  31   9.081  -0.429   7.608
  255    HG2  GLU  31           2HG      GLU  31  10.745  -0.780   9.247
  256    HG3  GLU  31           1HG      GLU  31  12.026  -0.829   8.036
  257    H    LEU  32           H        LEU  32   9.513  -3.067   9.142
  258    HA   LEU  32           HA       LEU  32   6.722  -3.672   8.484
  259    HG   LEU  32           HG       LEU  32   5.988  -6.333   8.370
  260    HB2  LEU  32           2HB      LEU  32   8.241  -5.674   8.173
  261    HB3  LEU  32           1HB      LEU  32   8.487  -5.655   9.905
  262   HD11  LEU  32          1HD1      LEU  32   6.638  -8.391   8.851
  263   HD12  LEU  32          2HD1      LEU  32   6.485  -8.025  10.569
  264   HD13  LEU  32          3HD1      LEU  32   8.026  -7.776   9.749
  265   HD21  LEU  32          3HD2      LEU  32   4.868  -6.477  10.629
  266   HD22  LEU  32          1HD2      LEU  32   5.141  -4.844  10.024
  267   HD23  LEU  32          2HD2      LEU  32   6.199  -5.514  11.265
  268    H    THR  33           H        THR  33   5.636  -2.452   9.856
  269    HA   THR  33           HA       THR  33   6.322  -2.647  12.736
  270    HB   THR  33           HB       THR  33   5.362  -0.279  12.890
  271    HG1  THR  33           1HG      THR  33   5.854  -0.387  10.100
  272   HG21  THR  33          3HG2      THR  33   7.589  -0.140  13.259
  273   HG22  THR  33          1HG2      THR  33   7.518   0.719  11.721
  274   HG23  THR  33          2HG2      THR  33   8.005  -0.975  11.762
  275    HA   PRO  34           HA       PRO  34   2.081  -3.811  13.116
  276    HB2  PRO  34           2HB      PRO  34   1.430  -2.896  15.575
  277    HB3  PRO  34           1HB      PRO  34   2.503  -4.270  15.311
  278    HG2  PRO  34           2HG      PRO  34   3.182  -1.447  15.990
  279    HG3  PRO  34           1HG      PRO  34   3.921  -2.947  16.572
  280    HD2  PRO  34           2HD      PRO  34   4.993  -1.361  14.600
  281    HD3  PRO  34           1HD      PRO  34   5.315  -3.099  14.763
  282    H    GLU  35           H        GLU  35   2.341  -1.608  11.546
  283    HA   GLU  35           HA       GLU  35  -0.152  -0.253  11.987
  284    HB2  GLU  35           2HB      GLU  35   2.447   1.299  11.974
  285    HB3  GLU  35           1HB      GLU  35   0.850   2.022  11.834
  286    HG2  GLU  35           2HG      GLU  35   1.859   0.438  14.185
  287    HG3  GLU  35           1HG      GLU  35   1.763   2.194  14.091
  288    H    ARG  36           H        ARG  36   2.811  -0.559  10.030
  289    HA   ARG  36           HA       ARG  36   1.326  -0.806   7.642
  290    HE   ARG  36           HE       ARG  36   0.941   4.608   9.168
  291    HB2  ARG  36           2HB      ARG  36   2.368   1.266   6.551
  292    HB3  ARG  36           1HB      ARG  36   0.986   1.518   7.599
  293    HG2  ARG  36           2HG      ARG  36   3.671   1.683   8.837
  294    HG3  ARG  36           1HG      ARG  36   3.196   2.986   7.747
  295    HD2  ARG  36           2HD      ARG  36   1.033   2.367   9.525
  296    HD3  ARG  36           1HD      ARG  36   2.504   2.651  10.454
  297   HH11  ARG  36          1HH1      ARG  36   4.279   3.747   9.720
  298   HH12  ARG  36          2HH1      ARG  36   4.847   5.379   9.611
  299   HH21  ARG  36          1HH2      ARG  36   1.687   6.755   9.026
  300   HH22  ARG  36          2HH2      ARG  36   3.377   7.086   9.218
  301    H    GLY  37           H        GLY  37   2.734  -0.720   5.688
  302    HA2  GLY  37           2HA      GLY  37   5.393  -1.814   6.356
  303    HA3  GLY  37           1HA      GLY  37   4.449  -2.287   4.945
  304    H    PHE  38           H        PHE  38   7.198  -1.037   5.156
  305    HA   PHE  38           HA       PHE  38   6.651   1.304   3.435
  306    HD1  PHE  38           2HD      PHE  38   7.254   3.757   3.631
  307    HD2  PHE  38           1HD      PHE  38  10.878   1.828   4.781
  308    HE1  PHE  38           2HE      PHE  38   8.545   5.606   2.667
  309    HE2  PHE  38           1HE      PHE  38  12.171   3.673   3.803
  310    HZ   PHE  38           HZ       PHE  38  11.006   5.564   2.738
  311    HB2  PHE  38           2HB      PHE  38   7.503   1.994   5.624
  312    HB3  PHE  38           1HB      PHE  38   8.876   0.914   5.452
  313    H    ILE  39           H        ILE  39   7.229   0.883   1.435
  314    HA   ILE  39           HA       ILE  39   9.689  -0.704   0.982
  315    HB   ILE  39           HB       ILE  39   7.427  -0.838  -0.988
  316   HG12  ILE  39          2HG1      ILE  39   7.669  -2.417   1.571
  317   HG13  ILE  39          1HG1      ILE  39   6.238  -1.672   0.866
  318   HG21  ILE  39          1HG2      ILE  39  10.039  -1.797  -0.917
  319   HG22  ILE  39          2HG2      ILE  39   8.778  -2.237  -2.067
  320   HG23  ILE  39          3HG2      ILE  39   9.034  -3.216  -0.624
  321   HD11  ILE  39          3HD1      ILE  39   6.120  -3.380  -0.818
  322   HD12  ILE  39          1HD1      ILE  39   6.210  -4.126   0.777
  323   HD13  ILE  39          2HD1      ILE  39   7.636  -4.085  -0.258
  324    H    ASP  40           H        ASP  40  11.077   0.912   0.343
  325    HA   ASP  40           HA       ASP  40  10.082   2.780  -1.692
  326    HB2  ASP  40           2HB      ASP  40  12.230   4.075  -1.026
  327    HB3  ASP  40           1HB      ASP  40  10.836   4.123   0.043
  328    H    PHE  41           H        PHE  41  10.924   2.853  -3.631
  329    HA   PHE  41           HA       PHE  41  13.031   0.917  -4.304
  330    HD1  PHE  41           2HD      PHE  41  11.159  -0.198  -3.780
  331    HD2  PHE  41           1HD      PHE  41  10.578   0.369  -7.963
  332    HE1  PHE  41           2HE      PHE  41  10.013  -2.362  -3.911
  333    HE2  PHE  41           1HE      PHE  41   9.427  -1.800  -8.094
  334    HZ   PHE  41           HZ       PHE  41   9.144  -3.169  -6.067
  335    HB2  PHE  41           2HB      PHE  41  10.890   2.341  -5.868
  336    HB3  PHE  41           1HB      PHE  41  12.276   1.655  -6.697
  337    H    GLY  42           H        GLY  42  13.118   3.883  -3.218
  338    HA2  GLY  42           2HA      GLY  42  15.207   5.102  -3.335
  339    HA3  GLY  42           1HA      GLY  42  15.272   4.722  -5.052
  340    H    ASP  43           H        ASP  43  14.084   5.946  -6.509
  341    HA   ASP  43           HA       ASP  43  13.200   8.535  -5.509
  342    HB2  ASP  43           2HB      ASP  43  14.418   7.639  -7.896
  343    HB3  ASP  43           1HB      ASP  43  12.809   8.190  -8.351
  344    H    SER  44           H        SER  44  11.582   6.766  -4.495
  345    HA   SER  44           HA       SER  44   9.011   7.443  -5.063
  346    HG   SER  44           HG       SER  44  10.602   5.666  -7.813
  347    HB2  SER  44           2HB      SER  44   8.416   5.099  -6.253
  348    HB3  SER  44           1HB      SER  44   8.800   6.552  -7.179
  349    H    ASN  45           H        ASN  45   7.426   6.012  -3.865
  350    HA   ASN  45           HA       ASN  45   8.612   3.854  -2.335
  351    HB2  ASN  45           2HB      ASN  45   7.343   6.060  -0.736
  352    HB3  ASN  45           1HB      ASN  45   8.429   4.787  -0.191
  353   HD21  ASN  45          1HD2      ASN  45   8.346   7.627  -2.308
  354   HD22  ASN  45          2HD2      ASN  45   9.963   8.134  -1.973
  355    H    CYS  46           H        CYS  46   6.943   2.846  -0.833
  356    HA   CYS  46           HA       CYS  46   4.190   3.411  -1.564
  357    HG   CYS  46           HG       CYS  46   6.140   1.059  -4.071
  358    HB2  CYS  46           2HB      CYS  46   4.317   0.619  -1.789
  359    HB3  CYS  46           1HB      CYS  46   4.031   1.778  -3.082
  360    H    GLU  47           H        GLU  47   3.505   3.754   0.471
  361    HA   GLU  47           HA       GLU  47   4.211   1.829   2.560
  362    HB2  GLU  47           2HB      GLU  47   4.359   4.487   2.660
  363    HB3  GLU  47           1HB      GLU  47   2.674   4.328   3.131
  364    HG2  GLU  47           2HG      GLU  47   3.190   3.401   5.156
  365    HG3  GLU  47           1HG      GLU  47   4.700   2.694   4.580
  366    H    LEU  48           H        LEU  48   2.512   0.978   3.962
  367    HA   LEU  48           HA       LEU  48  -0.203   1.195   2.889
  368    HG   LEU  48           HG       LEU  48  -0.933  -2.134   3.698
  369    HB2  LEU  48           2HB      LEU  48   0.801  -0.719   1.722
  370    HB3  LEU  48           1HB      LEU  48   1.227  -1.451   3.254
  371   HD11  LEU  48          1HD1      LEU  48  -2.200  -0.179   3.606
  372   HD12  LEU  48          2HD1      LEU  48  -2.911  -1.221   2.376
  373   HD13  LEU  48          3HD1      LEU  48  -1.834   0.091   1.901
  374   HD21  LEU  48          3HD2      LEU  48  -0.400  -3.539   1.971
  375   HD22  LEU  48          1HD2      LEU  48  -0.364  -2.243   0.776
  376   HD23  LEU  48          2HD2      LEU  48  -1.908  -2.841   1.382
  377    H    LEU  49           H        LEU  49  -1.533   1.610   4.499
  378    HA   LEU  49           HA       LEU  49  -0.743   0.904   7.237
  379    HG   LEU  49           HG       LEU  49  -1.813   1.959   9.005
  380    HB2  LEU  49           2HB      LEU  49  -1.669   3.236   6.440
  381    HB3  LEU  49           1HB      LEU  49  -3.222   2.441   6.574
  382   HD11  LEU  49          1HD1      LEU  49  -0.593   4.070   8.065
  383   HD12  LEU  49          2HD1      LEU  49  -1.099   4.011   9.754
  384   HD13  LEU  49          3HD1      LEU  49  -2.063   4.899   8.575
  385   HD21  LEU  49          3HD2      LEU  49  -3.697   3.224   9.951
  386   HD22  LEU  49          1HD2      LEU  49  -4.227   2.024   8.771
  387   HD23  LEU  49          2HD2      LEU  49  -4.160   3.730   8.327
  388    H    ALA  50           H        ALA  50  -1.726  -0.690   8.373
  389    HA   ALA  50           HA       ALA  50  -4.268  -1.716   7.367
  390    HB1  ALA  50           3HB      ALA  50  -2.587  -2.968   6.188
  391    HB2  ALA  50           1HB      ALA  50  -3.441  -3.997   7.323
  392    HB3  ALA  50           2HB      ALA  50  -1.822  -3.423   7.711
  393    H    HIS  51           H        HIS  51  -5.600  -1.715   8.994
  394    HA   HIS  51           HA       HIS  51  -4.657  -2.568  11.617
  395    HD1  HIS  51           1HD      HIS  51  -7.626   0.033  13.713
  396    HD2  HIS  51           2HD      HIS  51  -3.744  -1.399  13.305
  397    HE1  HIS  51           1HE      HIS  51  -6.575   0.280  15.982
  398    HE2  HIS  51           2HE      HIS  51  -4.202  -0.516  15.691
  399    HB2  HIS  51           2HB      HIS  51  -5.836  -0.167  10.996
  400    HB3  HIS  51           1HB      HIS  51  -7.227  -1.119  11.493
  401    HA   PRO  52           HA       PRO  52  -7.205  -6.127  11.850
  402    HB2  PRO  52           2HB      PRO  52  -8.927  -4.700  13.835
  403    HB3  PRO  52           1HB      PRO  52  -8.225  -6.322  13.909
  404    HG2  PRO  52           2HG      PRO  52  -7.106  -4.339  15.254
  405    HG3  PRO  52           1HG      PRO  52  -6.097  -5.522  14.406
  406    HD2  PRO  52           2HD      PRO  52  -6.748  -2.709  13.661
  407    HD3  PRO  52           1HD      PRO  52  -5.252  -3.621  13.400
  408    H    ASP  53           H        ASP  53  -8.856  -3.087  11.205
  409    HA   ASP  53           HA       ASP  53 -10.785  -4.625   9.650
  410    HB2  ASP  53           2HB      ASP  53 -11.661  -3.967  12.001
  411    HB3  ASP  53           1HB      ASP  53 -11.806  -2.350  11.319
  412    H    HIS  54           H        HIS  54  -8.581  -2.188   9.529
  413    HA   HIS  54           HA       HIS  54  -9.897  -1.210   7.142
  414    HD1  HIS  54           1HD      HIS  54  -7.189   1.861   8.751
  415    HD2  HIS  54           2HD      HIS  54  -9.946   0.234  11.397
  416    HE1  HIS  54           1HE      HIS  54  -6.318   2.404  11.044
  417    HE2  HIS  54           2HE      HIS  54  -8.093   1.559  12.619
  418    HB2  HIS  54           2HB      HIS  54  -9.419   1.174   7.657
  419    HB3  HIS  54           1HB      HIS  54 -10.642   0.449   8.687
  420    H    VAL  55           H        VAL  55  -8.464  -0.075   5.633
  421    HA   VAL  55           HA       VAL  55  -5.620  -0.395   6.195
  422    HB   VAL  55           HB       VAL  55  -6.758  -2.371   4.873
  423   HG11  VAL  55          1HG1      VAL  55  -7.588  -0.590   3.154
  424   HG12  VAL  55          2HG1      VAL  55  -7.028  -2.167   2.604
  425   HG13  VAL  55          3HG1      VAL  55  -5.963  -0.767   2.493
  426   HG21  VAL  55          3HG2      VAL  55  -4.372  -2.152   5.410
  427   HG22  VAL  55          1HG2      VAL  55  -4.154  -1.175   3.958
  428   HG23  VAL  55          2HG2      VAL  55  -4.647  -2.864   3.819
  429    H    LEU  56           H        LEU  56  -4.366   1.146   5.306
  430    HA   LEU  56           HA       LEU  56  -5.666   3.109   3.528
  431    HG   LEU  56           HG       LEU  56  -6.416   4.703   5.481
  432    HB2  LEU  56           2HB      LEU  56  -4.382   3.479   6.086
  433    HB3  LEU  56           1HB      LEU  56  -3.479   4.343   4.861
  434   HD11  LEU  56          1HD1      LEU  56  -4.216   6.682   5.967
  435   HD12  LEU  56          2HD1      LEU  56  -4.692   5.492   7.182
  436   HD13  LEU  56          3HD1      LEU  56  -5.862   6.677   6.599
  437   HD21  LEU  56          3HD2      LEU  56  -4.637   5.805   3.363
  438   HD22  LEU  56          1HD2      LEU  56  -5.833   6.874   4.092
  439   HD23  LEU  56          2HD2      LEU  56  -6.351   5.389   3.296
  440    H    MET  57           H        MET  57  -4.454   3.930   1.828
  441    HA   MET  57           HA       MET  57  -1.852   2.632   1.393
  442    HB2  MET  57           2HB      MET  57  -3.746   3.233  -0.855
  443    HB3  MET  57           1HB      MET  57  -2.367   2.140  -0.839
  444    HG2  MET  57           2HG      MET  57  -3.549   0.641   0.680
  445    HG3  MET  57           1HG      MET  57  -4.931   1.741   0.684
  446    HE1  MET  57           3HE      MET  57  -7.081   0.341  -1.927
  447    HE2  MET  57           1HE      MET  57  -6.782   1.726  -0.876
  448    HE3  MET  57           2HE      MET  57  -6.803   0.096  -0.203
  449    H    ILE  58           H        ILE  58  -0.289   4.142   1.420
  450    HA   ILE  58           HA       ILE  58  -0.840   6.704   0.088
  451    HB   ILE  58           HB       ILE  58   0.949   6.302   2.491
  452   HG12  ILE  58          2HG1      ILE  58  -1.898   6.600   2.374
  453   HG13  ILE  58          1HG1      ILE  58  -0.872   6.472   3.788
  454   HG21  ILE  58          1HG2      ILE  58   0.041   8.826   1.122
  455   HG22  ILE  58          2HG2      ILE  58   1.634   8.083   0.956
  456   HG23  ILE  58          3HG2      ILE  58   1.115   8.717   2.518
  457   HD11  ILE  58          3HD1      ILE  58  -0.771   8.753   4.087
  458   HD12  ILE  58          1HD1      ILE  58  -2.420   8.520   3.508
  459   HD13  ILE  58          2HD1      ILE  58  -1.171   9.103   2.405
  460    H    LEU  59           H        LEU  59   0.661   7.356  -1.384
  461    HA   LEU  59           HA       LEU  59   3.124   5.754  -1.548
  462    HG   LEU  59           HG       LEU  59   1.411   6.802  -5.312
  463    HB2  LEU  59           2HB      LEU  59   3.027   5.680  -3.869
  464    HB3  LEU  59           1HB      LEU  59   1.377   5.382  -3.370
  465   HD11  LEU  59          1HD1      LEU  59   0.049   8.621  -4.512
  466   HD12  LEU  59          2HD1      LEU  59   0.654   8.381  -2.875
  467   HD13  LEU  59          3HD1      LEU  59  -0.338   7.139  -3.638
  468   HD21  LEU  59          3HD2      LEU  59   2.545   9.166  -4.014
  469   HD22  LEU  59          1HD2      LEU  59   2.723   8.577  -5.661
  470   HD23  LEU  59          2HD2      LEU  59   3.707   7.893  -4.373
  471    H    ASN  60           H        ASN  60   5.024   6.765  -2.081
  472    HA   ASN  60           HA       ASN  60   4.917   9.712  -2.173
  473    HB2  ASN  60           2HB      ASN  60   7.084   8.023  -0.892
  474    HB3  ASN  60           1HB      ASN  60   7.057   9.782  -0.978
  475   HD21  ASN  60          1HD2      ASN  60   7.368   9.104   1.423
  476   HD22  ASN  60          2HD2      ASN  60   5.919   9.093   2.363
  477    H    SER  61           H        SER  61   5.187  10.096  -4.296
  478    HA   SER  61           HA       SER  61   7.675   9.087  -5.505
  479    HG   SER  61           HG       SER  61   5.629   7.119  -5.200
  480    HB2  SER  61           2HB      SER  61   5.401   8.945  -7.357
  481    HB3  SER  61           1HB      SER  61   6.732   7.818  -7.116
  482    HA   PRO  62           HA       PRO  62   7.930  13.240  -7.043
  483    HB2  PRO  62           2HB      PRO  62   9.908  12.859  -8.830
  484    HB3  PRO  62           1HB      PRO  62  10.163  12.876  -7.084
  485    HG2  PRO  62           2HG      PRO  62   9.841  10.514  -8.905
  486    HG3  PRO  62           1HG      PRO  62  11.066  10.794  -7.650
  487    HD2  PRO  62           2HD      PRO  62   8.917   9.272  -7.194
  488    HD3  PRO  62           1HD      PRO  62   9.589  10.319  -5.933
  489    H    ASP  63           H        ASP  63   6.859  10.600  -8.972
  490    HA   ASP  63           HA       ASP  63   5.892  12.547 -10.933
  491    HB2  ASP  63           2HB      ASP  63   7.733  11.739 -12.131
  492    HB3  ASP  63           1HB      ASP  63   7.536  10.100 -11.525
  493    H    GLU  64           H        GLU  64   3.860  12.004 -11.877
  494    HA   GLU  64           HA       GLU  64   2.174  10.406 -10.249
  495    HB2  GLU  64           2HB      GLU  64   1.779  11.716 -12.911
  496    HB3  GLU  64           1HB      GLU  64   0.671  10.436 -12.448
  497    HG2  GLU  64           2HG      GLU  64  -0.437  12.189 -11.558
  498    HG3  GLU  64           1HG      GLU  64   0.594  11.783 -10.181
  499    H    ASP  65           H        ASP  65   3.786   9.563 -13.344
  500    HA   ASP  65           HA       ASP  65   2.648   7.101 -13.832
  501    HB2  ASP  65           2HB      ASP  65   4.503   8.260 -15.138
  502    HB3  ASP  65           1HB      ASP  65   5.624   7.600 -13.949
  503    H    SER  66           H        SER  66   5.457   7.801 -11.799
  504    HA   SER  66           HA       SER  66   5.710   5.245 -10.630
  505    HG   SER  66           HG       SER  66   6.565   6.016  -8.049
  506    HB2  SER  66           2HB      SER  66   7.476   7.012 -10.544
  507    HB3  SER  66           1HB      SER  66   6.461   7.914  -9.416
  508    H    LEU  67           H        LEU  67   4.370   8.235  -9.391
  509    HA   LEU  67           HA       LEU  67   3.272   7.610  -7.020
  510    HG   LEU  67           HG       LEU  67   1.049   9.326  -6.548
  511    HB2  LEU  67           2HB      LEU  67   3.132   9.819  -7.809
  512    HB3  LEU  67           1HB      LEU  67   2.313   9.341  -9.266
  513   HD11  LEU  67          1HD1      LEU  67   1.519  11.458  -8.450
  514   HD12  LEU  67          2HD1      LEU  67   1.040  11.530  -6.754
  515   HD13  LEU  67          3HD1      LEU  67  -0.176  11.274  -8.005
  516   HD21  LEU  67          3HD2      LEU  67   0.072   8.683  -9.283
  517   HD22  LEU  67          1HD2      LEU  67  -1.028   9.436  -8.130
  518   HD23  LEU  67          2HD2      LEU  67  -0.281   7.886  -7.749
  519    H    ALA  68           H        ALA  68   1.400   7.295 -10.061
  520    HA   ALA  68           HA       ALA  68  -0.722   5.895  -8.811
  521    HB1  ALA  68           3HB      ALA  68   0.105   6.354 -11.653
  522    HB2  ALA  68           1HB      ALA  68  -1.352   6.878 -10.808
  523    HB3  ALA  68           2HB      ALA  68  -1.170   5.191 -11.287
  524    H    HIS  69           H        HIS  69   2.234   4.872 -10.437
  525    HA   HIS  69           HA       HIS  69   1.722   2.148 -10.707
  526    HD1  HIS  69           1HD      HIS  69   6.194   2.025 -11.757
  527    HD2  HIS  69           2HD      HIS  69   2.862   0.007 -10.313
  528    HE1  HIS  69           1HE      HIS  69   6.712  -0.419 -12.041
  529    HE2  HIS  69           2HE      HIS  69   4.718  -1.621 -11.080
  530    HB2  HIS  69           2HB      HIS  69   3.740   3.401 -11.570
  531    HB3  HIS  69           1HB      HIS  69   4.393   3.335  -9.937
  532    H    MET  70           H        MET  70   2.791   4.035  -7.955
  533    HA   MET  70           HA       MET  70   3.153   1.741  -6.237
  534    HB2  MET  70           2HB      MET  70   2.885   4.559  -5.244
  535    HB3  MET  70           1HB      MET  70   3.883   3.270  -4.598
  536    HG2  MET  70           2HG      MET  70   4.622   4.046  -7.311
  537    HG3  MET  70           1HG      MET  70   4.746   5.355  -6.141
  538    HE1  MET  70           3HE      MET  70   5.838   1.939  -7.315
  539    HE2  MET  70           1HE      MET  70   7.489   1.827  -6.705
  540    HE3  MET  70           2HE      MET  70   7.060   3.086  -7.863
  541    H    GLN  71           H        GLN  71   0.817   4.499  -6.158
  542    HA   GLN  71           HA       GLN  71  -0.771   3.440  -4.145
  543    HB2  GLN  71           2HB      GLN  71  -2.658   4.824  -5.296
  544    HB3  GLN  71           1HB      GLN  71  -1.319   5.636  -4.510
  545    HG2  GLN  71           2HG      GLN  71  -0.781   6.653  -6.395
  546    HG3  GLN  71           1HG      GLN  71  -0.743   5.135  -7.282
  547   HE21  GLN  71          1HE2      GLN  71  -2.812   7.734  -6.163
  548   HE22  GLN  71          2HE2      GLN  71  -4.043   7.522  -7.357
  549    H    ASN  72           H        ASN  72  -0.699   2.605  -7.530
  550    HA   ASN  72           HA       ASN  72  -3.227   1.215  -7.419
  551    HB2  ASN  72           2HB      ASN  72  -2.030   2.328  -9.487
  552    HB3  ASN  72           1HB      ASN  72  -1.259   0.749  -9.616
  553   HD21  ASN  72          1HD2      ASN  72  -4.273   2.489  -9.741
  554   HD22  ASN  72          2HD2      ASN  72  -5.180   1.253 -10.538
  555    H    VAL  73           H        VAL  73   0.207   0.310  -7.523
  556    HA   VAL  73           HA       VAL  73   0.087  -2.401  -7.748
  557    HB   VAL  73           HB       VAL  73   1.908  -0.607  -6.191
  558   HG11  VAL  73          1HG1      VAL  73   1.825  -2.522  -4.747
  559   HG12  VAL  73          2HG1      VAL  73   3.339  -2.566  -5.650
  560   HG13  VAL  73          3HG1      VAL  73   2.003  -3.619  -6.117
  561   HG21  VAL  73          3HG2      VAL  73   2.901  -2.575  -8.145
  562   HG22  VAL  73          1HG2      VAL  73   3.318  -0.875  -7.930
  563   HG23  VAL  73          2HG2      VAL  73   1.840  -1.320  -8.783
  564    H    VAL  74           H        VAL  74  -0.521  -0.493  -4.832
  565    HA   VAL  74           HA       VAL  74  -0.883  -2.736  -3.113
  566    HB   VAL  74           HB       VAL  74  -1.880   0.097  -2.813
  567   HG11  VAL  74          1HG1      VAL  74  -2.294  -0.374  -0.499
  568   HG12  VAL  74          2HG1      VAL  74  -1.656  -2.008  -0.668
  569   HG13  VAL  74          3HG1      VAL  74  -3.164  -1.564  -1.467
  570   HG21  VAL  74          3HG2      VAL  74   0.129  -0.436  -0.948
  571   HG22  VAL  74          1HG2      VAL  74   0.247   0.588  -2.378
  572   HG23  VAL  74          2HG2      VAL  74   0.713  -1.112  -2.468
  573    H    ALA  75           H        ALA  75  -3.179  -0.630  -4.874
  574    HA   ALA  75           HA       ALA  75  -5.578  -1.616  -3.979
  575    HB1  ALA  75           3HB      ALA  75  -5.517   0.225  -5.527
  576    HB2  ALA  75           1HB      ALA  75  -6.487  -1.068  -6.230
  577    HB3  ALA  75           2HB      ALA  75  -4.837  -0.803  -6.789
  578    H    ASP  76           H        ASP  76  -3.214  -3.126  -5.996
  579    HA   ASP  76           HA       ASP  76  -4.924  -5.245  -6.926
  580    HB2  ASP  76           2HB      ASP  76  -2.691  -4.290  -7.951
  581    HB3  ASP  76           1HB      ASP  76  -1.942  -5.485  -6.896
  582    H    HIS  77           H        HIS  77  -2.480  -4.870  -4.387
  583    HA   HIS  77           HA       HIS  77  -2.374  -7.542  -3.561
  584    HD1  HIS  77           1HD      HIS  77  -0.824  -6.319  -4.941
  585    HD2  HIS  77           2HD      HIS  77   0.929  -4.643  -1.567
  586    HE1  HIS  77           1HE      HIS  77   1.416  -5.470  -5.699
  587    HE2  HIS  77           2HE      HIS  77   2.494  -4.537  -3.622
  588    HB2  HIS  77           2HB      HIS  77  -2.016  -5.131  -1.772
  589    HB3  HIS  77           1HB      HIS  77  -1.362  -6.741  -1.526
  590    H    LEU  78           H        LEU  78  -4.545  -4.916  -2.531
  591    HA   LEU  78           HA       LEU  78  -5.831  -6.351  -0.481
  592    HG   LEU  78           HG       LEU  78  -5.102  -3.157  -0.779
  593    HB2  LEU  78           2HB      LEU  78  -6.754  -4.046  -2.198
  594    HB3  LEU  78           1HB      LEU  78  -7.691  -4.682  -0.862
  595   HD11  LEU  78          1HD1      LEU  78  -6.301  -1.702   0.677
  596   HD12  LEU  78          2HD1      LEU  78  -7.661  -2.820   0.767
  597   HD13  LEU  78          3HD1      LEU  78  -7.300  -1.989  -0.746
  598   HD21  LEU  78          3HD2      LEU  78  -4.531  -4.830   0.726
  599   HD22  LEU  78          1HD2      LEU  78  -6.197  -5.068   1.251
  600   HD23  LEU  78          2HD2      LEU  78  -5.307  -3.634   1.764
  601    H    GLN  79           H        GLN  79  -6.146  -6.349  -3.938
  602    HA   GLN  79           HA       GLN  79  -8.723  -7.581  -4.014
  603    HB2  GLN  79           2HB      GLN  79  -8.090  -6.319  -5.922
  604    HB3  GLN  79           1HB      GLN  79  -6.572  -7.185  -6.089
  605    HG2  GLN  79           2HG      GLN  79  -7.684  -9.149  -6.840
  606    HG3  GLN  79           1HG      GLN  79  -9.263  -8.477  -6.436
  607   HE21  GLN  79          1HE2      GLN  79  -9.295  -6.052  -7.485
  608   HE22  GLN  79          2HE2      GLN  79  -9.057  -6.090  -9.195
  609    H    ARG  80           H        ARG  80  -5.395  -8.828  -4.353
  610    HA   ARG  80           HA       ARG  80  -6.046 -11.466  -4.939
  611    HE   ARG  80           HE       ARG  80  -1.716 -14.647  -4.133
  612    HB2  ARG  80           2HB      ARG  80  -3.812 -10.930  -5.262
  613    HB3  ARG  80           1HB      ARG  80  -3.684 -10.089  -3.725
  614    HG2  ARG  80           2HG      ARG  80  -3.201 -11.971  -2.575
  615    HG3  ARG  80           1HG      ARG  80  -4.182 -13.002  -3.620
  616    HD2  ARG  80           2HD      ARG  80  -2.492 -12.875  -5.362
  617    HD3  ARG  80           1HD      ARG  80  -1.525 -11.788  -4.366
  618   HH11  ARG  80          1HH1      ARG  80  -0.968 -11.682  -2.451
  619   HH12  ARG  80          2HH1      ARG  80   0.035 -12.457  -1.272
  620   HH21  ARG  80          1HH2      ARG  80  -0.399 -15.669  -2.581
  621   HH22  ARG  80          2HH2      ARG  80   0.359 -14.721  -1.346
  622    H    MET  81           H        MET  81  -5.824  -9.774  -1.856
  623    HA   MET  81           HA       MET  81  -6.217 -12.199  -0.339
  624    HB2  MET  81           2HB      MET  81  -6.250 -10.715   1.626
  625    HB3  MET  81           1HB      MET  81  -4.836 -10.486   0.617
  626    HG2  MET  81           2HG      MET  81  -5.495  -8.344   1.273
  627    HG3  MET  81           1HG      MET  81  -6.022  -8.503  -0.397
  628    HE1  MET  81           3HE      MET  81  -7.888  -7.218   3.166
  629    HE2  MET  81           1HE      MET  81  -8.070  -6.146   1.778
  630    HE3  MET  81           2HE      MET  81  -6.484  -6.803   2.183
  631    H    ALA  82           H        ALA  82  -8.258 -10.003  -1.922
  632    HA   ALA  82           HA       ALA  82 -10.569 -11.076  -0.432
  633    HB1  ALA  82           3HB      ALA  82 -11.644  -8.791  -1.102
  634    HB2  ALA  82           1HB      ALA  82  -9.969  -8.248  -1.186
  635    HB3  ALA  82           2HB      ALA  82 -10.610  -8.898   0.323
  636    H    ASN  83           H        ASN  83 -11.355 -12.533  -1.844
  637    HA   ASN  83           HA       ASN  83 -11.539 -11.837  -4.678
  638    HB2  ASN  83           2HB      ASN  83 -10.689 -14.114  -3.665
  639    HB3  ASN  83           1HB      ASN  83 -12.409 -14.484  -3.585
  640   HD21  ASN  83          1HD2      ASN  83 -11.888 -16.186  -5.085
  641   HD22  ASN  83          2HD2      ASN  83 -11.778 -15.832  -6.773
  642    H    SER  84           H        SER  84 -13.316 -10.812  -5.296
  643    HA   SER  84           HA       SER  84 -15.874 -11.858  -5.170
  644    HG   SER  84           HG       SER  84 -14.951 -10.417  -1.740
  645    HB2  SER  84           2HB      SER  84 -16.750  -9.922  -3.544
  646    HB3  SER  84           1HB      SER  84 -16.284 -11.511  -2.938
  647    H    GLU  85           H        GLU  85 -13.929  -8.933  -5.183
  648    HA   GLU  85           HA       GLU  85 -15.159  -8.052  -7.629
  649    HB2  GLU  85           2HB      GLU  85 -15.990  -5.933  -6.833
  650    HB3  GLU  85           1HB      GLU  85 -16.739  -7.215  -5.892
  651    HG2  GLU  85           2HG      GLU  85 -14.313  -6.317  -4.628
  652    HG3  GLU  85           1HG      GLU  85 -15.398  -4.962  -4.939
  653    H    SER  86           H        SER  86 -14.108  -6.013  -8.435
  654    HA   SER  86           HA       SER  86 -11.283  -6.201  -8.053
  655    HG   SER  86           HG       SER  86 -13.779  -5.277 -10.392
  656    HB2  SER  86           2HB      SER  86 -12.521  -3.842  -9.418
  657    HB3  SER  86           1HB      SER  86 -11.087  -4.766  -9.863
  658    H    LEU  87           H        LEU  87 -11.520  -5.863  -5.696
  659    HA   LEU  87           HA       LEU  87 -11.785  -4.510  -3.798
  660    HG   LEU  87           HG       LEU  87  -8.303  -4.647  -3.116
  661    HB2  LEU  87           2HB      LEU  87  -9.265  -4.337  -5.144
  662    HB3  LEU  87           1HB      LEU  87  -9.615  -2.789  -4.397
  663   HD11  LEU  87          1HD1      LEU  87  -9.401  -3.730  -0.974
  664   HD12  LEU  87          2HD1      LEU  87 -10.376  -2.758  -2.077
  665   HD13  LEU  87          3HD1      LEU  87  -8.619  -2.595  -2.075
  666   HD21  LEU  87          3HD2      LEU  87 -11.116  -5.349  -2.308
  667   HD22  LEU  87          1HD2      LEU  87  -9.617  -6.038  -1.691
  668   HD23  LEU  87          2HD2      LEU  87 -10.106  -6.350  -3.352
  669    H    GLU  88           H        GLU  88 -13.379  -3.093  -3.467
  670    HA   GLU  88           HA       GLU  88 -13.720  -0.768  -5.110
  671    HB2  GLU  88           2HB      GLU  88 -15.602  -1.867  -3.890
  672    HB3  GLU  88           1HB      GLU  88 -14.873  -1.362  -2.371
  673    HG2  GLU  88           2HG      GLU  88 -15.018   1.014  -3.571
  674    HG3  GLU  88           1HG      GLU  88 -16.361   0.210  -4.384
  675    H    ILE  89           H        ILE  89 -11.914   0.510  -5.068
  676    HA   ILE  89           HA       ILE  89 -11.235   1.658  -2.463
  677    HB   ILE  89           HB       ILE  89  -8.922   1.474  -2.738
  678   HG12  ILE  89          2HG1      ILE  89  -9.025   2.175  -5.236
  679   HG13  ILE  89          1HG1      ILE  89  -7.719   1.128  -4.714
  680   HG21  ILE  89          1HG2      ILE  89  -9.756  -0.647  -2.140
  681   HG22  ILE  89          2HG2      ILE  89  -8.509  -0.917  -3.355
  682   HG23  ILE  89          3HG2      ILE  89 -10.211  -1.013  -3.802
  683   HD11  ILE  89          3HD1      ILE  89  -8.852  -0.801  -5.607
  684   HD12  ILE  89          1HD1      ILE  89  -8.676   0.436  -6.853
  685   HD13  ILE  89          2HD1      ILE  89 -10.236   0.194  -6.066
  686    H    ALA  90           H        ALA  90 -11.200   3.887  -2.457
  687    HA   ALA  90           HA       ALA  90 -11.410   5.174  -5.085
  688    HB1  ALA  90           3HB      ALA  90 -11.817   6.550  -2.436
  689    HB2  ALA  90           1HB      ALA  90 -13.107   5.649  -3.237
  690    HB3  ALA  90           2HB      ALA  90 -12.380   7.044  -4.031
  691    H    TRP  91           H        TRP  91  -9.546   5.741  -5.920
  692    HA   TRP  91           HA       TRP  91  -7.316   6.479  -4.200
  693    HD1  TRP  91           HD       TRP  91  -8.776   4.184  -7.612
  694    HE1  TRP  91           1HE      TRP  91  -9.462   4.964  -9.967
  695    HE3  TRP  91           3HE      TRP  91  -6.121   8.547  -7.828
  696    HZ2  TRP  91           2HZ      TRP  91  -8.946   7.141 -11.688
  697    HZ3  TRP  91           3HZ      TRP  91  -6.271   9.921  -9.864
  698    HH2  TRP  91           HH       TRP  91  -7.655   9.230 -11.754
  699    HB2  TRP  91           2HB      TRP  91  -6.007   6.467  -6.321
  700    HB3  TRP  91           1HB      TRP  91  -6.803   4.934  -5.982
  701    H    GLN  92           H        GLN  92  -6.553   8.483  -3.949
  702    HA   GLN  92           HA       GLN  92  -8.061  10.664  -5.143
  703    HB2  GLN  92           2HB      GLN  92  -5.904  10.633  -3.025
  704    HB3  GLN  92           1HB      GLN  92  -6.724  12.085  -3.581
  705    HG2  GLN  92           2HG      GLN  92  -8.848  11.212  -2.788
  706    HG3  GLN  92           1HG      GLN  92  -8.055   9.725  -2.270
  707   HE21  GLN  92          1HE2      GLN  92  -8.780  10.090  -0.147
  708   HE22  GLN  92          2HE2      GLN  92  -8.017  11.255   0.875
  709    HA   PRO  93           HA       PRO  93  -5.367  11.921  -8.376
  710    HB2  PRO  93           2HB      PRO  93  -5.178  14.530  -6.955
  711    HB3  PRO  93           1HB      PRO  93  -5.550  14.203  -8.651
  712    HG2  PRO  93           2HG      PRO  93  -7.484  14.856  -6.936
  713    HG3  PRO  93           1HG      PRO  93  -7.753  13.641  -8.198
  714    HD2  PRO  93           2HD      PRO  93  -7.369  13.282  -5.273
  715    HD3  PRO  93           1HD      PRO  93  -8.308  12.305  -6.420
  716    H    ALA  94           H        ALA  94  -4.412  12.955  -5.119
  717    HA   ALA  94           HA       ALA  94  -2.399  12.391  -4.059
  718    HB1  ALA  94           3HB      ALA  94  -0.581  11.467  -5.114
  719    HB2  ALA  94           1HB      ALA  94  -0.852  12.378  -6.598
  720    HB3  ALA  94           2HB      ALA  94  -1.867  10.987  -6.223
  721    H    GLU  95           H        GLU  95  -3.580  14.917  -4.785
  722    HA   GLU  95           HA       GLU  95  -1.352  16.612  -4.189
  723    HB2  GLU  95           2HB      GLU  95  -1.609  16.194  -6.839
  724    HB3  GLU  95           1HB      GLU  95  -2.722  17.541  -6.645
  725    HG2  GLU  95           2HG      GLU  95  -0.069  17.818  -5.378
  726    HG3  GLU  95           1HG      GLU  95  -0.121  17.849  -7.140
  727    H    SER  96           H        SER  96  -2.019  18.870  -3.845
  728    HA   SER  96           HA       SER  96  -4.910  19.129  -3.349
  729    HG   SER  96           HG       SER  96  -4.316  17.851  -1.305
  730    HB2  SER  96           2HB      SER  96  -2.632  19.478  -1.475
  731    HB3  SER  96           1HB      SER  96  -3.934  20.662  -1.366
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1   6.873  13.505  -5.001
    2    HB2  MET   1           2HB      MET   1   7.433  13.871  -2.677
    3    HB3  MET   1           1HB      MET   1   8.750  14.425  -3.703
    4    HG2  MET   1           2HG      MET   1   6.845  16.531  -3.081
    5    HG3  MET   1           1HG      MET   1   7.582  15.826  -1.648
    6    HE1  MET   1           3HE      MET   1   9.589  19.163  -2.225
    7    HE2  MET   1           1HE      MET   1   8.781  18.178  -1.004
    8    HE3  MET   1           2HE      MET   1   7.863  18.825  -2.364
    9    H    PHE   2           H        PHE   2   4.778  13.408  -5.538
   10    HA   PHE   2           HA       PHE   2   2.882  15.195  -4.176
   11    HD1  PHE   2           2HD      PHE   2   3.326  16.617  -6.598
   12    HD2  PHE   2           1HD      PHE   2   3.013  12.627  -8.047
   13    HE1  PHE   2           2HE      PHE   2   4.653  17.235  -8.575
   14    HE2  PHE   2           1HE      PHE   2   4.329  13.240 -10.027
   15    HZ   PHE   2           HZ       PHE   2   5.156  15.544 -10.295
   16    HB2  PHE   2           2HB      PHE   2   1.874  13.216  -6.141
   17    HB3  PHE   2           1HB      PHE   2   1.433  14.905  -5.927
   18    H    ARG   3           H        ARG   3   0.747  13.962  -3.466
   19    HA   ARG   3           HA       ARG   3   1.365  11.251  -2.628
   20    HE   ARG   3           HE       ARG   3   4.267  12.924   1.304
   21    HB2  ARG   3           2HB      ARG   3   1.884  13.338  -0.852
   22    HB3  ARG   3           1HB      ARG   3   0.358  12.649  -0.303
   23    HG2  ARG   3           2HG      ARG   3   1.612  11.154   0.755
   24    HG3  ARG   3           1HG      ARG   3   1.855  10.430  -0.825
   25    HD2  ARG   3           2HD      ARG   3   4.030  10.697  -0.379
   26    HD3  ARG   3           1HD      ARG   3   3.749  12.375  -0.834
   27   HH11  ARG   3          1HH1      ARG   3   2.940   9.693   1.338
   28   HH12  ARG   3          2HH1      ARG   3   3.092   9.518   3.054
   29   HH21  ARG   3          1HH2      ARG   3   4.469  12.689   3.558
   30   HH22  ARG   3          2HH2      ARG   3   3.959  11.216   4.313
   31    H    SER   4           H        SER   4  -0.312   9.986  -2.805
   32    HA   SER   4           HA       SER   4  -3.040  11.090  -2.718
   33    HG   SER   4           HG       SER   4  -3.263   7.670  -4.095
   34    HB2  SER   4           2HB      SER   4  -2.939  10.256  -4.882
   35    HB3  SER   4           1HB      SER   4  -1.722   9.045  -4.468
   36    H    THR   5           H        THR   5  -4.692   9.483  -1.911
   37    HA   THR   5           HA       THR   5  -3.552   7.413  -0.222
   38    HB   THR   5           HB       THR   5  -4.583   8.146   1.818
   39    HG1  THR   5           1HG      THR   5  -6.419   9.132   1.306
   40   HG21  THR   5          3HG2      THR   5  -3.468  10.742   0.877
   41   HG22  THR   5          1HG2      THR   5  -2.406   9.341   1.026
   42   HG23  THR   5          2HG2      THR   5  -3.292   9.930   2.429
   43    H    SER   6           H        SER   6  -4.676   5.615  -0.308
   44    HA   SER   6           HA       SER   6  -7.485   5.760  -1.197
   45    HG   SER   6           HG       SER   6  -7.987   3.090  -1.334
   46    HB2  SER   6           2HB      SER   6  -5.917   4.484  -2.660
   47    HB3  SER   6           1HB      SER   6  -5.605   3.387  -1.315
   48    H    HIS   7           H        HIS   7  -9.076   5.060   0.119
   49    HA   HIS   7           HA       HIS   7  -8.286   3.676   2.606
   50    HD1  HIS   7           1HD      HIS   7  -9.745   6.194   5.404
   51    HD2  HIS   7           2HD      HIS   7 -11.519   2.868   3.656
   52    HE1  HIS   7           1HE      HIS   7 -10.943   5.012   7.270
   53    HE2  HIS   7           2HE      HIS   7 -11.938   2.958   6.204
   54    HB2  HIS   7           2HB      HIS   7  -9.106   5.953   3.026
   55    HB3  HIS   7           1HB      HIS   7 -10.603   5.576   2.184
   56    H    VAL   8           H        VAL   8  -9.185   1.735   3.032
   57    HA   VAL   8           HA       VAL   8 -11.681   0.985   1.682
   58    HB   VAL   8           HB       VAL   8  -9.454  -1.021   1.785
   59   HG11  VAL   8          1HG1      VAL   8 -11.724  -0.696  -0.171
   60   HG12  VAL   8          2HG1      VAL   8 -11.809  -1.679   1.293
   61   HG13  VAL   8          3HG1      VAL   8 -10.660  -2.089   0.020
   62   HG21  VAL   8          3HG2      VAL   8  -9.896   0.820  -0.561
   63   HG22  VAL   8          1HG2      VAL   8  -8.657  -0.422  -0.383
   64   HG23  VAL   8          2HG2      VAL   8  -8.601   1.026   0.620
   65    H    ARG   9           H        ARG   9 -12.822  -0.781   2.722
   66    HA   ARG   9           HA       ARG   9 -12.043  -1.035   5.541
   67    HE   ARG   9           HE       ARG   9 -14.066   2.877   6.607
   68    HB2  ARG   9           2HB      ARG   9 -14.659  -1.125   4.135
   69    HB3  ARG   9           1HB      ARG   9 -14.472  -2.173   5.532
   70    HG2  ARG   9           2HG      ARG   9 -15.437  -0.107   6.243
   71    HG3  ARG   9           1HG      ARG   9 -13.788  -0.206   6.867
   72    HD2  ARG   9           2HD      ARG   9 -12.985   1.344   5.292
   73    HD3  ARG   9           1HD      ARG   9 -14.434   1.207   4.297
   74   HH11  ARG   9          1HH1      ARG   9 -16.410   1.249   4.598
   75   HH12  ARG   9          2HH1      ARG   9 -17.705   2.312   5.031
   76   HH21  ARG   9          1HH2      ARG   9 -15.769   4.276   7.178
   77   HH22  ARG   9          2HH2      ARG   9 -17.342   4.032   6.497
   78    H    THR  10           H        THR  10 -10.723  -2.722   5.841
   79    HA   THR  10           HA       THR  10 -11.569  -5.333   4.783
   80    HB   THR  10           HB       THR  10  -9.314  -3.941   3.941
   81    HG1  THR  10           1HG      THR  10 -10.352  -5.589   2.799
   82   HG21  THR  10          3HG2      THR  10  -8.392  -4.865   6.234
   83   HG22  THR  10          1HG2      THR  10  -7.412  -4.839   4.763
   84   HG23  THR  10          2HG2      THR  10  -8.203  -6.334   5.269
   85    H    GLU  11           H        GLU  11 -10.821  -7.202   6.030
   86    HA   GLU  11           HA       GLU  11 -10.482  -6.501   8.869
   87    HB2  GLU  11           2HB      GLU  11 -12.184  -8.339   7.522
   88    HB3  GLU  11           1HB      GLU  11 -11.088  -9.266   8.538
   89    HG2  GLU  11           2HG      GLU  11 -12.161  -8.669  10.382
   90    HG3  GLU  11           1HG      GLU  11 -12.112  -6.963   9.934
   91    H    SER  12           H        SER  12  -8.895  -7.490  10.157
   92    HA   SER  12           HA       SER  12  -6.861  -8.354  10.648
   93    HG   SER  12           HG       SER  12  -5.507 -10.414   8.528
   94    HB2  SER  12           2HB      SER  12  -7.771 -10.491  10.221
   95    HB3  SER  12           1HB      SER  12  -7.729 -10.254   8.474
   96    H    ALA  13           H        ALA  13  -7.139  -6.245   8.634
   97    HA   ALA  13           HA       ALA  13  -5.417  -6.385   6.476
   98    HB1  ALA  13           3HB      ALA  13  -5.665  -4.007   8.251
   99    HB2  ALA  13           1HB      ALA  13  -6.901  -4.474   7.095
  100    HB3  ALA  13           2HB      ALA  13  -5.293  -4.022   6.536
  101    H    ALA  14           H        ALA  14  -4.553  -5.291   9.734
  102    HA   ALA  14           HA       ALA  14  -1.976  -4.543   9.445
  103    HB1  ALA  14           3HB      ALA  14  -3.144  -4.420  11.536
  104    HB2  ALA  14           1HB      ALA  14  -1.588  -5.223  11.764
  105    HB3  ALA  14           2HB      ALA  14  -3.074  -6.175  11.720
  106    H    ARG  15           H        ARG  15  -2.992  -7.914   9.227
  107    HA   ARG  15           HA       ARG  15  -0.282  -8.880   9.470
  108    HE   ARG  15           HE       ARG  15  -1.458 -13.241   6.881
  109    HB2  ARG  15           2HB      ARG  15  -2.425 -10.132  10.132
  110    HB3  ARG  15           1HB      ARG  15  -2.612 -10.472   8.419
  111    HG2  ARG  15           2HG      ARG  15  -0.159 -11.163  10.008
  112    HG3  ARG  15           1HG      ARG  15  -1.505 -12.268   9.747
  113    HD2  ARG  15           2HD      ARG  15  -0.630 -11.146   7.248
  114    HD3  ARG  15           1HD      ARG  15   0.731 -11.862   8.098
  115   HH11  ARG  15          1HH1      ARG  15   0.896 -13.405   9.451
  116   HH12  ARG  15          2HH1      ARG  15   0.869 -15.135   9.534
  117   HH21  ARG  15          1HH2      ARG  15  -1.495 -15.515   6.988
  118   HH22  ARG  15          2HH2      ARG  15  -0.488 -16.333   8.135
  119    H    TYR  16           H        TYR  16  -2.571  -8.316   6.849
  120    HA   TYR  16           HA       TYR  16  -0.949  -9.440   4.816
  121    HD1  TYR  16           2HD      TYR  16  -2.547 -10.849   5.060
  122    HD2  TYR  16           1HD      TYR  16  -5.208  -7.804   3.716
  123    HE1  TYR  16           2HE      TYR  16  -4.419 -12.404   5.245
  124    HE2  TYR  16           1HE      TYR  16  -7.088  -9.366   3.907
  125    HH   TYR  16           HH       TYR  16  -7.654 -11.427   5.133
  126    HB2  TYR  16           2HB      TYR  16  -2.982  -7.214   4.556
  127    HB3  TYR  16           1HB      TYR  16  -2.297  -8.135   3.226
  128    H    VAL  17           H        VAL  17  -0.757  -6.489   6.597
  129    HA   VAL  17           HA       VAL  17   1.001  -5.187   4.710
  130    HB   VAL  17           HB       VAL  17  -0.012  -4.471   7.432
  131   HG11  VAL  17          1HG1      VAL  17   2.665  -3.750   6.428
  132   HG12  VAL  17          2HG1      VAL  17   2.023  -3.716   8.073
  133   HG13  VAL  17          3HG1      VAL  17   1.668  -2.402   6.960
  134   HG21  VAL  17          3HG2      VAL  17   0.334  -2.835   4.943
  135   HG22  VAL  17          1HG2      VAL  17  -0.619  -2.430   6.371
  136   HG23  VAL  17          2HG2      VAL  17  -1.117  -3.764   5.325
  137    H    ASN  18           H        ASN  18   1.292  -6.976   7.749
  138    HA   ASN  18           HA       ASN  18   4.106  -6.686   7.944
  139    HB2  ASN  18           2HB      ASN  18   2.377  -8.835   9.177
  140    HB3  ASN  18           1HB      ASN  18   3.979  -8.336   9.710
  141   HD21  ASN  18          1HD2      ASN  18   2.339  -8.285  11.655
  142   HD22  ASN  18          2HD2      ASN  18   1.728  -6.710  12.016
  143    H    ARG  19           H        ARG  19   2.026  -8.993   6.293
  144    HA   ARG  19           HA       ARG  19   4.133 -10.896   5.885
  145    HE   ARG  19           HE       ARG  19   1.440 -15.489   5.605
  146    HB2  ARG  19           2HB      ARG  19   1.445 -11.079   5.822
  147    HB3  ARG  19           1HB      ARG  19   1.780 -10.950   4.100
  148    HG2  ARG  19           2HG      ARG  19   2.288 -13.096   4.053
  149    HG3  ARG  19           1HG      ARG  19   3.623 -12.793   5.163
  150    HD2  ARG  19           2HD      ARG  19   2.158 -13.120   7.063
  151    HD3  ARG  19           1HD      ARG  19   0.777 -13.330   5.987
  152   HH11  ARG  19          1HH1      ARG  19   4.065 -13.744   7.102
  153   HH12  ARG  19          2HH1      ARG  19   5.034 -15.159   7.342
  154   HH21  ARG  19          1HH2      ARG  19   2.712 -17.350   5.920
  155   HH22  ARG  19          2HH2      ARG  19   4.266 -17.206   6.671
  156    H    LEU  20           H        LEU  20   3.180  -8.010   4.287
  157    HA   LEU  20           HA       LEU  20   4.029  -8.671   1.666
  158    HG   LEU  20           HG       LEU  20   1.627  -6.780   2.924
  159    HB2  LEU  20           2HB      LEU  20   3.825  -5.981   3.004
  160    HB3  LEU  20           1HB      LEU  20   4.080  -6.224   1.289
  161   HD11  LEU  20          1HD1      LEU  20   0.587  -5.224   1.522
  162   HD12  LEU  20          2HD1      LEU  20   1.824  -5.390   0.274
  163   HD13  LEU  20          3HD1      LEU  20   2.196  -4.541   1.774
  164   HD21  LEU  20          3HD2      LEU  20   1.756  -8.768   1.641
  165   HD22  LEU  20          1HD2      LEU  20   2.318  -7.903   0.209
  166   HD23  LEU  20          2HD2      LEU  20   0.658  -7.707   0.763
  167    H    CYS  21           H        CYS  21   5.684  -6.954   4.314
  168    HA   CYS  21           HA       CYS  21   8.037  -6.351   2.960
  169    HG   CYS  21           HG       CYS  21   8.384  -7.905   6.821
  170    HB2  CYS  21           2HB      CYS  21   9.113  -6.244   5.166
  171    HB3  CYS  21           1HB      CYS  21   7.526  -5.484   5.209
  172    H    LYS  22           H        LYS  22   7.029  -9.296   4.562
  173    HA   LYS  22           HA       LYS  22   9.552 -10.622   4.125
  174    HB2  LYS  22           2HB      LYS  22   6.888 -11.765   4.974
  175    HB3  LYS  22           1HB      LYS  22   8.440 -12.586   5.059
  176    HG2  LYS  22           2HG      LYS  22   8.973 -11.613   6.996
  177    HG3  LYS  22           1HG      LYS  22   8.434 -10.023   6.456
  178    HD2  LYS  22           2HD      LYS  22   7.042 -10.626   8.280
  179    HD3  LYS  22           1HD      LYS  22   6.069 -10.831   6.821
  180    HE2  LYS  22           2HE      LYS  22   5.639 -12.744   8.098
  181    HE3  LYS  22           1HE      LYS  22   6.799 -13.270   6.879
  182    HZ1  LYS  22           3HZ      LYS  22   7.132 -12.985   9.762
  183    HZ2  LYS  22           1HZ      LYS  22   8.466 -12.584   8.800
  184    HZ3  LYS  22           2HZ      LYS  22   7.789 -14.130   8.706
  185    H    HIS  23           H        HIS  23   6.643 -10.112   2.376
  186    HA   HIS  23           HA       HIS  23   6.953 -12.408   0.654
  187    HD1  HIS  23           1HD      HIS  23   3.012 -12.799   0.209
  188    HD2  HIS  23           2HD      HIS  23   6.008 -11.597  -2.406
  189    HE1  HIS  23           1HE      HIS  23   2.491 -13.930  -1.975
  190    HE2  HIS  23           2HE      HIS  23   4.367 -13.259  -3.516
  191    HB2  HIS  23           2HB      HIS  23   4.723 -11.419   1.339
  192    HB3  HIS  23           1HB      HIS  23   5.078 -10.085   0.246
  193    H    TRP  24           H        TRP  24   6.847  -8.866   0.015
  194    HA   TRP  24           HA       TRP  24   8.164  -9.341  -2.532
  195    HD1  TRP  24           HD       TRP  24   4.598  -6.581  -1.541
  196    HE1  TRP  24           1HE      TRP  24   2.812  -7.637  -3.064
  197    HE3  TRP  24           3HE      TRP  24   7.628  -9.498  -4.449
  198    HZ2  TRP  24           2HZ      TRP  24   2.702  -9.465  -5.213
  199    HZ3  TRP  24           3HZ      TRP  24   6.602 -10.871  -6.215
  200    HH2  TRP  24           HH       TRP  24   4.190 -10.853  -6.587
  201    HB2  TRP  24           2HB      TRP  24   7.118  -6.823  -1.235
  202    HB3  TRP  24           1HB      TRP  24   7.867  -6.876  -2.828
  203    H    GLY  25           H        GLY  25   9.206  -8.708   0.652
  204    HA2  GLY  25           2HA      GLY  25  11.418  -7.012   0.089
  205    HA3  GLY  25           1HA      GLY  25  11.215  -8.003   1.520
  206    H    HIS  26           H        HIS  26  11.878  -8.449  -1.951
  207    HA   HIS  26           HA       HIS  26  13.826 -10.523  -1.197
  208    HD1  HIS  26           1HD      HIS  26  14.712 -12.451  -1.896
  209    HD2  HIS  26           2HD      HIS  26  10.821 -13.045  -3.231
  210    HE1  HIS  26           1HE      HIS  26  14.227 -14.886  -1.494
  211    HE2  HIS  26           2HE      HIS  26  11.839 -15.202  -2.231
  212    HB2  HIS  26           2HB      HIS  26  11.736 -10.478  -3.166
  213    HB3  HIS  26           1HB      HIS  26  13.288 -10.666  -3.975
  214    H    LYS  27           H        LYS  27  13.330  -7.529  -2.904
  215    HA   LYS  27           HA       LYS  27  16.224  -7.252  -3.196
  216    HB2  LYS  27           2HB      LYS  27  15.652  -8.275  -5.304
  217    HB3  LYS  27           1HB      LYS  27  14.305  -7.176  -5.536
  218    HG2  LYS  27           2HG      LYS  27  16.888  -5.824  -5.254
  219    HG3  LYS  27           1HG      LYS  27  16.783  -6.906  -6.642
  220    HD2  LYS  27           2HD      LYS  27  14.529  -5.032  -6.113
  221    HD3  LYS  27           1HD      LYS  27  16.018  -4.394  -6.811
  222    HE2  LYS  27           2HE      LYS  27  15.316  -6.799  -8.176
  223    HE3  LYS  27           1HE      LYS  27  13.901  -5.747  -8.114
  224    HZ1  LYS  27           3HZ      LYS  27  15.432  -3.941  -8.937
  225    HZ2  LYS  27           1HZ      LYS  27  15.062  -5.160 -10.050
  226    HZ3  LYS  27           2HZ      LYS  27  16.562  -5.155  -9.268
  227    H    PHE  28           H        PHE  28  13.782  -6.001  -1.798
  228    HA   PHE  28           HA       PHE  28  14.563  -3.247  -2.391
  229    HD1  PHE  28           2HD      PHE  28  13.273  -1.377  -4.020
  230    HD2  PHE  28           1HD      PHE  28  11.751  -5.324  -4.475
  231    HE1  PHE  28           2HE      PHE  28  13.369  -1.129  -6.468
  232    HE2  PHE  28           1HE      PHE  28  11.846  -5.084  -6.923
  233    HZ   PHE  28           HZ       PHE  28  12.658  -2.985  -7.921
  234    HB2  PHE  28           2HB      PHE  28  11.734  -4.288  -2.358
  235    HB3  PHE  28           1HB      PHE  28  12.123  -2.580  -2.171
  236    H    GLU  29           H        GLU  29  13.831  -1.713  -0.696
  237    HA   GLU  29           HA       GLU  29  14.343  -2.901   1.893
  238    HB2  GLU  29           2HB      GLU  29  14.366  -0.576   2.721
  239    HB3  GLU  29           1HB      GLU  29  15.450  -0.812   1.358
  240    HG2  GLU  29           2HG      GLU  29  13.931   0.282  -0.125
  241    HG3  GLU  29           1HG      GLU  29  12.690   0.356   1.124
  242    H    VAL  30           H        VAL  30  12.743  -3.812   2.983
  243    HA   VAL  30           HA       VAL  30  10.120  -2.479   2.957
  244    HB   VAL  30           HB       VAL  30   9.471  -5.030   3.651
  245   HG11  VAL  30          1HG1      VAL  30   9.463  -3.629   1.011
  246   HG12  VAL  30          2HG1      VAL  30   8.117  -3.999   2.093
  247   HG13  VAL  30          3HG1      VAL  30   8.873  -5.283   1.152
  248   HG21  VAL  30          3HG2      VAL  30  11.902  -5.622   3.082
  249   HG22  VAL  30          1HG2      VAL  30  11.399  -5.445   1.400
  250   HG23  VAL  30          2HG2      VAL  30  10.612  -6.636   2.436
  251    H    GLU  31           H        GLU  31   9.675  -1.598   4.868
  252    HA   GLU  31           HA       GLU  31  10.880  -2.702   7.286
  253    HB2  GLU  31           2HB      GLU  31  10.357  -0.104   6.443
  254    HB3  GLU  31           1HB      GLU  31   9.119  -0.407   7.653
  255    HG2  GLU  31           2HG      GLU  31  10.930  -1.129   9.210
  256    HG3  GLU  31           1HG      GLU  31  12.099  -0.590   8.005
  257    H    LEU  32           H        LEU  32   9.546  -3.121   9.182
  258    HA   LEU  32           HA       LEU  32   6.720  -3.640   8.580
  259    HG   LEU  32           HG       LEU  32   5.938  -6.309   8.475
  260    HB2  LEU  32           2HB      LEU  32   8.195  -5.684   8.269
  261    HB3  LEU  32           1HB      LEU  32   8.449  -5.657  10.001
  262   HD11  LEU  32          1HD1      LEU  32   6.153  -8.057  10.521
  263   HD12  LEU  32          2HD1      LEU  32   7.852  -7.679  10.236
  264   HD13  LEU  32          3HD1      LEU  32   6.856  -8.308   8.924
  265   HD21  LEU  32          3HD2      LEU  32   6.140  -5.413  11.349
  266   HD22  LEU  32          1HD2      LEU  32   4.793  -6.362  10.722
  267   HD23  LEU  32          2HD2      LEU  32   5.110  -4.753  10.078
  268    H    THR  33           H        THR  33   5.688  -2.382   9.952
  269    HA   THR  33           HA       THR  33   6.411  -2.562  12.824
  270    HB   THR  33           HB       THR  33   5.384  -0.140  12.847
  271    HG1  THR  33           1HG      THR  33   4.932  -0.292  10.525
  272   HG21  THR  33          3HG2      THR  33   8.163  -0.820  11.966
  273   HG22  THR  33          1HG2      THR  33   7.597  -0.317  13.558
  274   HG23  THR  33          2HG2      THR  33   7.647   0.845  12.232
  275    HA   PRO  34           HA       PRO  34   2.133  -3.526  13.301
  276    HB2  PRO  34           2HB      PRO  34   1.520  -2.499  15.715
  277    HB3  PRO  34           1HB      PRO  34   2.591  -3.884  15.512
  278    HG2  PRO  34           2HG      PRO  34   3.274  -1.030  16.044
  279    HG3  PRO  34           1HG      PRO  34   4.016  -2.500  16.696
  280    HD2  PRO  34           2HD      PRO  34   5.064  -1.013  14.627
  281    HD3  PRO  34           1HD      PRO  34   5.410  -2.732  14.901
  282    H    GLU  35           H        GLU  35   2.439  -1.390  11.628
  283    HA   GLU  35           HA       GLU  35  -0.022   0.036  12.048
  284    HB2  GLU  35           2HB      GLU  35   2.600   1.538  11.870
  285    HB3  GLU  35           1HB      GLU  35   1.006   2.275  11.777
  286    HG2  GLU  35           2HG      GLU  35   2.081   0.755  14.141
  287    HG3  GLU  35           1HG      GLU  35   2.056   2.509  13.982
  288    H    ARG  36           H        ARG  36   2.880  -0.449  10.027
  289    HA   ARG  36           HA       ARG  36   1.307  -0.770   7.705
  290    HE   ARG  36           HE       ARG  36   1.258   4.634   8.689
  291    HB2  ARG  36           2HB      ARG  36   2.228   1.216   6.464
  292    HB3  ARG  36           1HB      ARG  36   1.041   1.597   7.702
  293    HG2  ARG  36           2HG      ARG  36   3.854   1.618   8.572
  294    HG3  ARG  36           1HG      ARG  36   3.386   2.877   7.427
  295    HD2  ARG  36           2HD      ARG  36   1.438   2.520   9.556
  296    HD3  ARG  36           1HD      ARG  36   3.038   2.931  10.170
  297   HH11  ARG  36          1HH1      ARG  36   4.584   4.041   9.560
  298   HH12  ARG  36          2HH1      ARG  36   5.074   5.681   9.306
  299   HH21  ARG  36          1HH2      ARG  36   1.900   6.793   8.352
  300   HH22  ARG  36          2HH2      ARG  36   3.550   7.245   8.621
  301    H    GLY  37           H        GLY  37   2.634  -0.818   5.692
  302    HA2  GLY  37           2HA      GLY  37   5.272  -1.997   6.292
  303    HA3  GLY  37           1HA      GLY  37   4.253  -2.461   4.936
  304    H    PHE  38           H        PHE  38   6.995  -0.729   5.629
  305    HA   PHE  38           HA       PHE  38   6.504   1.346   3.614
  306    HD1  PHE  38           1HD      PHE  38   7.240   3.730   3.599
  307    HD2  PHE  38           2HD      PHE  38  10.773   1.802   5.030
  308    HE1  PHE  38           1HE      PHE  38   8.627   5.495   2.601
  309    HE2  PHE  38           2HE      PHE  38  12.148   3.561   4.010
  310    HZ   PHE  38           HZ       PHE  38  11.075   5.411   2.792
  311    HB2  PHE  38           2HB      PHE  38   7.424   2.066   5.756
  312    HB3  PHE  38           1HB      PHE  38   8.748   0.926   5.602
  313    H    ILE  39           H        ILE  39   7.096   0.964   1.592
  314    HA   ILE  39           HA       ILE  39   9.455  -0.752   1.110
  315    HB   ILE  39           HB       ILE  39   7.116  -0.808  -0.775
  316   HG12  ILE  39          2HG1      ILE  39   7.449  -2.369   1.779
  317   HG13  ILE  39          1HG1      ILE  39   6.005  -1.595   1.142
  318   HG21  ILE  39          1HG2      ILE  39   8.569  -3.256  -0.586
  319   HG22  ILE  39          2HG2      ILE  39   9.716  -1.930  -0.733
  320   HG23  ILE  39          3HG2      ILE  39   8.453  -2.138  -1.943
  321   HD11  ILE  39          3HD1      ILE  39   5.916  -4.054   1.092
  322   HD12  ILE  39          1HD1      ILE  39   7.273  -4.056  -0.034
  323   HD13  ILE  39          2HD1      ILE  39   5.739  -3.320  -0.501
  324    H    ASP  40           H        ASP  40  10.967   0.581   0.191
  325    HA   ASP  40           HA       ASP  40   9.994   2.627  -1.683
  326    HB2  ASP  40           2HB      ASP  40  11.358   4.050  -0.636
  327    HB3  ASP  40           1HB      ASP  40  11.963   2.768   0.402
  328    H    PHE  41           H        PHE  41  10.361   2.434  -3.751
  329    HA   PHE  41           HA       PHE  41  11.902   0.186  -4.743
  330    HD1  PHE  41           2HD      PHE  41  12.054   2.105  -8.110
  331    HD2  PHE  41           1HD      PHE  41   9.865  -1.259  -6.698
  332    HE1  PHE  41           2HE      PHE  41  12.648   0.865 -10.153
  333    HE2  PHE  41           1HE      PHE  41  10.451  -2.504  -8.738
  334    HZ   PHE  41           HZ       PHE  41  11.845  -1.441 -10.469
  335    HB2  PHE  41           2HB      PHE  41   9.639   0.861  -5.641
  336    HB3  PHE  41           1HB      PHE  41  10.398   2.298  -6.306
  337    H    GLY  42           H        GLY  42  12.310   3.528  -4.223
  338    HA2  GLY  42           2HA      GLY  42  14.899   3.903  -4.479
  339    HA3  GLY  42           1HA      GLY  42  14.463   3.800  -6.178
  340    H    ASP  43           H        ASP  43  13.193   5.447  -7.111
  341    HA   ASP  43           HA       ASP  43  13.392   7.998  -5.702
  342    HB2  ASP  43           2HB      ASP  43  13.938   7.334  -8.291
  343    HB3  ASP  43           1HB      ASP  43  12.303   7.969  -8.447
  344    H    SER  44           H        SER  44  11.614   6.780  -4.363
  345    HA   SER  44           HA       SER  44   9.314   8.188  -4.274
  346    HG   SER  44           HG       SER  44   6.760   6.120  -5.823
  347    HB2  SER  44           2HB      SER  44   8.710   7.412  -6.524
  348    HB3  SER  44           1HB      SER  44   8.881   5.744  -6.010
  349    H    ASN  45           H        ASN  45   7.380   6.132  -3.628
  350    HA   ASN  45           HA       ASN  45   8.578   4.158  -1.977
  351    HB2  ASN  45           2HB      ASN  45   8.217   6.782  -0.822
  352    HB3  ASN  45           1HB      ASN  45   7.226   5.598   0.029
  353   HD21  ASN  45          1HD2      ASN  45  10.104   7.072   0.079
  354   HD22  ASN  45          2HD2      ASN  45  11.060   5.868   0.868
  355    H    CYS  46           H        CYS  46   6.869   3.131  -0.505
  356    HA   CYS  46           HA       CYS  46   4.139   3.624  -1.302
  357    HG   CYS  46           HG       CYS  46   5.976   1.534  -4.041
  358    HB2  CYS  46           2HB      CYS  46   4.466   0.812  -1.629
  359    HB3  CYS  46           1HB      CYS  46   3.927   1.999  -2.808
  360    H    GLU  47           H        GLU  47   3.434   3.880   0.730
  361    HA   GLU  47           HA       GLU  47   4.147   1.882   2.749
  362    HB2  GLU  47           2HB      GLU  47   4.272   4.545   2.938
  363    HB3  GLU  47           1HB      GLU  47   2.594   4.344   3.419
  364    HG2  GLU  47           2HG      GLU  47   3.154   3.260   5.379
  365    HG3  GLU  47           1HG      GLU  47   4.729   2.742   4.773
  366    H    LEU  48           H        LEU  48   2.467   0.965   4.083
  367    HA   LEU  48           HA       LEU  48  -0.253   1.208   3.014
  368    HG   LEU  48           HG       LEU  48  -0.971  -2.048   3.916
  369    HB2  LEU  48           2HB      LEU  48   0.697  -0.691   1.821
  370    HB3  LEU  48           1HB      LEU  48   1.210  -1.427   3.326
  371   HD11  LEU  48          1HD1      LEU  48  -2.346  -0.227   3.658
  372   HD12  LEU  48          2HD1      LEU  48  -2.912  -1.274   2.358
  373   HD13  LEU  48          3HD1      LEU  48  -1.830   0.070   1.998
  374   HD21  LEU  48          3HD2      LEU  48  -0.421  -2.401   1.000
  375   HD22  LEU  48          1HD2      LEU  48  -1.906  -3.029   1.713
  376   HD23  LEU  48          2HD2      LEU  48  -0.340  -3.580   2.309
  377    H    LEU  49           H        LEU  49  -1.516   1.714   4.648
  378    HA   LEU  49           HA       LEU  49  -0.762   0.942   7.373
  379    HG   LEU  49           HG       LEU  49  -1.989   1.881   9.143
  380    HB2  LEU  49           2HB      LEU  49  -1.655   3.287   6.632
  381    HB3  LEU  49           1HB      LEU  49  -3.224   2.508   6.697
  382   HD11  LEU  49          1HD1      LEU  49  -0.533   3.930   8.282
  383   HD12  LEU  49          2HD1      LEU  49  -0.978   3.733   9.977
  384   HD13  LEU  49          3HD1      LEU  49  -1.892   4.836   8.949
  385   HD21  LEU  49          3HD2      LEU  49  -3.739   3.407  10.044
  386   HD22  LEU  49          1HD2      LEU  49  -4.347   2.227   8.883
  387   HD23  LEU  49          2HD2      LEU  49  -4.097   3.902   8.391
  388    H    ALA  50           H        ALA  50  -1.747  -0.664   8.486
  389    HA   ALA  50           HA       ALA  50  -4.293  -1.666   7.467
  390    HB1  ALA  50           3HB      ALA  50  -2.596  -2.919   6.296
  391    HB2  ALA  50           1HB      ALA  50  -3.485  -3.948   7.405
  392    HB3  ALA  50           2HB      ALA  50  -1.867  -3.398   7.829
  393    H    HIS  51           H        HIS  51  -5.632  -1.661   9.088
  394    HA   HIS  51           HA       HIS  51  -4.703  -2.514  11.715
  395    HD1  HIS  51           1HD      HIS  51  -7.704   0.032  13.806
  396    HD2  HIS  51           2HD      HIS  51  -3.781  -1.281  13.387
  397    HE1  HIS  51           1HE      HIS  51  -6.657   0.303  16.075
  398    HE2  HIS  51           2HE      HIS  51  -4.309  -0.573  15.815
  399    HB2  HIS  51           2HB      HIS  51  -5.893  -0.118  11.081
  400    HB3  HIS  51           1HB      HIS  51  -7.279  -1.076  11.579
  401    HA   PRO  52           HA       PRO  52  -7.241  -6.085  11.940
  402    HB2  PRO  52           2HB      PRO  52  -8.975  -4.656  13.914
  403    HB3  PRO  52           1HB      PRO  52  -8.273  -6.277  13.994
  404    HG2  PRO  52           2HG      PRO  52  -7.163  -4.291  15.341
  405    HG3  PRO  52           1HG      PRO  52  -6.148  -5.473  14.500
  406    HD2  PRO  52           2HD      PRO  52  -6.798  -2.662  13.747
  407    HD3  PRO  52           1HD      PRO  52  -5.300  -3.574  13.493
  408    H    ASP  53           H        ASP  53  -8.891  -3.052  11.275
  409    HA   ASP  53           HA       ASP  53 -10.810  -4.597   9.713
  410    HB2  ASP  53           2HB      ASP  53 -11.788  -2.349  11.468
  411    HB3  ASP  53           1HB      ASP  53 -12.742  -3.540  10.589
  412    H    HIS  54           H        HIS  54  -8.608  -2.165   9.598
  413    HA   HIS  54           HA       HIS  54  -9.907  -1.185   7.202
  414    HD1  HIS  54           1HD      HIS  54  -7.251   1.947   8.804
  415    HD2  HIS  54           2HD      HIS  54  -9.928   0.212  11.464
  416    HE1  HIS  54           1HE      HIS  54  -6.365   2.485  11.094
  417    HE2  HIS  54           2HE      HIS  54  -8.090   1.566  12.680
  418    HB2  HIS  54           2HB      HIS  54  -9.452   1.197   7.721
  419    HB3  HIS  54           1HB      HIS  54 -10.666   0.466   8.757
  420    H    VAL  55           H        VAL  55  -8.460  -0.034   5.711
  421    HA   VAL  55           HA       VAL  55  -5.622  -0.351   6.297
  422    HB   VAL  55           HB       VAL  55  -6.738  -2.337   4.979
  423   HG11  VAL  55          1HG1      VAL  55  -7.023  -2.148   2.717
  424   HG12  VAL  55          2HG1      VAL  55  -5.935  -0.767   2.585
  425   HG13  VAL  55          3HG1      VAL  55  -7.556  -0.552   3.244
  426   HG21  VAL  55          3HG2      VAL  55  -4.622  -2.830   3.943
  427   HG22  VAL  55          1HG2      VAL  55  -4.354  -2.099   5.524
  428   HG23  VAL  55          2HG2      VAL  55  -4.138  -1.137   4.060
  429    H    LEU  56           H        LEU  56  -4.355   1.183   5.403
  430    HA   LEU  56           HA       LEU  56  -5.643   3.135   3.604
  431    HG   LEU  56           HG       LEU  56  -6.428   4.728   5.538
  432    HB2  LEU  56           2HB      LEU  56  -4.384   3.524   6.170
  433    HB3  LEU  56           1HB      LEU  56  -3.481   4.389   4.949
  434   HD11  LEU  56          1HD1      LEU  56  -4.271   6.743   6.049
  435   HD12  LEU  56          2HD1      LEU  56  -4.704   5.527   7.253
  436   HD13  LEU  56          3HD1      LEU  56  -5.913   6.680   6.690
  437   HD21  LEU  56          3HD2      LEU  56  -4.622   5.865   3.455
  438   HD22  LEU  56          1HD2      LEU  56  -5.860   6.901   4.159
  439   HD23  LEU  56          2HD2      LEU  56  -6.323   5.409   3.347
  440    H    MET  57           H        MET  57  -4.401   3.979   1.929
  441    HA   MET  57           HA       MET  57  -1.790   2.694   1.517
  442    HB2  MET  57           2HB      MET  57  -3.669   3.251  -0.753
  443    HB3  MET  57           1HB      MET  57  -2.292   2.156  -0.705
  444    HG2  MET  57           2HG      MET  57  -3.495   0.676   0.815
  445    HG3  MET  57           1HG      MET  57  -4.870   1.783   0.803
  446    HE1  MET  57           3HE      MET  57  -6.727   1.696  -0.655
  447    HE2  MET  57           1HE      MET  57  -6.732   0.024  -0.093
  448    HE3  MET  57           2HE      MET  57  -7.021   0.383  -1.796
  449    H    ILE  58           H        ILE  58  -0.249   4.231   1.536
  450    HA   ILE  58           HA       ILE  58  -0.830   6.771   0.173
  451    HB   ILE  58           HB       ILE  58   0.938   6.438   2.599
  452   HG12  ILE  58          2HG1      ILE  58  -1.916   6.625   2.457
  453   HG13  ILE  58          1HG1      ILE  58  -0.898   6.531   3.879
  454   HG21  ILE  58          1HG2      ILE  58   0.986   8.868   2.629
  455   HG22  ILE  58          2HG2      ILE  58  -0.043   8.915   1.196
  456   HG23  ILE  58          3HG2      ILE  58   1.586   8.242   1.093
  457   HD11  ILE  58          3HD1      ILE  58  -2.529   8.524   3.565
  458   HD12  ILE  58          1HD1      ILE  58  -1.259   9.160   2.518
  459   HD13  ILE  58          2HD1      ILE  58  -0.911   8.801   4.208
  460    H    LEU  59           H        LEU  59   0.734   7.510  -1.220
  461    HA   LEU  59           HA       LEU  59   3.217   5.936  -1.344
  462    HG   LEU  59           HG       LEU  59   1.516   6.892  -5.143
  463    HB2  LEU  59           2HB      LEU  59   3.175   5.866  -3.676
  464    HB3  LEU  59           1HB      LEU  59   1.539   5.482  -3.193
  465   HD11  LEU  59          1HD1      LEU  59   0.649   8.448  -2.728
  466   HD12  LEU  59          2HD1      LEU  59  -0.265   7.146  -3.485
  467   HD13  LEU  59          3HD1      LEU  59   0.050   8.637  -4.372
  468   HD21  LEU  59          3HD2      LEU  59   2.740   8.729  -5.486
  469   HD22  LEU  59          1HD2      LEU  59   3.742   8.102  -4.181
  470   HD23  LEU  59          2HD2      LEU  59   2.511   9.317  -3.845
  471    H    ASN  60           H        ASN  60   5.106   6.983  -1.902
  472    HA   ASN  60           HA       ASN  60   4.940   9.932  -1.973
  473    HB2  ASN  60           2HB      ASN  60   7.345   8.471  -0.903
  474    HB3  ASN  60           1HB      ASN  60   6.872  10.146  -0.644
  475   HD21  ASN  60          1HD2      ASN  60   5.705   6.848  -0.042
  476   HD22  ASN  60          2HD2      ASN  60   5.063   7.181   1.526
  477    H    SER  61           H        SER  61   5.173  10.324  -4.105
  478    HA   SER  61           HA       SER  61   7.652   9.314  -5.368
  479    HG   SER  61           HG       SER  61   5.049   7.016  -6.212
  480    HB2  SER  61           2HB      SER  61   5.285   9.330  -7.132
  481    HB3  SER  61           1HB      SER  61   6.622   8.186  -7.049
  482    HA   PRO  62           HA       PRO  62   7.828  13.504  -6.901
  483    HB2  PRO  62           2HB      PRO  62   9.901  13.272  -8.544
  484    HB3  PRO  62           1HB      PRO  62  10.079  13.110  -6.794
  485    HG2  PRO  62           2HG      PRO  62   9.872  10.958  -8.866
  486    HG3  PRO  62           1HG      PRO  62  11.024  11.102  -7.524
  487    HD2  PRO  62           2HD      PRO  62   8.790   9.565  -7.406
  488    HD3  PRO  62           1HD      PRO  62   9.507  10.329  -5.980
  489    H    ASP  63           H        ASP  63   6.838  10.854  -8.794
  490    HA   ASP  63           HA       ASP  63   5.900  12.721 -10.832
  491    HB2  ASP  63           2HB      ASP  63   7.797  11.956 -11.972
  492    HB3  ASP  63           1HB      ASP  63   7.645  10.325 -11.335
  493    H    GLU  64           H        GLU  64   3.892  12.094 -11.784
  494    HA   GLU  64           HA       GLU  64   2.243  10.461 -10.158
  495    HB2  GLU  64           2HB      GLU  64   1.849  11.693 -12.856
  496    HB3  GLU  64           1HB      GLU  64   0.789  10.374 -12.393
  497    HG2  GLU  64           2HG      GLU  64  -0.414  12.096 -11.567
  498    HG3  GLU  64           1HG      GLU  64   0.594  11.755 -10.157
  499    H    ASP  65           H        ASP  65   3.954   9.609 -13.197
  500    HA   ASP  65           HA       ASP  65   2.928   7.096 -13.655
  501    HB2  ASP  65           2HB      ASP  65   4.761   8.288 -14.948
  502    HB3  ASP  65           1HB      ASP  65   5.881   7.721 -13.710
  503    H    SER  66           H        SER  66   5.658   7.939 -11.564
  504    HA   SER  66           HA       SER  66   5.977   5.420 -10.341
  505    HG   SER  66           HG       SER  66   8.844   7.125  -9.705
  506    HB2  SER  66           2HB      SER  66   6.707   8.227  -9.512
  507    HB3  SER  66           1HB      SER  66   7.047   6.841  -8.474
  508    H    LEU  67           H        LEU  67   4.482   8.373  -9.198
  509    HA   LEU  67           HA       LEU  67   3.333   7.747  -6.850
  510    HG   LEU  67           HG       LEU  67   1.103   9.437  -6.436
  511    HB2  LEU  67           2HB      LEU  67   3.166   9.934  -7.714
  512    HB3  LEU  67           1HB      LEU  67   2.361   9.391  -9.157
  513   HD11  LEU  67          1HD1      LEU  67  -0.180  11.285  -7.974
  514   HD12  LEU  67          2HD1      LEU  67   1.513  11.501  -8.419
  515   HD13  LEU  67          3HD1      LEU  67   1.022  11.624  -6.730
  516   HD21  LEU  67          3HD2      LEU  67  -0.177   7.903  -7.574
  517   HD22  LEU  67          1HD2      LEU  67   0.136   8.655  -9.138
  518   HD23  LEU  67          2HD2      LEU  67  -0.982   9.409  -8.003
  519    H    ALA  68           H        ALA  68   1.561   7.314  -9.931
  520    HA   ALA  68           HA       ALA  68  -0.549   5.875  -8.711
  521    HB1  ALA  68           3HB      ALA  68   0.346   6.296 -11.538
  522    HB2  ALA  68           1HB      ALA  68  -1.154   6.786 -10.749
  523    HB3  ALA  68           2HB      ALA  68  -0.898   5.097 -11.183
  524    H    HIS  69           H        HIS  69   2.492   4.908 -10.203
  525    HA   HIS  69           HA       HIS  69   2.081   2.172 -10.451
  526    HD1  HIS  69           1HD      HIS  69   3.224   0.293  -9.815
  527    HD2  HIS  69           2HD      HIS  69   6.598   1.964 -11.575
  528    HE1  HIS  69           1HE      HIS  69   4.646  -1.655 -10.525
  529    HE2  HIS  69           2HE      HIS  69   6.640  -0.621 -11.666
  530    HB2  HIS  69           2HB      HIS  69   4.113   3.516 -11.189
  531    HB3  HIS  69           1HB      HIS  69   4.679   3.403  -9.526
  532    H    MET  70           H        MET  70   2.966   4.110  -7.654
  533    HA   MET  70           HA       MET  70   3.283   1.830  -5.919
  534    HB2  MET  70           2HB      MET  70   2.895   4.631  -4.935
  535    HB3  MET  70           1HB      MET  70   3.886   3.359  -4.244
  536    HG2  MET  70           2HG      MET  70   4.463   5.120  -6.588
  537    HG3  MET  70           1HG      MET  70   5.401   4.885  -5.119
  538    HE1  MET  70           3HE      MET  70   7.707   4.499  -7.032
  539    HE2  MET  70           1HE      MET  70   6.351   5.030  -8.026
  540    HE3  MET  70           2HE      MET  70   7.276   3.602  -8.488
  541    H    GLN  71           H        GLN  71   0.895   4.534  -5.950
  542    HA   GLN  71           HA       GLN  71  -0.772   3.459  -4.018
  543    HB2  GLN  71           2HB      GLN  71  -2.628   4.792  -5.299
  544    HB3  GLN  71           1HB      GLN  71  -1.375   5.627  -4.403
  545    HG2  GLN  71           2HG      GLN  71  -0.681   6.662  -6.233
  546    HG3  GLN  71           1HG      GLN  71  -0.608   5.159  -7.148
  547   HE21  GLN  71          1HE2      GLN  71  -2.113   8.102  -6.856
  548   HE22  GLN  71          2HE2      GLN  71  -3.509   7.792  -7.825
  549    H    ASN  72           H        ASN  72  -0.520   2.607  -7.385
  550    HA   ASN  72           HA       ASN  72  -3.023   1.166  -7.392
  551    HB2  ASN  72           2HB      ASN  72  -1.747   2.290  -9.403
  552    HB3  ASN  72           1HB      ASN  72  -0.926   0.732  -9.477
  553   HD21  ASN  72          1HD2      ASN  72  -2.532  -1.169  -9.291
  554   HD22  ASN  72          2HD2      ASN  72  -3.919  -1.059 -10.314
  555    H    VAL  73           H        VAL  73   0.429   0.323  -7.336
  556    HA   VAL  73           HA       VAL  73   0.354  -2.395  -7.531
  557    HB   VAL  73           HB       VAL  73   2.105  -0.553  -5.951
  558   HG11  VAL  73          1HG1      VAL  73   3.554  -2.497  -5.368
  559   HG12  VAL  73          2HG1      VAL  73   2.227  -3.562  -5.833
  560   HG13  VAL  73          3HG1      VAL  73   2.029  -2.442  -4.485
  561   HG21  VAL  73          3HG2      VAL  73   3.173  -2.526  -7.863
  562   HG22  VAL  73          1HG2      VAL  73   3.566  -0.820  -7.649
  563   HG23  VAL  73          2HG2      VAL  73   2.115  -1.286  -8.536
  564    H    VAL  74           H        VAL  74  -0.402  -0.458  -4.672
  565    HA   VAL  74           HA       VAL  74  -0.745  -2.688  -2.930
  566    HB   VAL  74           HB       VAL  74  -1.803   0.129  -2.687
  567   HG11  VAL  74          1HG1      VAL  74  -1.587  -1.950  -0.515
  568   HG12  VAL  74          2HG1      VAL  74  -3.085  -1.538  -1.349
  569   HG13  VAL  74          3HG1      VAL  74  -2.255  -0.326  -0.376
  570   HG21  VAL  74          3HG2      VAL  74   0.805  -1.028  -2.275
  571   HG22  VAL  74          1HG2      VAL  74   0.177  -0.354  -0.771
  572   HG23  VAL  74          2HG2      VAL  74   0.305   0.662  -2.205
  573    H    ALA  75           H        ALA  75  -3.059  -0.652  -4.757
  574    HA   ALA  75           HA       ALA  75  -5.441  -1.731  -3.906
  575    HB1  ALA  75           3HB      ALA  75  -5.406   0.128  -5.444
  576    HB2  ALA  75           1HB      ALA  75  -6.336  -1.189  -6.157
  577    HB3  ALA  75           2HB      ALA  75  -4.689  -0.878  -6.703
  578    H    ASP  76           H        ASP  76  -2.976  -3.129  -5.878
  579    HA   ASP  76           HA       ASP  76  -4.549  -5.299  -6.896
  580    HB2  ASP  76           2HB      ASP  76  -2.434  -4.370  -7.948
  581    HB3  ASP  76           1HB      ASP  76  -1.541  -5.197  -6.676
  582    H    HIS  77           H        HIS  77  -2.278  -4.855  -4.222
  583    HA   HIS  77           HA       HIS  77  -2.150  -7.531  -3.387
  584    HD1  HIS  77           1HD      HIS  77  -0.566  -6.349  -4.726
  585    HD2  HIS  77           2HD      HIS  77   1.050  -4.552  -1.346
  586    HE1  HIS  77           1HE      HIS  77   1.689  -5.490  -5.434
  587    HE2  HIS  77           2HE      HIS  77   2.613  -4.334  -3.395
  588    HB2  HIS  77           2HB      HIS  77  -1.872  -5.097  -1.620
  589    HB3  HIS  77           1HB      HIS  77  -1.212  -6.696  -1.331
  590    H    LEU  78           H        LEU  78  -4.392  -4.938  -2.445
  591    HA   LEU  78           HA       LEU  78  -5.683  -6.384  -0.397
  592    HG   LEU  78           HG       LEU  78  -4.957  -3.168  -0.661
  593    HB2  LEU  78           2HB      LEU  78  -6.588  -4.063  -2.096
  594    HB3  LEU  78           1HB      LEU  78  -7.536  -4.708  -0.774
  595   HD11  LEU  78          1HD1      LEU  78  -6.168  -1.756   0.818
  596   HD12  LEU  78          2HD1      LEU  78  -7.504  -2.902   0.919
  597   HD13  LEU  78          3HD1      LEU  78  -7.189  -2.047  -0.590
  598   HD21  LEU  78          3HD2      LEU  78  -6.031  -5.107   1.359
  599   HD22  LEU  78          1HD2      LEU  78  -5.104  -3.695   1.859
  600   HD23  LEU  78          2HD2      LEU  78  -4.374  -4.896   0.795
  601    H    GLN  79           H        GLN  79  -5.912  -6.548  -3.834
  602    HA   GLN  79           HA       GLN  79  -8.563  -7.537  -4.024
  603    HB2  GLN  79           2HB      GLN  79  -6.313  -8.085  -5.954
  604    HB3  GLN  79           1HB      GLN  79  -8.038  -8.108  -6.290
  605    HG2  GLN  79           2HG      GLN  79  -7.464  -5.553  -5.279
  606    HG3  GLN  79           1HG      GLN  79  -6.189  -5.936  -6.431
  607   HE21  GLN  79          1HE2      GLN  79  -7.703  -7.566  -8.158
  608   HE22  GLN  79          2HE2      GLN  79  -8.831  -6.559  -8.991
  609    H    ARG  80           H        ARG  80  -5.483  -9.309  -4.430
  610    HA   ARG  80           HA       ARG  80  -6.571 -11.850  -4.512
  611    HE   ARG  80           HE       ARG  80  -1.733  -9.748  -1.240
  612    HB2  ARG  80           2HB      ARG  80  -4.268 -12.544  -3.514
  613    HB3  ARG  80           1HB      ARG  80  -4.347 -11.812  -5.110
  614    HG2  ARG  80           2HG      ARG  80  -3.030 -10.159  -4.480
  615    HG3  ARG  80           1HG      ARG  80  -4.074  -9.774  -3.111
  616    HD2  ARG  80           2HD      ARG  80  -2.975 -11.576  -1.821
  617    HD3  ARG  80           1HD      ARG  80  -1.886 -11.851  -3.180
  618   HH11  ARG  80          1HH1      ARG  80  -0.940 -10.646  -4.517
  619   HH12  ARG  80          2HH1      ARG  80   0.376  -9.527  -4.638
  620   HH21  ARG  80          1HH2      ARG  80  -0.002  -8.276  -1.396
  621   HH22  ARG  80          2HH2      ARG  80   0.909  -8.181  -2.867
  622    H    MET  81           H        MET  81  -5.884  -9.849  -1.716
  623    HA   MET  81           HA       MET  81  -6.309 -12.021   0.135
  624    HB2  MET  81           2HB      MET  81  -6.012 -10.366   1.882
  625    HB3  MET  81           1HB      MET  81  -4.752 -10.221   0.675
  626    HG2  MET  81           2HG      MET  81  -5.353  -8.032   1.259
  627    HG3  MET  81           1HG      MET  81  -6.067  -8.325  -0.322
  628    HE1  MET  81           3HE      MET  81  -6.192  -6.694   2.510
  629    HE2  MET  81           1HE      MET  81  -7.537  -7.159   3.550
  630    HE3  MET  81           2HE      MET  81  -7.767  -5.932   2.305
  631    H    ALA  82           H        ALA  82  -8.342  -9.979  -1.621
  632    HA   ALA  82           HA       ALA  82 -10.545 -10.438   0.295
  633    HB1  ALA  82           3HB      ALA  82  -9.894  -8.040  -0.152
  634    HB2  ALA  82           1HB      ALA  82 -11.590  -8.442  -0.421
  635    HB3  ALA  82           2HB      ALA  82 -10.495  -8.272  -1.793
  636    H    ASN  83           H        ASN  83 -12.667  -9.827  -1.360
  637    HA   ASN  83           HA       ASN  83 -13.206 -12.247  -2.609
  638    HB2  ASN  83           2HB      ASN  83 -14.512  -9.670  -2.327
  639    HB3  ASN  83           1HB      ASN  83 -14.838 -10.386  -3.901
  640   HD21  ASN  83          1HD2      ASN  83 -15.657 -12.594  -3.918
  641   HD22  ASN  83          2HD2      ASN  83 -16.678 -13.115  -2.626
  642    H    SER  84           H        SER  84 -14.224 -11.843  -5.087
  643    HA   SER  84           HA       SER  84 -11.825 -11.766  -6.693
  644    HG   SER  84           HG       SER  84 -12.150 -13.683  -8.012
  645    HB2  SER  84           2HB      SER  84 -14.049 -13.289  -6.843
  646    HB3  SER  84           1HB      SER  84 -14.462 -12.038  -8.016
  647    H    GLU  85           H        GLU  85 -14.400  -9.612  -5.919
  648    HA   GLU  85           HA       GLU  85 -14.527  -8.033  -8.216
  649    HB2  GLU  85           2HB      GLU  85 -15.359  -6.251  -6.744
  650    HB3  GLU  85           1HB      GLU  85 -16.110  -7.797  -6.375
  651    HG2  GLU  85           2HG      GLU  85 -14.079  -7.888  -4.643
  652    HG3  GLU  85           1HG      GLU  85 -14.280  -6.140  -4.759
  653    H    SER  86           H        SER  86 -13.465  -6.129  -8.846
  654    HA   SER  86           HA       SER  86 -10.680  -6.075  -8.281
  655    HG   SER  86           HG       SER  86  -9.920  -5.423 -10.515
  656    HB2  SER  86           2HB      SER  86 -12.551  -4.524  -9.994
  657    HB3  SER  86           1HB      SER  86 -11.026  -3.746  -9.569
  658    H    LEU  87           H        LEU  87 -11.043  -5.893  -5.916
  659    HA   LEU  87           HA       LEU  87 -11.516  -4.638  -3.971
  660    HG   LEU  87           HG       LEU  87  -8.094  -4.727  -3.083
  661    HB2  LEU  87           2HB      LEU  87  -8.923  -4.311  -5.136
  662    HB3  LEU  87           1HB      LEU  87  -9.385  -2.799  -4.386
  663   HD11  LEU  87          1HD1      LEU  87  -9.208  -3.734  -0.984
  664   HD12  LEU  87          2HD1      LEU  87 -10.107  -2.729  -2.119
  665   HD13  LEU  87          3HD1      LEU  87  -8.345  -2.649  -2.073
  666   HD21  LEU  87          3HD2      LEU  87  -9.521  -6.038  -1.692
  667   HD22  LEU  87          1HD2      LEU  87  -9.995  -6.329  -3.363
  668   HD23  LEU  87          2HD2      LEU  87 -10.965  -5.268  -2.342
  669    H    GLU  88           H        GLU  88 -13.174  -3.285  -3.654
  670    HA   GLU  88           HA       GLU  88 -13.560  -0.934  -5.234
  671    HB2  GLU  88           2HB      GLU  88 -14.765  -1.933  -2.652
  672    HB3  GLU  88           1HB      GLU  88 -15.182  -0.359  -3.316
  673    HG2  GLU  88           2HG      GLU  88 -16.807  -1.433  -4.387
  674    HG3  GLU  88           1HG      GLU  88 -15.536  -2.003  -5.469
  675    H    ILE  89           H        ILE  89 -11.804   0.413  -5.143
  676    HA   ILE  89           HA       ILE  89 -11.220   1.566  -2.517
  677    HB   ILE  89           HB       ILE  89  -8.885   1.451  -2.740
  678   HG12  ILE  89          2HG1      ILE  89  -8.956   2.053  -5.267
  679   HG13  ILE  89          1HG1      ILE  89  -7.635   1.062  -4.677
  680   HG21  ILE  89          1HG2      ILE  89 -10.124  -1.096  -3.709
  681   HG22  ILE  89          2HG2      ILE  89  -9.649  -0.661  -2.069
  682   HG23  ILE  89          3HG2      ILE  89  -8.417  -0.959  -3.293
  683   HD11  ILE  89          3HD1      ILE  89  -8.489   0.233  -6.788
  684   HD12  ILE  89          1HD1      ILE  89 -10.093   0.045  -6.080
  685   HD13  ILE  89          2HD1      ILE  89  -8.749  -0.938  -5.494
  686    H    ALA  90           H        ALA  90 -11.238   3.794  -2.524
  687    HA   ALA  90           HA       ALA  90 -11.379   5.066  -5.162
  688    HB1  ALA  90           3HB      ALA  90 -13.124   5.545  -3.365
  689    HB2  ALA  90           1HB      ALA  90 -12.377   6.942  -4.139
  690    HB3  ALA  90           2HB      ALA  90 -11.859   6.449  -2.529
  691    H    TRP  91           H        TRP  91  -9.492   5.634  -5.955
  692    HA   TRP  91           HA       TRP  91  -7.323   6.406  -4.167
  693    HD1  TRP  91           HD       TRP  91  -8.845   4.350  -7.702
  694    HE1  TRP  91           1HE      TRP  91  -9.176   5.199 -10.110
  695    HE3  TRP  91           3HE      TRP  91  -5.485   8.203  -7.676
  696    HZ2  TRP  91           2HZ      TRP  91  -8.150   7.232 -11.777
  697    HZ3  TRP  91           3HZ      TRP  91  -5.220   9.550  -9.717
  698    HH2  TRP  91           HH       TRP  91  -6.525   9.074 -11.724
  699    HB2  TRP  91           2HB      TRP  91  -5.889   6.245  -6.146
  700    HB3  TRP  91           1HB      TRP  91  -6.836   4.775  -5.934
  701    H    GLN  92           H        GLN  92  -6.576   8.414  -3.945
  702    HA   GLN  92           HA       GLN  92  -8.019  10.555  -5.286
  703    HB2  GLN  92           2HB      GLN  92  -6.010  10.551  -3.030
  704    HB3  GLN  92           1HB      GLN  92  -6.691  12.020  -3.715
  705    HG2  GLN  92           2HG      GLN  92  -8.961  11.111  -3.139
  706    HG3  GLN  92           1HG      GLN  92  -8.135   9.836  -2.244
  707   HE21  GLN  92          1HE2      GLN  92  -6.626  10.557  -0.552
  708   HE22  GLN  92          2HE2      GLN  92  -7.029  11.969   0.358
  709    HA   PRO  93           HA       PRO  93  -5.191  11.628  -8.477
  710    HB2  PRO  93           2HB      PRO  93  -5.160  14.313  -7.184
  711    HB3  PRO  93           1HB      PRO  93  -5.391  13.893  -8.885
  712    HG2  PRO  93           2HG      PRO  93  -7.470  14.567  -7.361
  713    HG3  PRO  93           1HG      PRO  93  -7.606  13.278  -8.571
  714    HD2  PRO  93           2HD      PRO  93  -7.455  13.088  -5.612
  715    HD3  PRO  93           1HD      PRO  93  -8.247  12.008  -6.776
  716    H    ALA  94           H        ALA  94  -4.451  12.827  -5.228
  717    HA   ALA  94           HA       ALA  94  -2.484  12.365  -4.037
  718    HB1  ALA  94           3HB      ALA  94  -0.565  11.492  -4.959
  719    HB2  ALA  94           1HB      ALA  94  -0.789  12.355  -6.479
  720    HB3  ALA  94           2HB      ALA  94  -1.761  10.929  -6.130
  721    H    GLU  95           H        GLU  95  -2.689  14.494  -6.803
  722    HA   GLU  95           HA       GLU  95  -1.374  16.588  -5.209
  723    HB2  GLU  95           2HB      GLU  95   0.016  15.596  -7.150
  724    HB3  GLU  95           1HB      GLU  95  -1.098  16.460  -8.200
  725    HG2  GLU  95           2HG      GLU  95   0.993  17.689  -7.751
  726    HG3  GLU  95           1HG      GLU  95  -0.457  18.564  -7.256
  727    H    SER  96           H        SER  96  -1.938  18.803  -5.941
  728    HA   SER  96           HA       SER  96  -4.765  18.889  -6.724
  729    HG   SER  96           HG       SER  96  -2.398  21.548  -5.733
  730    HB2  SER  96           2HB      SER  96  -4.608  21.265  -5.794
  731    HB3  SER  96           1HB      SER  96  -4.457  19.951  -4.625
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1   6.912  13.522  -4.748
    2    HB2  MET   1           2HB      MET   1   7.504  13.764  -2.413
    3    HB3  MET   1           1HB      MET   1   8.820  14.323  -3.439
    4    HG2  MET   1           2HG      MET   1   6.978  16.447  -2.679
    5    HG3  MET   1           1HG      MET   1   7.748  15.666  -1.302
    6    HE1  MET   1           3HE      MET   1  10.519  15.806  -0.864
    7    HE2  MET   1           1HE      MET   1  11.544  16.037  -2.281
    8    HE3  MET   1           2HE      MET   1  10.374  14.718  -2.246
    9    H    PHE   2           H        PHE   2   4.830  13.607  -5.369
   10    HA   PHE   2           HA       PHE   2   2.948  15.298  -3.898
   11    HD1  PHE   2           2HD      PHE   2   3.490  16.743  -6.248
   12    HD2  PHE   2           1HD      PHE   2   2.980  12.838  -7.869
   13    HE1  PHE   2           2HE      PHE   2   4.828  17.386  -8.209
   14    HE2  PHE   2           1HE      PHE   2   4.309  13.480  -9.833
   15    HZ   PHE   2           HZ       PHE   2   5.237  15.754 -10.007
   16    HB2  PHE   2           2HB      PHE   2   1.925  13.373  -5.909
   17    HB3  PHE   2           1HB      PHE   2   1.503  15.061  -5.659
   18    H    ARG   3           H        ARG   3   0.802  14.061  -3.231
   19    HA   ARG   3           HA       ARG   3   1.390  11.329  -2.448
   20    HE   ARG   3           HE       ARG   3   4.545  10.733   1.645
   21    HB2  ARG   3           2HB      ARG   3   1.863  13.405  -0.609
   22    HB3  ARG   3           1HB      ARG   3   0.371  12.629  -0.088
   23    HG2  ARG   3           2HG      ARG   3   1.690  11.158   0.926
   24    HG3  ARG   3           1HG      ARG   3   1.980  10.497  -0.669
   25    HD2  ARG   3           2HD      ARG   3   4.123  11.084  -0.578
   26    HD3  ARG   3           1HD      ARG   3   3.695  12.753  -0.213
   27   HH11  ARG   3          1HH1      ARG   3   2.795  13.730   1.277
   28   HH12  ARG   3          2HH1      ARG   3   3.007  14.202   2.929
   29   HH21  ARG   3          1HH2      ARG   3   4.826  11.353   3.819
   30   HH22  ARG   3          2HH2      ARG   3   4.161  12.854   4.372
   31    H    SER   4           H        SER   4  -0.311  10.086  -2.625
   32    HA   SER   4           HA       SER   4  -3.021  11.227  -2.515
   33    HG   SER   4           HG       SER   4  -4.352   8.934  -4.591
   34    HB2  SER   4           2HB      SER   4  -3.002  10.518  -4.715
   35    HB3  SER   4           1HB      SER   4  -1.738   9.323  -4.423
   36    H    THR   5           H        THR   5  -4.690   9.553  -1.829
   37    HA   THR   5           HA       THR   5  -3.551   7.390  -0.256
   38    HB   THR   5           HB       THR   5  -4.613   8.001   1.813
   39    HG1  THR   5           1HG      THR   5  -6.441   9.013   1.347
   40   HG21  THR   5          3HG2      THR   5  -2.430   9.261   1.101
   41   HG22  THR   5          1HG2      THR   5  -3.321   9.732   2.547
   42   HG23  THR   5          2HG2      THR   5  -3.507  10.658   1.060
   43    H    SER   6           H        SER   6  -4.702   5.597  -0.316
   44    HA   SER   6           HA       SER   6  -7.496   5.782  -1.257
   45    HG   SER   6           HG       SER   6  -7.420   3.303  -3.351
   46    HB2  SER   6           2HB      SER   6  -5.856   4.597  -2.768
   47    HB3  SER   6           1HB      SER   6  -5.664   3.385  -1.501
   48    H    HIS   7           H        HIS   7  -9.041   5.182   0.135
   49    HA   HIS   7           HA       HIS   7  -8.244   3.644   2.521
   50    HD1  HIS   7           1HD      HIS   7 -12.307   3.900   3.258
   51    HD2  HIS   7           2HD      HIS   7 -11.055   7.036   0.835
   52    HE1  HIS   7           1HE      HIS   7 -14.388   4.754   2.131
   53    HE2  HIS   7           2HE      HIS   7 -13.592   6.590   0.602
   54    HB2  HIS   7           2HB      HIS   7  -9.900   4.756   3.754
   55    HB3  HIS   7           1HB      HIS   7  -9.259   6.011   2.702
   56    H    VAL   8           H        VAL   8  -9.125   1.685   2.948
   57    HA   VAL   8           HA       VAL   8 -11.555   0.872   1.518
   58    HB   VAL   8           HB       VAL   8  -9.276  -1.070   1.708
   59   HG11  VAL   8          1HG1      VAL   8 -11.588  -1.825   1.181
   60   HG12  VAL   8          2HG1      VAL   8 -10.407  -2.199  -0.074
   61   HG13  VAL   8          3HG1      VAL   8 -11.523  -0.850  -0.288
   62   HG21  VAL   8          3HG2      VAL   8  -8.420  -0.480  -0.417
   63   HG22  VAL   8          1HG2      VAL   8  -8.498   1.013   0.519
   64   HG23  VAL   8          2HG2      VAL   8  -9.723   0.672  -0.704
   65    H    ARG   9           H        ARG   9 -12.690  -0.911   2.531
   66    HA   ARG   9           HA       ARG   9 -11.972  -1.150   5.366
   67    HE   ARG   9           HE       ARG   9 -13.808   0.869   2.805
   68    HB2  ARG   9           2HB      ARG   9 -14.567  -1.318   3.907
   69    HB3  ARG   9           1HB      ARG   9 -14.383  -2.236   5.394
   70    HG2  ARG   9           2HG      ARG   9 -15.373  -0.108   5.893
   71    HG3  ARG   9           1HG      ARG   9 -13.739  -0.164   6.563
   72    HD2  ARG   9           2HD      ARG   9 -14.397   1.980   5.389
   73    HD3  ARG   9           1HD      ARG   9 -12.886   1.234   4.871
   74   HH11  ARG   9          1HH1      ARG   9 -16.345   1.700   5.053
   75   HH12  ARG   9          2HH1      ARG   9 -17.557   1.847   3.823
   76   HH21  ARG   9          1HH2      ARG   9 -15.400   1.063   1.187
   77   HH22  ARG   9          2HH2      ARG   9 -17.020   1.485   1.630
   78    H    THR  10           H        THR  10 -10.663  -2.835   5.694
   79    HA   THR  10           HA       THR  10 -11.471  -5.447   4.609
   80    HB   THR  10           HB       THR  10  -9.206  -4.041   3.830
   81    HG1  THR  10           1HG      THR  10  -9.448  -5.570   2.441
   82   HG21  THR  10          3HG2      THR  10  -8.327  -4.903   6.145
   83   HG22  THR  10          1HG2      THR  10  -7.314  -4.946   4.696
   84   HG23  THR  10          2HG2      THR  10  -8.133  -6.411   5.244
   85    H    GLU  11           H        GLU  11 -10.748  -7.314   5.872
   86    HA   GLU  11           HA       GLU  11 -10.488  -6.619   8.721
   87    HB2  GLU  11           2HB      GLU  11 -12.141  -8.465   7.325
   88    HB3  GLU  11           1HB      GLU  11 -11.064  -9.387   8.366
   89    HG2  GLU  11           2HG      GLU  11 -12.189  -8.806  10.183
   90    HG3  GLU  11           1HG      GLU  11 -12.137  -7.098   9.745
   91    H    SER  12           H        SER  12  -8.926  -7.593  10.044
   92    HA   SER  12           HA       SER  12  -6.898  -8.442  10.585
   93    HG   SER  12           HG       SER  12  -5.972 -11.616   8.993
   94    HB2  SER  12           2HB      SER  12  -7.788 -10.585  10.139
   95    HB3  SER  12           1HB      SER  12  -7.698 -10.350   8.394
   96    H    ALA  13           H        ALA  13  -7.138  -6.334   8.567
   97    HA   ALA  13           HA       ALA  13  -5.375  -6.466   6.446
   98    HB1  ALA  13           3HB      ALA  13  -5.250  -4.108   6.504
   99    HB2  ALA  13           1HB      ALA  13  -5.621  -4.090   8.221
  100    HB3  ALA  13           2HB      ALA  13  -6.861  -4.547   7.065
  101    H    ALA  14           H        ALA  14  -4.535  -5.357   9.711
  102    HA   ALA  14           HA       ALA  14  -1.925  -4.696   9.427
  103    HB1  ALA  14           3HB      ALA  14  -1.594  -5.250  11.758
  104    HB2  ALA  14           1HB      ALA  14  -3.041  -6.261  11.743
  105    HB3  ALA  14           2HB      ALA  14  -3.179  -4.518  11.503
  106    H    ARG  15           H        ARG  15  -3.089  -7.966   9.114
  107    HA   ARG  15           HA       ARG  15  -0.527  -9.181   9.594
  108    HE   ARG  15           HE       ARG  15   0.860 -13.552   9.024
  109    HB2  ARG  15           2HB      ARG  15  -2.917 -10.221   9.779
  110    HB3  ARG  15           1HB      ARG  15  -2.720 -10.514   8.061
  111    HG2  ARG  15           2HG      ARG  15  -1.479 -11.848  10.362
  112    HG3  ARG  15           1HG      ARG  15  -1.921 -12.478   8.779
  113    HD2  ARG  15           2HD      ARG  15   0.092 -11.733   7.801
  114    HD3  ARG  15           1HD      ARG  15   0.460 -10.678   9.163
  115   HH11  ARG  15          1HH1      ARG  15   0.847 -10.673  11.004
  116   HH12  ARG  15          2HH1      ARG  15   1.837 -11.372  12.240
  117   HH21  ARG  15          1HH2      ARG  15   2.157 -14.467  10.652
  118   HH22  ARG  15          2HH2      ARG  15   2.579 -13.523  12.042
  119    H    TYR  16           H        TYR  16  -2.372  -8.377   6.643
  120    HA   TYR  16           HA       TYR  16  -0.439  -9.561   4.962
  121    HD1  TYR  16           2HD      TYR  16  -1.541 -11.005   3.692
  122    HD2  TYR  16           1HD      TYR  16  -4.661  -8.162   4.210
  123    HE1  TYR  16           2HE      TYR  16  -3.202 -12.800   3.507
  124    HE2  TYR  16           1HE      TYR  16  -6.330  -9.952   4.032
  125    HH   TYR  16           HH       TYR  16  -5.705 -12.930   2.809
  126    HB2  TYR  16           2HB      TYR  16  -2.491  -7.422   4.351
  127    HB3  TYR  16           1HB      TYR  16  -1.484  -8.202   3.136
  128    H    VAL  17           H        VAL  17  -0.829  -6.327   6.297
  129    HA   VAL  17           HA       VAL  17   1.242  -5.079   4.850
  130    HB   VAL  17           HB       VAL  17   0.029  -4.523   7.532
  131   HG11  VAL  17          1HG1      VAL  17   2.010  -3.754   8.315
  132   HG12  VAL  17          2HG1      VAL  17   1.685  -2.397   7.244
  133   HG13  VAL  17          3HG1      VAL  17   2.736  -3.701   6.707
  134   HG21  VAL  17          3HG2      VAL  17  -1.012  -3.744   5.445
  135   HG22  VAL  17          1HG2      VAL  17   0.447  -2.815   5.099
  136   HG23  VAL  17          2HG2      VAL  17  -0.530  -2.423   6.512
  137    H    ASN  18           H        ASN  18   1.259  -6.997   7.808
  138    HA   ASN  18           HA       ASN  18   4.074  -6.805   8.190
  139    HB2  ASN  18           2HB      ASN  18   1.994  -8.673   9.330
  140    HB3  ASN  18           1HB      ASN  18   3.689  -8.705   9.806
  141   HD21  ASN  18          1HD2      ASN  18   1.977  -8.320  11.763
  142   HD22  ASN  18          2HD2      ASN  18   1.958  -6.675  12.290
  143    H    ARG  19           H        ARG  19   1.945  -9.080   6.486
  144    HA   ARG  19           HA       ARG  19   4.104 -10.953   6.083
  145    HE   ARG  19           HE       ARG  19   1.254 -15.468   6.564
  146    HB2  ARG  19           2HB      ARG  19   1.367 -11.161   6.120
  147    HB3  ARG  19           1HB      ARG  19   1.736 -11.297   4.406
  148    HG2  ARG  19           2HG      ARG  19   2.259 -13.419   4.721
  149    HG3  ARG  19           1HG      ARG  19   3.600 -12.905   5.743
  150    HD2  ARG  19           2HD      ARG  19   2.279 -13.037   7.703
  151    HD3  ARG  19           1HD      ARG  19   0.795 -13.232   6.768
  152   HH11  ARG  19          1HH1      ARG  19   4.124 -13.816   7.666
  153   HH12  ARG  19          2HH1      ARG  19   4.996 -15.280   7.982
  154   HH21  ARG  19          1HH2      ARG  19   2.397 -17.393   6.981
  155   HH22  ARG  19          2HH2      ARG  19   4.016 -17.310   7.593
  156    H    LEU  20           H        LEU  20   2.821  -8.257   4.303
  157    HA   LEU  20           HA       LEU  20   3.625  -9.065   1.723
  158    HG   LEU  20           HG       LEU  20   1.098  -7.317   2.903
  159    HB2  LEU  20           2HB      LEU  20   3.222  -6.310   2.867
  160    HB3  LEU  20           1HB      LEU  20   3.456  -6.646   1.164
  161   HD11  LEU  20          1HD1      LEU  20   0.117  -6.320   0.615
  162   HD12  LEU  20          2HD1      LEU  20   1.698  -5.540   0.621
  163   HD13  LEU  20          3HD1      LEU  20   0.595  -5.308   1.980
  164   HD21  LEU  20          3HD2      LEU  20   1.383  -9.361   1.755
  165   HD22  LEU  20          1HD2      LEU  20   1.838  -8.552   0.254
  166   HD23  LEU  20          2HD2      LEU  20   0.176  -8.466   0.835
  167    H    CYS  21           H        CYS  21   5.240  -7.018   4.150
  168    HA   CYS  21           HA       CYS  21   7.478  -6.347   2.635
  169    HG   CYS  21           HG       CYS  21   6.135  -7.517   5.998
  170    HB2  CYS  21           2HB      CYS  21   8.649  -6.181   4.895
  171    HB3  CYS  21           1HB      CYS  21   7.188  -5.219   4.700
  172    H    LYS  22           H        LYS  22   6.857  -9.180   4.638
  173    HA   LYS  22           HA       LYS  22   9.430 -10.353   4.161
  174    HB2  LYS  22           2HB      LYS  22   6.876 -11.579   5.214
  175    HB3  LYS  22           1HB      LYS  22   8.452 -12.359   5.224
  176    HG2  LYS  22           2HG      LYS  22   9.135 -11.234   7.038
  177    HG3  LYS  22           1HG      LYS  22   8.406  -9.720   6.505
  178    HD2  LYS  22           2HD      LYS  22   7.227 -10.336   8.453
  179    HD3  LYS  22           1HD      LYS  22   6.166 -10.761   7.107
  180    HE2  LYS  22           2HE      LYS  22   6.098 -12.591   8.583
  181    HE3  LYS  22           1HE      LYS  22   7.133 -13.083   7.243
  182    HZ1  LYS  22           3HZ      LYS  22   9.056 -12.762   8.556
  183    HZ2  LYS  22           1HZ      LYS  22   7.976 -13.643   9.515
  184    HZ3  LYS  22           2HZ      LYS  22   8.192 -11.988   9.786
  185    H    HIS  23           H        HIS  23   6.456 -10.193   2.476
  186    HA   HIS  23           HA       HIS  23   6.886 -12.585   0.914
  187    HD1  HIS  23           1HD      HIS  23   2.897 -13.168   0.580
  188    HD2  HIS  23           2HD      HIS  23   5.891 -12.186  -2.127
  189    HE1  HIS  23           1HE      HIS  23   2.419 -14.536  -1.475
  190    HE2  HIS  23           2HE      HIS  23   4.294 -13.990  -3.067
  191    HB2  HIS  23           2HB      HIS  23   4.608 -11.680   1.583
  192    HB3  HIS  23           1HB      HIS  23   4.855 -10.426   0.372
  193    H    TRP  24           H        TRP  24   6.421  -9.153  -0.049
  194    HA   TRP  24           HA       TRP  24   7.723  -9.672  -2.570
  195    HD1  TRP  24           HD       TRP  24   4.524  -9.047  -1.026
  196    HE1  TRP  24           1HE      TRP  24   2.564  -9.354  -2.667
  197    HE3  TRP  24           3HE      TRP  24   6.619  -6.956  -5.194
  198    HZ2  TRP  24           2HZ      TRP  24   1.983  -8.785  -5.370
  199    HZ3  TRP  24           3HZ      TRP  24   5.295  -6.876  -7.267
  200    HH2  TRP  24           HH       TRP  24   3.025  -7.773  -7.351
  201    HB2  TRP  24           2HB      TRP  24   6.683  -7.126  -1.317
  202    HB3  TRP  24           1HB      TRP  24   7.381  -7.215  -2.930
  203    H    GLY  25           H        GLY  25   8.846  -8.896   0.555
  204    HA2  GLY  25           2HA      GLY  25  11.025  -7.206  -0.134
  205    HA3  GLY  25           1HA      GLY  25  10.858  -8.128   1.348
  206    H    HIS  26           H        HIS  26  11.457  -8.744  -2.110
  207    HA   HIS  26           HA       HIS  26  13.456 -10.744  -1.292
  208    HD1  HIS  26           1HD      HIS  26  12.261 -12.273  -0.541
  209    HD2  HIS  26           2HD      HIS  26  12.355 -13.802  -4.403
  210    HE1  HIS  26           1HE      HIS  26  12.207 -14.773  -0.275
  211    HE2  HIS  26           2HE      HIS  26  12.355 -15.678  -2.622
  212    HB2  HIS  26           2HB      HIS  26  11.347 -10.796  -3.270
  213    HB3  HIS  26           1HB      HIS  26  12.909 -11.087  -4.028
  214    H    LYS  27           H        LYS  27  12.890  -7.824  -3.072
  215    HA   LYS  27           HA       LYS  27  15.762  -7.504  -3.457
  216    HB2  LYS  27           2HB      LYS  27  15.179  -8.637  -5.506
  217    HB3  LYS  27           1HB      LYS  27  13.794  -7.589  -5.758
  218    HG2  LYS  27           2HG      LYS  27  16.321  -6.132  -5.593
  219    HG3  LYS  27           1HG      LYS  27  16.261  -7.301  -6.913
  220    HD2  LYS  27           2HD      LYS  27  13.937  -5.482  -6.476
  221    HD3  LYS  27           1HD      LYS  27  15.391  -4.847  -7.246
  222    HE2  LYS  27           2HE      LYS  27  14.793  -7.346  -8.447
  223    HE3  LYS  27           1HE      LYS  27  13.301  -6.407  -8.387
  224    HZ1  LYS  27           3HZ      LYS  27  14.975  -4.554  -9.251
  225    HZ2  LYS  27           1HZ      LYS  27  14.139  -5.586 -10.299
  226    HZ3  LYS  27           2HZ      LYS  27  15.746  -5.917  -9.890
  227    H    PHE  28           H        PHE  28  13.445  -6.256  -1.983
  228    HA   PHE  28           HA       PHE  28  14.015  -3.510  -2.791
  229    HD1  PHE  28           2HD      PHE  28  12.229  -1.576  -4.106
  230    HD2  PHE  28           1HD      PHE  28  11.401  -5.713  -4.688
  231    HE1  PHE  28           2HE      PHE  28  12.085  -1.210  -6.533
  232    HE2  PHE  28           1HE      PHE  28  11.256  -5.348  -7.116
  233    HZ   PHE  28           HZ       PHE  28  11.597  -3.093  -8.042
  234    HB2  PHE  28           2HB      PHE  28  11.290  -4.742  -2.508
  235    HB3  PHE  28           1HB      PHE  28  11.536  -3.017  -2.257
  236    H    GLU  29           H        GLU  29  13.588  -1.939  -1.143
  237    HA   GLU  29           HA       GLU  29  14.300  -2.934   1.467
  238    HB2  GLU  29           2HB      GLU  29  14.105  -0.431   2.048
  239    HB3  GLU  29           1HB      GLU  29  15.373  -0.923   0.935
  240    HG2  GLU  29           2HG      GLU  29  12.826  -0.191  -0.323
  241    HG3  GLU  29           1HG      GLU  29  13.666   1.118   0.508
  242    H    VAL  30           H        VAL  30  12.643  -4.013   2.419
  243    HA   VAL  30           HA       VAL  30  10.081  -2.592   2.653
  244    HB   VAL  30           HB       VAL  30   9.378  -5.043   3.454
  245   HG11  VAL  30          1HG1      VAL  30   8.132  -4.050   1.769
  246   HG12  VAL  30          2HG1      VAL  30   8.794  -5.490   0.998
  247   HG13  VAL  30          3HG1      VAL  30   9.519  -3.914   0.685
  248   HG21  VAL  30          3HG2      VAL  30  11.850  -5.710   2.933
  249   HG22  VAL  30          1HG2      VAL  30  11.264  -5.794   1.271
  250   HG23  VAL  30          2HG2      VAL  30  10.523  -6.794   2.523
  251    H    GLU  31           H        GLU  31   9.529  -1.813   4.576
  252    HA   GLU  31           HA       GLU  31  10.935  -2.815   6.954
  253    HB2  GLU  31           2HB      GLU  31  10.441  -0.212   6.057
  254    HB3  GLU  31           1HB      GLU  31   9.313  -0.445   7.386
  255    HG2  GLU  31           2HG      GLU  31  11.025  -0.817   8.928
  256    HG3  GLU  31           1HG      GLU  31  12.216  -1.124   7.664
  257    H    LEU  32           H        LEU  32   9.699  -3.180   8.905
  258    HA   LEU  32           HA       LEU  32   6.821  -3.578   8.463
  259    HG   LEU  32           HG       LEU  32   5.864  -6.116   8.568
  260    HB2  LEU  32           2HB      LEU  32   8.177  -5.705   8.173
  261    HB3  LEU  32           1HB      LEU  32   8.532  -5.610   9.885
  262   HD11  LEU  32          1HD1      LEU  32   7.778  -7.645  10.260
  263   HD12  LEU  32          2HD1      LEU  32   6.880  -8.150   8.830
  264   HD13  LEU  32          3HD1      LEU  32   6.055  -7.998  10.382
  265   HD21  LEU  32          3HD2      LEU  32   5.293  -4.579  10.275
  266   HD22  LEU  32          1HD2      LEU  32   6.444  -5.290  11.407
  267   HD23  LEU  32          2HD2      LEU  32   4.992  -6.179  10.951
  268    H    THR  33           H        THR  33   5.886  -2.243   9.829
  269    HA   THR  33           HA       THR  33   6.753  -2.312  12.666
  270    HB   THR  33           HB       THR  33   5.787   0.127  12.640
  271    HG1  THR  33           1HG      THR  33   6.562  -0.196   9.931
  272   HG21  THR  33          3HG2      THR  33   8.093   0.909  11.584
  273   HG22  THR  33          1HG2      THR  33   8.475  -0.794  11.833
  274   HG23  THR  33          2HG2      THR  33   7.974   0.205  13.196
  275    HA   PRO  34           HA       PRO  34   2.488  -3.153  13.417
  276    HB2  PRO  34           2HB      PRO  34   2.036  -2.024  15.817
  277    HB3  PRO  34           1HB      PRO  34   3.074  -3.433  15.611
  278    HG2  PRO  34           2HG      PRO  34   3.827  -0.571  15.982
  279    HG3  PRO  34           1HG      PRO  34   4.584  -2.025  16.653
  280    HD2  PRO  34           2HD      PRO  34   5.528  -0.641  14.462
  281    HD3  PRO  34           1HD      PRO  34   5.871  -2.351  14.794
  282    H    GLU  35           H        GLU  35   2.707  -1.129  11.630
  283    HA   GLU  35           HA       GLU  35   0.321   0.385  12.132
  284    HB2  GLU  35           2HB      GLU  35   2.962   1.811  11.727
  285    HB3  GLU  35           1HB      GLU  35   1.384   2.583  11.671
  286    HG2  GLU  35           2HG      GLU  35   2.552   1.176  14.061
  287    HG3  GLU  35           1HG      GLU  35   2.537   2.918  13.803
  288    H    ARG  36           H        ARG  36   3.091  -0.247   9.969
  289    HA   ARG  36           HA       ARG  36   1.385  -0.698   7.773
  290    HE   ARG  36           HE       ARG  36   4.647   4.355   8.071
  291    HB2  ARG  36           2HB      ARG  36   2.127   1.191   6.347
  292    HB3  ARG  36           1HB      ARG  36   1.151   1.706   7.713
  293    HG2  ARG  36           2HG      ARG  36   3.652   1.881   8.755
  294    HG3  ARG  36           1HG      ARG  36   3.948   2.282   7.064
  295    HD2  ARG  36           2HD      ARG  36   2.123   3.967   7.210
  296    HD3  ARG  36           1HD      ARG  36   2.004   3.621   8.935
  297   HH11  ARG  36          1HH1      ARG  36   1.562   5.543   9.188
  298   HH12  ARG  36          2HH1      ARG  36   2.212   7.030   9.790
  299   HH21  ARG  36          1HH2      ARG  36   5.504   6.310   8.863
  300   HH22  ARG  36          2HH2      ARG  36   4.449   7.467   9.605
  301    H    GLY  37           H        GLY  37   2.582  -0.870   5.693
  302    HA2  GLY  37           2HA      GLY  37   5.223  -2.070   6.211
  303    HA3  GLY  37           1HA      GLY  37   4.149  -2.518   4.892
  304    H    PHE  38           H        PHE  38   6.982  -0.922   5.420
  305    HA   PHE  38           HA       PHE  38   6.468   1.201   3.463
  306    HD1  PHE  38           1HD      PHE  38   7.226   3.720   3.882
  307    HD2  PHE  38           2HD      PHE  38  10.777   1.375   4.112
  308    HE1  PHE  38           1HE      PHE  38   8.489   5.534   2.825
  309    HE2  PHE  38           2HE      PHE  38  12.037   3.180   3.022
  310    HZ   PHE  38           HZ       PHE  38  10.895   5.264   2.377
  311    HB2  PHE  38           2HB      PHE  38   7.584   1.786   5.582
  312    HB3  PHE  38           1HB      PHE  38   8.870   0.647   5.219
  313    H    ILE  39           H        ILE  39   6.840   0.750   1.408
  314    HA   ILE  39           HA       ILE  39   9.156  -0.973   0.748
  315    HB   ILE  39           HB       ILE  39   6.711  -1.094  -0.982
  316   HG12  ILE  39          2HG1      ILE  39   7.114  -2.568   1.619
  317   HG13  ILE  39          1HG1      ILE  39   5.663  -1.778   1.014
  318   HG21  ILE  39          1HG2      ILE  39   9.283  -2.192  -1.053
  319   HG22  ILE  39          2HG2      ILE  39   7.927  -2.565  -2.115
  320   HG23  ILE  39          3HG2      ILE  39   8.207  -3.534  -0.670
  321   HD11  ILE  39          3HD1      ILE  39   5.297  -3.548  -0.566
  322   HD12  ILE  39          1HD1      ILE  39   5.511  -4.232   1.045
  323   HD13  ILE  39          2HD1      ILE  39   6.827  -4.307  -0.125
  324    H    ASP  40           H        ASP  40  10.509   0.583  -0.088
  325    HA   ASP  40           HA       ASP  40   9.334   2.366  -2.109
  326    HB2  ASP  40           2HB      ASP  40  11.305   3.876  -1.587
  327    HB3  ASP  40           1HB      ASP  40  10.078   3.729  -0.332
  328    H    PHE  41           H        PHE  41  10.257   2.668  -4.004
  329    HA   PHE  41           HA       PHE  41  12.102   0.655  -4.968
  330    HD1  PHE  41           2HD      PHE  41  13.319   1.321  -7.633
  331    HD2  PHE  41           1HD      PHE  41   9.200   0.288  -7.385
  332    HE1  PHE  41           2HE      PHE  41  13.646  -0.372  -9.388
  333    HE2  PHE  41           1HE      PHE  41   9.517  -1.410  -9.143
  334    HZ   PHE  41           HZ       PHE  41  11.743  -1.740 -10.146
  335    HB2  PHE  41           2HB      PHE  41   9.980   1.971  -6.089
  336    HB3  PHE  41           1HB      PHE  41  11.322   2.906  -6.731
  337    H    GLY  42           H        GLY  42  12.338   3.647  -3.529
  338    HA2  GLY  42           2HA      GLY  42  14.806   4.183  -3.160
  339    HA3  GLY  42           1HA      GLY  42  14.831   4.377  -4.910
  340    H    ASP  43           H        ASP  43  13.830   6.175  -5.850
  341    HA   ASP  43           HA       ASP  43  13.626   8.486  -4.162
  342    HB2  ASP  43           2HB      ASP  43  14.434   8.446  -6.594
  343    HB3  ASP  43           1HB      ASP  43  12.738   8.313  -7.047
  344    H    SER  44           H        SER  44  11.479   6.188  -5.596
  345    HA   SER  44           HA       SER  44   9.100   7.651  -4.701
  346    HG   SER  44           HG       SER  44  10.328   4.857  -6.640
  347    HB2  SER  44           2HB      SER  44   8.194   5.394  -6.012
  348    HB3  SER  44           1HB      SER  44   8.440   6.972  -6.766
  349    H    ASN  45           H        ASN  45   7.382   6.280  -3.554
  350    HA   ASN  45           HA       ASN  45   8.440   3.933  -2.204
  351    HB2  ASN  45           2HB      ASN  45   7.273   5.977  -0.380
  352    HB3  ASN  45           1HB      ASN  45   8.486   4.744  -0.053
  353   HD21  ASN  45          1HD2      ASN  45  10.382   5.556   0.413
  354   HD22  ASN  45          2HD2      ASN  45  11.068   7.002  -0.236
  355    H    CYS  46           H        CYS  46   6.745   2.994  -0.659
  356    HA   CYS  46           HA       CYS  46   4.014   3.716  -1.257
  357    HG   CYS  46           HG       CYS  46   2.412   2.651  -2.971
  358    HB2  CYS  46           2HB      CYS  46   5.009   2.074  -3.061
  359    HB3  CYS  46           1HB      CYS  46   4.686   0.867  -1.821
  360    H    GLU  47           H        GLU  47   3.443   3.922   0.824
  361    HA   GLU  47           HA       GLU  47   4.159   1.832   2.734
  362    HB2  GLU  47           2HB      GLU  47   4.306   4.468   3.014
  363    HB3  GLU  47           1HB      GLU  47   2.628   4.283   3.503
  364    HG2  GLU  47           2HG      GLU  47   3.176   3.206   5.448
  365    HG3  GLU  47           1HG      GLU  47   4.690   2.566   4.805
  366    H    LEU  48           H        LEU  48   2.507   0.875   4.102
  367    HA   LEU  48           HA       LEU  48  -0.228   1.105   3.053
  368    HG   LEU  48           HG       LEU  48  -0.934  -2.149   3.981
  369    HB2  LEU  48           2HB      LEU  48   0.751  -0.804   1.892
  370    HB3  LEU  48           1HB      LEU  48   1.244  -1.519   3.414
  371   HD11  LEU  48          1HD1      LEU  48  -1.807  -0.068   2.014
  372   HD12  LEU  48          2HD1      LEU  48  -2.262  -0.270   3.707
  373   HD13  LEU  48          3HD1      LEU  48  -2.890  -1.376   2.487
  374   HD21  LEU  48          3HD2      LEU  48  -0.506  -3.743   2.445
  375   HD22  LEU  48          1HD2      LEU  48  -0.198  -2.584   1.154
  376   HD23  LEU  48          2HD2      LEU  48  -1.855  -2.975   1.609
  377    H    LEU  49           H        LEU  49  -1.483   1.653   4.689
  378    HA   LEU  49           HA       LEU  49  -0.750   0.879   7.419
  379    HG   LEU  49           HG       LEU  49  -1.985   1.804   9.184
  380    HB2  LEU  49           2HB      LEU  49  -1.645   3.223   6.677
  381    HB3  LEU  49           1HB      LEU  49  -3.210   2.437   6.735
  382   HD11  LEU  49          1HD1      LEU  49  -0.669   4.019   8.224
  383   HD12  LEU  49          2HD1      LEU  49  -0.799   3.540   9.917
  384   HD13  LEU  49          3HD1      LEU  49  -1.931   4.713   9.243
  385   HD21  LEU  49          3HD2      LEU  49  -4.348   2.151   8.890
  386   HD22  LEU  49          1HD2      LEU  49  -4.087   3.839   8.448
  387   HD23  LEU  49          2HD2      LEU  49  -3.746   3.295  10.091
  388    H    ALA  50           H        ALA  50  -1.773  -0.705   8.546
  389    HA   ALA  50           HA       ALA  50  -4.286  -1.732   7.468
  390    HB1  ALA  50           3HB      ALA  50  -2.530  -2.960   6.342
  391    HB2  ALA  50           1HB      ALA  50  -3.464  -4.001   7.401
  392    HB3  ALA  50           2HB      ALA  50  -1.866  -3.457   7.898
  393    H    HIS  51           H        HIS  51  -5.664  -1.746   9.058
  394    HA   HIS  51           HA       HIS  51  -4.784  -2.591  11.706
  395    HD1  HIS  51           1HD      HIS  51  -7.838  -0.047  13.731
  396    HD2  HIS  51           2HD      HIS  51  -3.913  -1.374  13.399
  397    HE1  HIS  51           1HE      HIS  51  -6.840   0.226  16.020
  398    HE2  HIS  51           2HE      HIS  51  -4.490  -0.658  15.813
  399    HB2  HIS  51           2HB      HIS  51  -5.982  -0.205  11.048
  400    HB3  HIS  51           1HB      HIS  51  -7.368  -1.176  11.518
  401    HA   PRO  52           HA       PRO  52  -7.291  -6.185  11.874
  402    HB2  PRO  52           2HB      PRO  52  -9.076  -4.776  13.816
  403    HB3  PRO  52           1HB      PRO  52  -8.360  -6.390  13.908
  404    HG2  PRO  52           2HG      PRO  52  -7.296  -4.395  15.279
  405    HG3  PRO  52           1HG      PRO  52  -6.254  -5.567  14.457
  406    HD2  PRO  52           2HD      PRO  52  -6.912  -2.761  13.695
  407    HD3  PRO  52           1HD      PRO  52  -5.403  -3.661  13.467
  408    H    ASP  53           H        ASP  53  -8.958  -3.166  11.184
  409    HA   ASP  53           HA       ASP  53 -10.833  -4.728   9.583
  410    HB2  ASP  53           2HB      ASP  53 -11.863  -2.491  11.322
  411    HB3  ASP  53           1HB      ASP  53 -12.791  -3.686  10.422
  412    H    HIS  54           H        HIS  54  -8.658  -2.265   9.524
  413    HA   HIS  54           HA       HIS  54  -9.912  -1.303   7.098
  414    HD1  HIS  54           1HD      HIS  54  -7.301   1.813   8.780
  415    HD2  HIS  54           2HD      HIS  54 -10.097   0.132  11.352
  416    HE1  HIS  54           1HE      HIS  54  -6.498   2.365  11.097
  417    HE2  HIS  54           2HE      HIS  54  -8.294   1.481  12.625
  418    HB2  HIS  54           2HB      HIS  54  -9.487   1.086   7.627
  419    HB3  HIS  54           1HB      HIS  54 -10.725   0.343   8.623
  420    H    VAL  55           H        VAL  55  -8.441  -0.138   5.641
  421    HA   VAL  55           HA       VAL  55  -5.612  -0.439   6.290
  422    HB   VAL  55           HB       VAL  55  -6.697  -2.423   4.941
  423   HG11  VAL  55          1HG1      VAL  55  -6.946  -2.227   2.682
  424   HG12  VAL  55          2HG1      VAL  55  -5.837  -0.862   2.566
  425   HG13  VAL  55          3HG1      VAL  55  -7.468  -0.623   3.192
  426   HG21  VAL  55          3HG2      VAL  55  -4.558  -2.910   3.950
  427   HG22  VAL  55          1HG2      VAL  55  -4.327  -2.186   5.541
  428   HG23  VAL  55          2HG2      VAL  55  -4.079  -1.218   4.087
  429    H    LEU  56           H        LEU  56  -4.334   1.102   5.418
  430    HA   LEU  56           HA       LEU  56  -5.614   3.061   3.622
  431    HG   LEU  56           HG       LEU  56  -6.407   4.635   5.595
  432    HB2  LEU  56           2HB      LEU  56  -4.364   3.437   6.196
  433    HB3  LEU  56           1HB      LEU  56  -3.464   4.316   4.982
  434   HD11  LEU  56          1HD1      LEU  56  -4.240   6.657   6.042
  435   HD12  LEU  56          2HD1      LEU  56  -4.684   5.473   7.273
  436   HD13  LEU  56          3HD1      LEU  56  -5.881   6.627   6.688
  437   HD21  LEU  56          3HD2      LEU  56  -5.813   6.810   4.176
  438   HD22  LEU  56          1HD2      LEU  56  -6.404   5.331   3.425
  439   HD23  LEU  56          2HD2      LEU  56  -4.677   5.693   3.426
  440    H    MET  57           H        MET  57  -4.406   3.845   1.913
  441    HA   MET  57           HA       MET  57  -1.766   2.604   1.544
  442    HB2  MET  57           2HB      MET  57  -3.648   3.104  -0.742
  443    HB3  MET  57           1HB      MET  57  -2.237   2.055  -0.689
  444    HG2  MET  57           2HG      MET  57  -3.397   0.553   0.855
  445    HG3  MET  57           1HG      MET  57  -4.812   1.605   0.800
  446    HE1  MET  57           3HE      MET  57  -6.868  -0.117  -1.609
  447    HE2  MET  57           1HE      MET  57  -6.567   1.617  -1.518
  448    HE3  MET  57           2HE      MET  57  -6.620   0.653  -0.041
  449    H    ILE  58           H        ILE  58  -0.244   4.158   1.556
  450    HA   ILE  58           HA       ILE  58  -0.866   6.689   0.196
  451    HB   ILE  58           HB       ILE  58   0.943   6.349   2.593
  452   HG12  ILE  58          2HG1      ILE  58  -1.925   6.651   2.445
  453   HG13  ILE  58          1HG1      ILE  58  -0.912   6.425   3.858
  454   HG21  ILE  58          1HG2      ILE  58   1.600   8.136   1.067
  455   HG22  ILE  58          2HG2      ILE  58   1.030   8.777   2.608
  456   HG23  ILE  58          3HG2      ILE  58  -0.018   8.832   1.188
  457   HD11  ILE  58          3HD1      ILE  58  -2.387   8.500   3.763
  458   HD12  ILE  58          1HD1      ILE  58  -1.229   9.121   2.586
  459   HD13  ILE  58          2HD1      ILE  58  -0.697   8.717   4.219
  460    H    LEU  59           H        LEU  59   0.630   7.437  -1.229
  461    HA   LEU  59           HA       LEU  59   3.109   5.869  -1.494
  462    HG   LEU  59           HG       LEU  59   1.332   7.154  -5.158
  463    HB2  LEU  59           2HB      LEU  59   3.001   5.950  -3.815
  464    HB3  LEU  59           1HB      LEU  59   1.356   5.605  -3.332
  465   HD11  LEU  59          1HD1      LEU  59   0.054   8.960  -4.205
  466   HD12  LEU  59          2HD1      LEU  59   0.701   8.599  -2.608
  467   HD13  LEU  59          3HD1      LEU  59  -0.350   7.436  -3.414
  468   HD21  LEU  59          3HD2      LEU  59   2.685   8.911  -5.444
  469   HD22  LEU  59          1HD2      LEU  59   3.689   8.117  -4.236
  470   HD23  LEU  59          2HD2      LEU  59   2.580   9.401  -3.761
  471    H    ASN  60           H        ASN  60   5.002   6.934  -1.930
  472    HA   ASN  60           HA       ASN  60   4.874   9.878  -1.891
  473    HB2  ASN  60           2HB      ASN  60   7.159   8.276  -0.730
  474    HB3  ASN  60           1HB      ASN  60   6.823   9.994  -0.525
  475   HD21  ASN  60          1HD2      ASN  60   7.290   8.752   1.710
  476   HD22  ASN  60          2HD2      ASN  60   5.849   8.424   2.604
  477    H    SER  61           H        SER  61   5.196  10.331  -4.002
  478    HA   SER  61           HA       SER  61   7.735   9.401  -5.151
  479    HG   SER  61           HG       SER  61   5.815   7.256  -5.041
  480    HB2  SER  61           2HB      SER  61   5.522   9.214  -7.072
  481    HB3  SER  61           1HB      SER  61   6.899   8.146  -6.825
  482    HA   PRO  62           HA       PRO  62   8.000  13.599  -6.548
  483    HB2  PRO  62           2HB      PRO  62   9.982  13.186  -8.372
  484    HB3  PRO  62           1HB      PRO  62  10.226  13.318  -6.630
  485    HG2  PRO  62           2HG      PRO  62  10.012  10.846  -8.311
  486    HG3  PRO  62           1HG      PRO  62  11.172  11.228  -7.023
  487    HD2  PRO  62           2HD      PRO  62   9.060   9.664  -6.569
  488    HD3  PRO  62           1HD      PRO  62   9.627  10.817  -5.346
  489    H    ASP  63           H        ASP  63   6.964  10.998  -8.552
  490    HA   ASP  63           HA       ASP  63   5.956  12.981 -10.447
  491    HB2  ASP  63           2HB      ASP  63   7.881  12.274 -11.613
  492    HB3  ASP  63           1HB      ASP  63   7.642  10.591 -11.164
  493    H    GLU  64           H        GLU  64   4.003  12.360 -11.527
  494    HA   GLU  64           HA       GLU  64   2.305  10.707  -9.963
  495    HB2  GLU  64           2HB      GLU  64   1.964  12.028 -12.628
  496    HB3  GLU  64           1HB      GLU  64   0.876  10.716 -12.211
  497    HG2  GLU  64           2HG      GLU  64  -0.300  12.453 -11.364
  498    HG3  GLU  64           1HG      GLU  64   0.664  12.031  -9.946
  499    H    ASP  65           H        ASP  65   4.075   9.917 -12.982
  500    HA   ASP  65           HA       ASP  65   2.977   7.436 -13.523
  501    HB2  ASP  65           2HB      ASP  65   4.862   8.648 -14.762
  502    HB3  ASP  65           1HB      ASP  65   5.949   7.955 -13.560
  503    H    SER  66           H        SER  66   5.717   8.181 -11.416
  504    HA   SER  66           HA       SER  66   5.996   5.633 -10.245
  505    HG   SER  66           HG       SER  66   7.895   7.508 -11.066
  506    HB2  SER  66           2HB      SER  66   6.717   8.401  -9.269
  507    HB3  SER  66           1HB      SER  66   7.141   6.931  -8.388
  508    H    LEU  67           H        LEU  67   4.538   8.589  -9.046
  509    HA   LEU  67           HA       LEU  67   3.389   7.925  -6.709
  510    HG   LEU  67           HG       LEU  67   1.105   9.603  -6.294
  511    HB2  LEU  67           2HB      LEU  67   3.204  10.134  -7.482
  512    HB3  LEU  67           1HB      LEU  67   2.452   9.650  -8.972
  513   HD11  LEU  67          1HD1      LEU  67   1.022  11.801  -6.537
  514   HD12  LEU  67          2HD1      LEU  67  -0.160  11.476  -7.804
  515   HD13  LEU  67          3HD1      LEU  67   1.535  11.718  -8.222
  516   HD21  LEU  67          3HD2      LEU  67  -0.935   9.605  -7.924
  517   HD22  LEU  67          1HD2      LEU  67  -0.140   8.091  -7.497
  518   HD23  LEU  67          2HD2      LEU  67   0.221   8.874  -9.036
  519    H    ALA  68           H        ALA  68   1.618   7.564  -9.800
  520    HA   ALA  68           HA       ALA  68  -0.490   6.095  -8.607
  521    HB1  ALA  68           3HB      ALA  68   0.398   6.531 -11.444
  522    HB2  ALA  68           1HB      ALA  68  -1.053   7.114 -10.630
  523    HB3  ALA  68           2HB      ALA  68  -0.912   5.411 -11.068
  524    H    HIS  69           H        HIS  69   2.572   5.179 -10.070
  525    HA   HIS  69           HA       HIS  69   2.155   2.457 -10.448
  526    HD1  HIS  69           1HD      HIS  69   6.667   2.484 -11.255
  527    HD2  HIS  69           2HD      HIS  69   3.278   0.340 -10.165
  528    HE1  HIS  69           1HE      HIS  69   7.228   0.073 -11.695
  529    HE2  HIS  69           2HE      HIS  69   5.193  -1.213 -10.948
  530    HB2  HIS  69           2HB      HIS  69   4.198   3.827 -11.103
  531    HB3  HIS  69           1HB      HIS  69   4.745   3.635  -9.442
  532    H    MET  70           H        MET  70   2.953   4.267  -7.546
  533    HA   MET  70           HA       MET  70   3.274   1.891  -5.936
  534    HB2  MET  70           2HB      MET  70   2.762   4.307  -4.400
  535    HB3  MET  70           1HB      MET  70   4.161   3.255  -4.377
  536    HG2  MET  70           2HG      MET  70   3.694   5.433  -6.396
  537    HG3  MET  70           1HG      MET  70   4.690   5.581  -4.952
  538    HE1  MET  70           3HE      MET  70   7.377   2.735  -5.727
  539    HE2  MET  70           1HE      MET  70   5.762   2.344  -5.136
  540    HE3  MET  70           2HE      MET  70   6.641   3.716  -4.460
  541    H    GLN  71           H        GLN  71   0.839   4.554  -5.878
  542    HA   GLN  71           HA       GLN  71  -0.865   3.400  -4.054
  543    HB2  GLN  71           2HB      GLN  71  -2.722   4.661  -5.414
  544    HB3  GLN  71           1HB      GLN  71  -1.543   5.541  -4.463
  545    HG2  GLN  71           2HG      GLN  71  -0.811   6.606  -6.260
  546    HG3  GLN  71           1HG      GLN  71  -0.637   5.105  -7.169
  547   HE21  GLN  71          1HE2      GLN  71  -2.995   4.143  -7.597
  548   HE22  GLN  71          2HE2      GLN  71  -4.053   5.264  -8.377
  549    H    ASN  72           H        ASN  72  -0.435   2.555  -7.398
  550    HA   ASN  72           HA       ASN  72  -2.871   1.016  -7.531
  551    HB2  ASN  72           2HB      ASN  72  -2.433   0.751  -9.763
  552    HB3  ASN  72           1HB      ASN  72  -1.434   2.166  -9.463
  553   HD21  ASN  72          1HD2      ASN  72  -1.376  -1.345  -9.701
  554   HD22  ASN  72          2HD2      ASN  72   0.269  -1.465 -10.214
  555    H    VAL  73           H        VAL  73   0.584   0.327  -7.185
  556    HA   VAL  73           HA       VAL  73   0.655  -2.397  -7.350
  557    HB   VAL  73           HB       VAL  73   2.180  -0.487  -5.600
  558   HG11  VAL  73          1HG1      VAL  73   2.582  -3.472  -5.751
  559   HG12  VAL  73          2HG1      VAL  73   2.154  -2.530  -4.323
  560   HG13  VAL  73          3HG1      VAL  73   3.740  -2.331  -5.068
  561   HG21  VAL  73          3HG2      VAL  73   3.677  -0.432  -7.266
  562   HG22  VAL  73          1HG2      VAL  73   2.361  -1.073  -8.251
  563   HG23  VAL  73          2HG2      VAL  73   3.560  -2.167  -7.563
  564    H    VAL  74           H        VAL  74  -0.178  -0.493  -4.459
  565    HA   VAL  74           HA       VAL  74  -0.635  -2.784  -2.824
  566    HB   VAL  74           HB       VAL  74  -1.586   0.054  -2.446
  567   HG11  VAL  74          1HG1      VAL  74  -2.096  -0.482  -0.187
  568   HG12  VAL  74          2HG1      VAL  74  -1.396  -2.090  -0.340
  569   HG13  VAL  74          3HG1      VAL  74  -2.890  -1.695  -1.188
  570   HG21  VAL  74          3HG2      VAL  74   0.526   0.512  -1.914
  571   HG22  VAL  74          1HG2      VAL  74   0.991  -1.175  -2.133
  572   HG23  VAL  74          2HG2      VAL  74   0.395  -0.619  -0.571
  573    H    ALA  75           H        ALA  75  -2.833  -0.574  -4.581
  574    HA   ALA  75           HA       ALA  75  -5.271  -1.552  -3.778
  575    HB1  ALA  75           3HB      ALA  75  -4.459  -0.661  -6.543
  576    HB2  ALA  75           1HB      ALA  75  -5.130   0.345  -5.258
  577    HB3  ALA  75           2HB      ALA  75  -6.122  -0.899  -6.015
  578    H    ASP  76           H        ASP  76  -2.873  -3.033  -5.767
  579    HA   ASP  76           HA       ASP  76  -4.581  -5.088  -6.829
  580    HB2  ASP  76           2HB      ASP  76  -2.264  -4.114  -7.700
  581    HB3  ASP  76           1HB      ASP  76  -1.623  -5.434  -6.727
  582    H    HIS  77           H        HIS  77  -2.224  -4.836  -4.197
  583    HA   HIS  77           HA       HIS  77  -2.161  -7.538  -3.473
  584    HD1  HIS  77           1HD      HIS  77  -0.551  -6.305  -4.740
  585    HD2  HIS  77           2HD      HIS  77   1.109  -4.806  -1.238
  586    HE1  HIS  77           1HE      HIS  77   1.749  -5.509  -5.373
  587    HE2  HIS  77           2HE      HIS  77   2.767  -4.690  -3.219
  588    HB2  HIS  77           2HB      HIS  77  -1.849  -5.187  -1.598
  589    HB3  HIS  77           1HB      HIS  77  -1.243  -6.815  -1.356
  590    H    LEU  78           H        LEU  78  -4.359  -4.951  -2.431
  591    HA   LEU  78           HA       LEU  78  -5.709  -6.442  -0.462
  592    HG   LEU  78           HG       LEU  78  -4.938  -3.251  -0.646
  593    HB2  LEU  78           2HB      LEU  78  -6.577  -4.080  -2.127
  594    HB3  LEU  78           1HB      LEU  78  -7.542  -4.748  -0.827
  595   HD11  LEU  78          1HD1      LEU  78  -6.144  -1.788   0.758
  596   HD12  LEU  78          2HD1      LEU  78  -7.495  -2.914   0.897
  597   HD13  LEU  78          3HD1      LEU  78  -7.177  -2.103  -0.636
  598   HD21  LEU  78          3HD2      LEU  78  -6.096  -5.218   1.290
  599   HD22  LEU  78          1HD2      LEU  78  -5.238  -3.796   1.883
  600   HD23  LEU  78          2HD2      LEU  78  -4.413  -4.950   0.835
  601    H    GLN  79           H        GLN  79  -5.835  -6.554  -3.896
  602    HA   GLN  79           HA       GLN  79  -8.493  -7.490  -4.197
  603    HB2  GLN  79           2HB      GLN  79  -6.105  -7.887  -6.002
  604    HB3  GLN  79           1HB      GLN  79  -7.781  -8.174  -6.448
  605    HG2  GLN  79           2HG      GLN  79  -7.401  -5.510  -5.397
  606    HG3  GLN  79           1HG      GLN  79  -6.346  -5.829  -6.770
  607   HE21  GLN  79          1HE2      GLN  79  -8.221  -3.930  -7.035
  608   HE22  GLN  79          2HE2      GLN  79  -9.492  -4.463  -8.077
  609    H    ARG  80           H        ARG  80  -5.428  -9.304  -4.505
  610    HA   ARG  80           HA       ARG  80  -6.563 -11.826  -4.651
  611    HE   ARG  80           HE       ARG  80  -2.135 -13.261  -2.834
  612    HB2  ARG  80           2HB      ARG  80  -4.291 -12.575  -3.627
  613    HB3  ARG  80           1HB      ARG  80  -4.332 -11.824  -5.215
  614    HG2  ARG  80           2HG      ARG  80  -2.997 -10.197  -4.546
  615    HG3  ARG  80           1HG      ARG  80  -4.048  -9.820  -3.180
  616    HD2  ARG  80           2HD      ARG  80  -1.694 -10.460  -2.580
  617    HD3  ARG  80           1HD      ARG  80  -2.956 -11.408  -1.793
  618   HH11  ARG  80          1HH1      ARG  80  -1.016 -10.447  -4.567
  619   HH12  ARG  80          2HH1      ARG  80  -0.001 -11.354  -5.637
  620   HH21  ARG  80          1HH2      ARG  80  -0.800 -14.457  -4.241
  621   HH22  ARG  80          2HH2      ARG  80   0.121 -13.631  -5.453
  622    H    MET  81           H        MET  81  -5.949  -9.861  -1.815
  623    HA   MET  81           HA       MET  81  -6.387 -12.063  -0.003
  624    HB2  MET  81           2HB      MET  81  -6.217 -10.386   1.774
  625    HB3  MET  81           1HB      MET  81  -4.871 -10.311   0.655
  626    HG2  MET  81           2HG      MET  81  -5.412  -8.094   1.126
  627    HG3  MET  81           1HG      MET  81  -6.080  -8.401  -0.472
  628    HE1  MET  81           3HE      MET  81  -6.435  -8.053   3.120
  629    HE2  MET  81           1HE      MET  81  -8.154  -8.070   3.514
  630    HE3  MET  81           2HE      MET  81  -7.391  -6.581   2.953
  631    H    ALA  82           H        ALA  82  -8.414  -9.982  -1.738
  632    HA   ALA  82           HA       ALA  82 -10.631 -10.472   0.153
  633    HB1  ALA  82           3HB      ALA  82 -10.282  -8.294  -1.902
  634    HB2  ALA  82           1HB      ALA  82 -10.313  -8.124  -0.146
  635    HB3  ALA  82           2HB      ALA  82 -11.778  -8.585  -1.014
  636    H    ASN  83           H        ASN  83  -9.955 -10.224  -3.343
  637    HA   ASN  83           HA       ASN  83 -10.713 -11.439  -5.113
  638    HB2  ASN  83           2HB      ASN  83 -10.581 -13.301  -3.125
  639    HB3  ASN  83           1HB      ASN  83 -12.289 -13.385  -3.549
  640   HD21  ASN  83          1HD2      ASN  83 -10.203 -15.362  -3.928
  641   HD22  ASN  83          2HD2      ASN  83 -10.145 -15.690  -5.623
  642    H    SER  84           H        SER  84 -13.116 -12.745  -5.573
  643    HA   SER  84           HA       SER  84 -15.288 -12.377  -6.124
  644    HG   SER  84           HG       SER  84 -16.915  -9.987  -4.908
  645    HB2  SER  84           2HB      SER  84 -15.794 -12.334  -3.777
  646    HB3  SER  84           1HB      SER  84 -15.191 -10.686  -3.618
  647    H    GLU  85           H        GLU  85 -14.690  -9.152  -4.775
  648    HA   GLU  85           HA       GLU  85 -15.297  -8.023  -7.414
  649    HB2  GLU  85           2HB      GLU  85 -15.828  -5.966  -6.260
  650    HB3  GLU  85           1HB      GLU  85 -16.679  -7.295  -5.487
  651    HG2  GLU  85           2HG      GLU  85 -15.062  -7.334  -3.691
  652    HG3  GLU  85           1HG      GLU  85 -14.113  -6.079  -4.486
  653    H    SER  86           H        SER  86 -14.045  -6.218  -8.207
  654    HA   SER  86           HA       SER  86 -11.229  -6.616  -7.799
  655    HG   SER  86           HG       SER  86 -13.700  -5.604 -10.143
  656    HB2  SER  86           2HB      SER  86 -11.237  -4.494  -9.404
  657    HB3  SER  86           1HB      SER  86 -11.605  -6.108 -10.013
  658    H    LEU  87           H        LEU  87 -11.440  -6.065  -5.473
  659    HA   LEU  87           HA       LEU  87 -11.545  -4.577  -3.689
  660    HG   LEU  87           HG       LEU  87  -8.058  -4.764  -3.167
  661    HB2  LEU  87           2HB      LEU  87  -9.099  -4.562  -5.155
  662    HB3  LEU  87           1HB      LEU  87  -9.383  -2.940  -4.553
  663   HD11  LEU  87          1HD1      LEU  87  -8.985  -3.494  -1.087
  664   HD12  LEU  87          2HD1      LEU  87  -9.853  -2.544  -2.293
  665   HD13  LEU  87          3HD1      LEU  87  -8.091  -2.616  -2.328
  666   HD21  LEU  87          3HD2      LEU  87 -10.853  -5.093  -2.089
  667   HD22  LEU  87          1HD2      LEU  87  -9.375  -5.844  -1.492
  668   HD23  LEU  87          2HD2      LEU  87 -10.021  -6.303  -3.066
  669    H    GLU  88           H        GLU  88 -13.072  -3.103  -3.346
  670    HA   GLU  88           HA       GLU  88 -13.464  -0.884  -5.139
  671    HB2  GLU  88           2HB      GLU  88 -15.318  -1.921  -3.807
  672    HB3  GLU  88           1HB      GLU  88 -14.557  -1.306  -2.345
  673    HG2  GLU  88           2HG      GLU  88 -14.744   0.992  -3.578
  674    HG3  GLU  88           1HG      GLU  88 -15.999   0.161  -4.495
  675    H    ILE  89           H        ILE  89 -11.645   0.392  -5.197
  676    HA   ILE  89           HA       ILE  89 -10.824   1.550  -2.626
  677    HB   ILE  89           HB       ILE  89  -8.522   1.590  -3.272
  678   HG12  ILE  89          2HG1      ILE  89  -9.235   1.860  -5.835
  679   HG13  ILE  89          1HG1      ILE  89  -7.654   1.272  -5.363
  680   HG21  ILE  89          1HG2      ILE  89  -8.820  -0.442  -2.307
  681   HG22  ILE  89          2HG2      ILE  89  -8.218  -0.938  -3.886
  682   HG23  ILE  89          3HG2      ILE  89  -9.946  -0.996  -3.547
  683   HD11  ILE  89          3HD1      ILE  89  -8.492  -1.044  -5.642
  684   HD12  ILE  89          1HD1      ILE  89  -8.497  -0.091  -7.128
  685   HD13  ILE  89          2HD1      ILE  89 -10.004  -0.372  -6.257
  686    H    ALA  90           H        ALA  90 -10.931   3.762  -2.519
  687    HA   ALA  90           HA       ALA  90 -11.306   5.167  -5.070
  688    HB1  ALA  90           3HB      ALA  90 -11.686   6.390  -2.344
  689    HB2  ALA  90           1HB      ALA  90 -12.961   5.464  -3.140
  690    HB3  ALA  90           2HB      ALA  90 -12.333   6.928  -3.893
  691    H    TRP  91           H        TRP  91  -9.480   5.844  -5.919
  692    HA   TRP  91           HA       TRP  91  -7.250   6.590  -4.196
  693    HD1  TRP  91           HD       TRP  91  -8.899   4.601  -7.666
  694    HE1  TRP  91           1HE      TRP  91  -9.419   5.471 -10.031
  695    HE3  TRP  91           3HE      TRP  91  -5.675   8.566  -7.799
  696    HZ2  TRP  91           2HZ      TRP  91  -8.575   7.563 -11.730
  697    HZ3  TRP  91           3HZ      TRP  91  -5.592   9.951  -9.831
  698    HH2  TRP  91           HH       TRP  91  -7.013   9.458 -11.755
  699    HB2  TRP  91           2HB      TRP  91  -5.921   6.596  -6.272
  700    HB3  TRP  91           1HB      TRP  91  -6.767   5.069  -6.039
  701    H    GLN  92           H        GLN  92  -6.569   8.603  -3.886
  702    HA   GLN  92           HA       GLN  92  -8.104  10.770  -5.076
  703    HB2  GLN  92           2HB      GLN  92  -6.021  10.715  -2.887
  704    HB3  GLN  92           1HB      GLN  92  -6.787  12.188  -3.464
  705    HG2  GLN  92           2HG      GLN  92  -8.995  11.139  -2.863
  706    HG3  GLN  92           1HG      GLN  92  -8.074   9.872  -2.055
  707   HE21  GLN  92          1HE2      GLN  92  -8.319  13.406  -2.205
  708   HE22  GLN  92          2HE2      GLN  92  -8.071  13.668  -0.515
  709    HA   PRO  93           HA       PRO  93  -5.380  12.121  -8.246
  710    HB2  PRO  93           2HB      PRO  93  -5.261  14.700  -6.758
  711    HB3  PRO  93           1HB      PRO  93  -5.574  14.410  -8.474
  712    HG2  PRO  93           2HG      PRO  93  -7.572  14.990  -6.801
  713    HG3  PRO  93           1HG      PRO  93  -7.782  13.809  -8.107
  714    HD2  PRO  93           2HD      PRO  93  -7.511  13.369  -5.185
  715    HD3  PRO  93           1HD      PRO  93  -8.365  12.399  -6.401
  716    H    ALA  94           H        ALA  94  -4.495  13.088  -4.951
  717    HA   ALA  94           HA       ALA  94  -2.491  12.496  -3.880
  718    HB1  ALA  94           3HB      ALA  94  -0.605  11.704  -4.951
  719    HB2  ALA  94           1HB      ALA  94  -0.930  12.621  -6.421
  720    HB3  ALA  94           2HB      ALA  94  -1.878  11.180  -6.056
  721    H    GLU  95           H        GLU  95  -2.994  14.916  -6.294
  722    HA   GLU  95           HA       GLU  95  -2.191  17.025  -4.649
  723    HB2  GLU  95           2HB      GLU  95   0.078  16.221  -4.987
  724    HB3  GLU  95           1HB      GLU  95  -0.147  16.236  -6.732
  725    HG2  GLU  95           2HG      GLU  95  -0.710  18.819  -5.559
  726    HG3  GLU  95           1HG      GLU  95   0.915  18.259  -5.165
  727    H    SER  96           H        SER  96  -3.174  18.806  -5.370
  728    HA   SER  96           HA       SER  96  -3.840  18.962  -8.236
  729    HG   SER  96           HG       SER  96  -6.821  18.011  -7.003
  730    HB2  SER  96           2HB      SER  96  -5.571  19.260  -5.836
  731    HB3  SER  96           1HB      SER  96  -5.868  20.364  -7.177
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1   6.876  13.153  -5.296
    2    HB2  MET   1           2HB      MET   1   7.631  13.468  -3.041
    3    HB3  MET   1           1HB      MET   1   8.869  14.061  -4.142
    4    HG2  MET   1           2HG      MET   1   8.763  16.129  -3.320
    5    HG3  MET   1           1HG      MET   1   7.003  16.134  -3.306
    6    HE1  MET   1           3HE      MET   1   5.544  15.284  -0.894
    7    HE2  MET   1           1HE      MET   1   6.049  16.868  -1.481
    8    HE3  MET   1           2HE      MET   1   6.311  16.429   0.206
    9    H    PHE   2           H        PHE   2   4.769  13.178  -5.770
   10    HA   PHE   2           HA       PHE   2   2.981  14.976  -4.298
   11    HD1  PHE   2           2HD      PHE   2   3.375  16.352  -6.767
   12    HD2  PHE   2           1HD      PHE   2   2.852  12.356  -8.142
   13    HE1  PHE   2           2HE      PHE   2   4.632  16.893  -8.811
   14    HE2  PHE   2           1HE      PHE   2   4.100  12.895 -10.187
   15    HZ   PHE   2           HZ       PHE   2   4.996  15.163 -10.526
   16    HB2  PHE   2           2HB      PHE   2   1.827  13.010  -6.192
   17    HB3  PHE   2           1HB      PHE   2   1.455  14.716  -5.984
   18    H    ARG   3           H        ARG   3   0.857  13.797  -3.494
   19    HA   ARG   3           HA       ARG   3   1.435  11.081  -2.647
   20    HE   ARG   3           HE       ARG   3   3.686  10.877   1.794
   21    HB2  ARG   3           2HB      ARG   3   2.021  13.206  -0.901
   22    HB3  ARG   3           1HB      ARG   3   0.532  12.486  -0.296
   23    HG2  ARG   3           2HG      ARG   3   1.850  11.017   0.719
   24    HG3  ARG   3           1HG      ARG   3   2.071  10.297  -0.861
   25    HD2  ARG   3           2HD      ARG   3   4.228  10.834  -0.857
   26    HD3  ARG   3           1HD      ARG   3   3.847  12.527  -0.548
   27   HH11  ARG   3          1HH1      ARG   3   5.829  12.730  -0.245
   28   HH12  ARG   3          2HH1      ARG   3   6.995  12.993   1.007
   29   HH21  ARG   3          1HH2      ARG   3   5.220  11.224   3.443
   30   HH22  ARG   3          2HH2      ARG   3   6.650  12.138   3.100
   31    H    SER   4           H        SER   4  -0.296   9.861  -2.724
   32    HA   SER   4           HA       SER   4  -2.974  11.072  -2.567
   33    HG   SER   4           HG       SER   4  -3.562   7.854  -4.596
   34    HB2  SER   4           2HB      SER   4  -3.071  10.253  -4.716
   35    HB3  SER   4           1HB      SER   4  -1.783   9.078  -4.432
   36    H    THR   5           H        THR   5  -4.665   9.482  -1.752
   37    HA   THR   5           HA       THR   5  -3.540   7.365  -0.110
   38    HB   THR   5           HB       THR   5  -4.507   8.093   1.961
   39    HG1  THR   5           1HG      THR   5  -5.776   9.890   2.118
   40   HG21  THR   5          3HG2      THR   5  -2.332   9.275   1.121
   41   HG22  THR   5          1HG2      THR   5  -3.166   9.839   2.566
   42   HG23  THR   5          2HG2      THR   5  -3.380  10.690   1.040
   43    H    SER   6           H        SER   6  -4.717   5.598  -0.144
   44    HA   SER   6           HA       SER   6  -7.548   5.827  -0.954
   45    HG   SER   6           HG       SER   6  -7.393   2.513  -2.257
   46    HB2  SER   6           2HB      SER   6  -6.059   4.587  -2.531
   47    HB3  SER   6           1HB      SER   6  -5.728   3.425  -1.248
   48    H    HIS   7           H        HIS   7  -9.076   5.193   0.462
   49    HA   HIS   7           HA       HIS   7  -8.198   3.678   2.834
   50    HD1  HIS   7           1HD      HIS   7 -10.676   7.158   1.393
   51    HD2  HIS   7           2HD      HIS   7 -12.432   4.207   3.735
   52    HE1  HIS   7           1HE      HIS   7 -13.151   7.368   0.997
   53    HE2  HIS   7           2HE      HIS   7 -14.198   5.630   2.491
   54    HB2  HIS   7           2HB      HIS   7  -9.723   4.865   4.164
   55    HB3  HIS   7           1HB      HIS   7  -9.070   6.091   3.087
   56    H    VAL   8           H        VAL   8  -9.139   1.760   3.290
   57    HA   VAL   8           HA       VAL   8 -11.701   1.087   2.029
   58    HB   VAL   8           HB       VAL   8  -9.498  -0.954   2.022
   59   HG11  VAL   8          1HG1      VAL   8 -10.814  -2.030   0.348
   60   HG12  VAL   8          2HG1      VAL   8 -11.873  -0.630   0.196
   61   HG13  VAL   8          3HG1      VAL   8 -11.890  -1.592   1.674
   62   HG21  VAL   8          3HG2      VAL   8  -8.675   1.049   0.804
   63   HG22  VAL   8          1HG2      VAL   8 -10.068   0.921  -0.271
   64   HG23  VAL   8          2HG2      VAL   8  -8.869  -0.371  -0.224
   65    H    ARG   9           H        ARG   9 -12.848  -0.653   3.117
   66    HA   ARG   9           HA       ARG   9 -11.943  -0.927   5.892
   67    HE   ARG   9           HE       ARG   9 -14.222   1.217   3.433
   68    HB2  ARG   9           2HB      ARG   9 -14.636  -1.028   4.612
   69    HB3  ARG   9           1HB      ARG   9 -14.374  -1.922   6.103
   70    HG2  ARG   9           2HG      ARG   9 -15.265   0.248   6.617
   71    HG3  ARG   9           1HG      ARG   9 -13.595   0.147   7.184
   72    HD2  ARG   9           2HD      ARG   9 -14.078   2.295   6.094
   73    HD3  ARG   9           1HD      ARG   9 -12.830   1.381   5.247
   74   HH11  ARG   9          1HH1      ARG   9 -16.067   2.297   6.191
   75   HH12  ARG   9          2HH1      ARG   9 -17.484   2.652   5.261
   76   HH21  ARG   9          1HH2      ARG   9 -16.085   1.683   2.209
   77   HH22  ARG   9          2HH2      ARG   9 -17.495   2.303   3.001
   78    H    THR  10           H        THR  10 -10.667  -2.648   6.140
   79    HA   THR  10           HA       THR  10 -11.640  -5.243   5.161
   80    HB   THR  10           HB       THR  10  -9.334  -3.905   4.263
   81    HG1  THR  10           1HG      THR  10  -9.751  -5.317   2.798
   82   HG21  THR  10          3HG2      THR  10  -7.483  -4.977   4.965
   83   HG22  THR  10          1HG2      THR  10  -8.356  -6.453   5.385
   84   HG23  THR  10          2HG2      THR  10  -8.415  -5.055   6.465
   85    H    GLU  11           H        GLU  11 -10.885  -7.111   6.407
   86    HA   GLU  11           HA       GLU  11 -10.402  -6.378   9.216
   87    HB2  GLU  11           2HB      GLU  11 -12.176  -8.213   7.972
   88    HB3  GLU  11           1HB      GLU  11 -11.032  -9.145   8.929
   89    HG2  GLU  11           2HG      GLU  11 -12.005  -8.546  10.824
   90    HG3  GLU  11           1HG      GLU  11 -11.964  -6.841  10.379
   91    H    SER  12           H        SER  12  -8.755  -7.344  10.433
   92    HA   SER  12           HA       SER  12  -6.708  -8.219  10.842
   93    HG   SER  12           HG       SER  12  -5.759 -11.055   8.849
   94    HB2  SER  12           2HB      SER  12  -7.726 -10.348  10.481
   95    HB3  SER  12           1HB      SER  12  -7.646 -10.160   8.728
   96    H    ALA  13           H        ALA  13  -7.045  -6.146   8.804
   97    HA   ALA  13           HA       ALA  13  -5.421  -6.412   6.566
   98    HB1  ALA  13           3HB      ALA  13  -5.935  -4.049   8.307
   99    HB2  ALA  13           1HB      ALA  13  -6.721  -4.463   6.797
  100    HB3  ALA  13           2HB      ALA  13  -5.038  -3.952   6.799
  101    H    ALA  14           H        ALA  14  -4.445  -5.728   9.874
  102    HA   ALA  14           HA       ALA  14  -1.859  -4.866   9.494
  103    HB1  ALA  14           3HB      ALA  14  -1.410  -5.802  11.765
  104    HB2  ALA  14           1HB      ALA  14  -3.025  -6.512  11.714
  105    HB3  ALA  14           2HB      ALA  14  -2.828  -4.760  11.632
  106    H    ARG  15           H        ARG  15  -3.005  -8.100   8.957
  107    HA   ARG  15           HA       ARG  15  -0.404  -9.315   9.218
  108    HE   ARG  15           HE       ARG  15   0.902 -13.644   8.108
  109    HB2  ARG  15           2HB      ARG  15  -2.725 -10.416   9.527
  110    HB3  ARG  15           1HB      ARG  15  -2.727 -10.551   7.780
  111    HG2  ARG  15           2HG      ARG  15  -1.284 -12.110   9.788
  112    HG3  ARG  15           1HG      ARG  15  -1.830 -12.554   8.173
  113    HD2  ARG  15           2HD      ARG  15   0.112 -11.658   7.163
  114    HD3  ARG  15           1HD      ARG  15   0.572 -10.793   8.626
  115   HH11  ARG  15          1HH1      ARG  15   1.219 -10.973  10.341
  116   HH12  ARG  15          2HH1      ARG  15   2.328 -11.810  11.372
  117   HH21  ARG  15          1HH2      ARG  15   2.357 -14.739   9.469
  118   HH22  ARG  15          2HH2      ARG  15   2.972 -13.945  10.880
  119    H    TYR  16           H        TYR  16  -2.427  -8.328   6.444
  120    HA   TYR  16           HA       TYR  16  -0.622  -9.417   4.569
  121    HD1  TYR  16           2HD      TYR  16  -1.706 -10.720   3.149
  122    HD2  TYR  16           1HD      TYR  16  -4.871  -8.071   4.176
  123    HE1  TYR  16           2HE      TYR  16  -3.319 -12.541   2.857
  124    HE2  TYR  16           1HE      TYR  16  -6.494  -9.889   3.889
  125    HH   TYR  16           HH       TYR  16  -5.991 -12.559   2.260
  126    HB2  TYR  16           2HB      TYR  16  -2.716  -7.261   4.246
  127    HB3  TYR  16           1HB      TYR  16  -1.754  -7.886   2.911
  128    H    VAL  17           H        VAL  17  -0.789  -6.346   6.228
  129    HA   VAL  17           HA       VAL  17   1.186  -5.024   4.675
  130    HB   VAL  17           HB       VAL  17   0.121  -4.558   7.439
  131   HG11  VAL  17          1HG1      VAL  17   2.070  -3.674   8.140
  132   HG12  VAL  17          2HG1      VAL  17   1.782  -2.401   6.960
  133   HG13  VAL  17          3HG1      VAL  17   2.784  -3.779   6.529
  134   HG21  VAL  17          3HG2      VAL  17   0.328  -2.845   4.980
  135   HG22  VAL  17          1HG2      VAL  17  -0.471  -2.399   6.487
  136   HG23  VAL  17          2HG2      VAL  17  -1.106  -3.726   5.510
  137    H    ASN  18           H        ASN  18   1.352  -6.962   7.647
  138    HA   ASN  18           HA       ASN  18   4.171  -6.786   7.883
  139    HB2  ASN  18           2HB      ASN  18   2.334  -8.909   9.006
  140    HB3  ASN  18           1HB      ASN  18   3.959  -8.524   9.568
  141   HD21  ASN  18          1HD2      ASN  18   2.699  -8.355  11.611
  142   HD22  ASN  18          2HD2      ASN  18   2.025  -6.814  12.005
  143    H    ARG  19           H        ARG  19   2.021  -8.939   6.121
  144    HA   ARG  19           HA       ARG  19   4.060 -10.898   5.629
  145    HE   ARG  19           HE       ARG  19   0.802 -15.178   5.052
  146    HB2  ARG  19           2HB      ARG  19   1.359 -10.970   5.555
  147    HB3  ARG  19           1HB      ARG  19   1.714 -10.799   3.841
  148    HG2  ARG  19           2HG      ARG  19   2.134 -12.962   3.729
  149    HG3  ARG  19           1HG      ARG  19   3.474 -12.744   4.853
  150    HD2  ARG  19           2HD      ARG  19   2.155 -13.258   6.710
  151    HD3  ARG  19           1HD      ARG  19   0.652 -13.022   5.819
  152   HH11  ARG  19          1HH1      ARG  19   3.865 -14.247   6.444
  153   HH12  ARG  19          2HH1      ARG  19   4.524 -15.846   6.374
  154   HH21  ARG  19          1HH2      ARG  19   1.670 -17.282   4.959
  155   HH22  ARG  19          2HH2      ARG  19   3.279 -17.569   5.530
  156    H    LEU  20           H        LEU  20   3.216  -7.912   4.169
  157    HA   LEU  20           HA       LEU  20   4.046  -8.487   1.519
  158    HG   LEU  20           HG       LEU  20   1.662  -6.578   2.834
  159    HB2  LEU  20           2HB      LEU  20   3.881  -5.854   2.971
  160    HB3  LEU  20           1HB      LEU  20   4.149  -6.024   1.249
  161   HD11  LEU  20          1HD1      LEU  20   0.676  -4.981   1.429
  162   HD12  LEU  20          2HD1      LEU  20   1.959  -5.124   0.225
  163   HD13  LEU  20          3HD1      LEU  20   2.281  -4.329   1.763
  164   HD21  LEU  20          3HD2      LEU  20   1.752  -8.539   1.509
  165   HD22  LEU  20          1HD2      LEU  20   2.368  -7.661   0.107
  166   HD23  LEU  20          2HD2      LEU  20   0.703  -7.427   0.634
  167    H    CYS  21           H        CYS  21   5.719  -6.925   4.248
  168    HA   CYS  21           HA       CYS  21   8.094  -6.315   2.928
  169    HG   CYS  21           HG       CYS  21   6.692  -7.332   6.664
  170    HB2  CYS  21           2HB      CYS  21   9.155  -6.310   5.143
  171    HB3  CYS  21           1HB      CYS  21   7.584  -5.517   5.201
  172    H    LYS  22           H        LYS  22   7.021  -9.291   4.433
  173    HA   LYS  22           HA       LYS  22   9.511 -10.658   3.961
  174    HB2  LYS  22           2HB      LYS  22   6.809 -11.755   4.750
  175    HB3  LYS  22           1HB      LYS  22   8.329 -12.637   4.792
  176    HG2  LYS  22           2HG      LYS  22   8.910 -11.766   6.765
  177    HG3  LYS  22           1HG      LYS  22   8.411 -10.138   6.303
  178    HD2  LYS  22           2HD      LYS  22   7.016 -10.785   8.107
  179    HD3  LYS  22           1HD      LYS  22   6.031 -10.899   6.647
  180    HE2  LYS  22           2HE      LYS  22   5.556 -12.853   7.847
  181    HE3  LYS  22           1HE      LYS  22   6.685 -13.354   6.589
  182    HZ1  LYS  22           3HZ      LYS  22   7.718 -14.311   8.326
  183    HZ2  LYS  22           1HZ      LYS  22   7.039 -13.266   9.470
  184    HZ3  LYS  22           2HZ      LYS  22   8.372 -12.770   8.555
  185    H    HIS  23           H        HIS  23   6.644 -10.004   2.197
  186    HA   HIS  23           HA       HIS  23   6.914 -12.241   0.391
  187    HD1  HIS  23           1HD      HIS  23   5.623 -10.527  -2.555
  188    HD2  HIS  23           2HD      HIS  23   3.405 -13.191  -0.264
  189    HE1  HIS  23           1HE      HIS  23   4.444 -12.013  -4.206
  190    HE2  HIS  23           2HE      HIS  23   3.037 -13.558  -2.798
  191    HB2  HIS  23           2HB      HIS  23   4.702 -11.222   1.067
  192    HB3  HIS  23           1HB      HIS  23   5.120  -9.840   0.059
  193    H    TRP  24           H        TRP  24   6.913  -8.674  -0.135
  194    HA   TRP  24           HA       TRP  24   8.280  -9.104  -2.663
  195    HD1  TRP  24           HD       TRP  24   4.943  -8.182  -1.187
  196    HE1  TRP  24           1HE      TRP  24   3.099  -8.382  -2.971
  197    HE3  TRP  24           3HE      TRP  24   7.563  -6.520  -5.251
  198    HZ2  TRP  24           2HZ      TRP  24   2.796  -7.898  -5.737
  199    HZ3  TRP  24           3HZ      TRP  24   6.423  -6.419  -7.429
  200    HH2  TRP  24           HH       TRP  24   4.088  -7.095  -7.665
  201    HB2  TRP  24           2HB      TRP  24   7.284  -6.598  -1.302
  202    HB3  TRP  24           1HB      TRP  24   8.069  -6.622  -2.878
  203    H    GLY  25           H        GLY  25   9.252  -8.600   0.569
  204    HA2  GLY  25           2HA      GLY  25  11.537  -6.970   0.124
  205    HA3  GLY  25           1HA      GLY  25  11.257  -7.995   1.516
  206    H    HIS  26           H        HIS  26  12.032  -8.343  -1.945
  207    HA   HIS  26           HA       HIS  26  13.855 -10.530  -1.201
  208    HD1  HIS  26           1HD      HIS  26  13.919 -12.879  -4.458
  209    HD2  HIS  26           2HD      HIS  26  11.658 -12.391  -1.007
  210    HE1  HIS  26           1HE      HIS  26  13.523 -15.202  -3.579
  211    HE2  HIS  26           2HE      HIS  26  12.228 -14.874  -1.443
  212    HB2  HIS  26           2HB      HIS  26  11.873 -10.296  -3.263
  213    HB3  HIS  26           1HB      HIS  26  13.455 -10.504  -4.007
  214    H    LYS  27           H        LYS  27  13.552  -7.483  -2.889
  215    HA   LYS  27           HA       LYS  27  16.464  -7.268  -2.962
  216    HB2  LYS  27           2HB      LYS  27  16.046  -8.218  -5.119
  217    HB3  LYS  27           1HB      LYS  27  14.693  -7.138  -5.407
  218    HG2  LYS  27           2HG      LYS  27  17.212  -5.734  -4.948
  219    HG3  LYS  27           1HG      LYS  27  17.242  -6.809  -6.346
  220    HD2  LYS  27           2HD      LYS  27  15.885  -5.483  -7.530
  221    HD3  LYS  27           1HD      LYS  27  14.784  -5.260  -6.170
  222    HE2  LYS  27           2HE      LYS  27  15.742  -3.321  -5.543
  223    HE3  LYS  27           1HE      LYS  27  17.369  -3.871  -5.942
  224    HZ1  LYS  27           3HZ      LYS  27  17.200  -3.134  -8.069
  225    HZ2  LYS  27           1HZ      LYS  27  16.159  -2.019  -7.336
  226    HZ3  LYS  27           2HZ      LYS  27  15.525  -3.358  -8.152
  227    H    PHE  28           H        PHE  28  14.007  -6.010  -1.647
  228    HA   PHE  28           HA       PHE  28  14.848  -3.255  -2.127
  229    HD1  PHE  28           1HD      PHE  28  13.560  -1.155  -3.494
  230    HD2  PHE  28           2HD      PHE  28  12.224  -5.055  -4.547
  231    HE1  PHE  28           1HE      PHE  28  13.783  -0.582  -5.878
  232    HE2  PHE  28           2HE      PHE  28  12.443  -4.490  -6.933
  233    HZ   PHE  28           HZ       PHE  28  13.223  -2.252  -7.600
  234    HB2  PHE  28           2HB      PHE  28  12.039  -4.302  -2.322
  235    HB3  PHE  28           1HB      PHE  28  12.355  -2.623  -1.892
  236    H    GLU  29           H        GLU  29  14.268  -1.785  -0.413
  237    HA   GLU  29           HA       GLU  29  14.595  -3.029   2.162
  238    HB2  GLU  29           2HB      GLU  29  14.458  -0.614   2.965
  239    HB3  GLU  29           1HB      GLU  29  15.789  -1.014   1.887
  240    HG2  GLU  29           2HG      GLU  29  13.415  -0.111   0.477
  241    HG3  GLU  29           1HG      GLU  29  14.046   1.079   1.614
  242    H    VAL  30           H        VAL  30  12.905  -3.941   3.130
  243    HA   VAL  30           HA       VAL  30  10.340  -2.501   3.062
  244    HB   VAL  30           HB       VAL  30   9.570  -5.027   3.699
  245   HG11  VAL  30          1HG1      VAL  30   9.775  -3.669   1.036
  246   HG12  VAL  30          2HG1      VAL  30   8.365  -3.861   2.082
  247   HG13  VAL  30          3HG1      VAL  30   9.019  -5.250   1.216
  248   HG21  VAL  30          3HG2      VAL  30  12.001  -5.712   3.239
  249   HG22  VAL  30          1HG2      VAL  30  11.586  -5.502   1.537
  250   HG23  VAL  30          2HG2      VAL  30  10.707  -6.670   2.523
  251    H    GLU  31           H        GLU  31   9.816  -1.657   4.967
  252    HA   GLU  31           HA       GLU  31  10.962  -2.780   7.404
  253    HB2  GLU  31           2HB      GLU  31  10.212  -0.158   6.534
  254    HB3  GLU  31           1HB      GLU  31   9.283  -0.556   7.974
  255    HG2  GLU  31           2HG      GLU  31  11.123  -0.626   9.314
  256    HG3  GLU  31           1HG      GLU  31  12.199  -1.102   8.001
  257    H    LEU  32           H        LEU  32   9.646  -3.325   9.222
  258    HA   LEU  32           HA       LEU  32   6.806  -3.774   8.623
  259    HG   LEU  32           HG       LEU  32   6.006  -6.433   8.429
  260    HB2  LEU  32           2HB      LEU  32   8.269  -5.825   8.251
  261    HB3  LEU  32           1HB      LEU  32   8.514  -5.850   9.984
  262   HD11  LEU  32          1HD1      LEU  32   6.206  -8.236  10.438
  263   HD12  LEU  32          2HD1      LEU  32   7.906  -7.876  10.141
  264   HD13  LEU  32          3HD1      LEU  32   6.886  -8.458   8.826
  265   HD21  LEU  32          3HD2      LEU  32   6.205  -5.624  11.328
  266   HD22  LEU  32          1HD2      LEU  32   4.851  -6.539  10.669
  267   HD23  LEU  32          2HD2      LEU  32   5.190  -4.915  10.073
  268    H    THR  33           H        THR  33   5.795  -2.539  10.041
  269    HA   THR  33           HA       THR  33   6.528  -2.816  12.902
  270    HB   THR  33           HB       THR  33   5.502  -0.329  12.881
  271    HG1  THR  33           1HG      THR  33   5.714   0.662  11.040
  272   HG21  THR  33          3HG2      THR  33   7.511  -0.298  13.894
  273   HG22  THR  33          1HG2      THR  33   8.018   0.397  12.354
  274   HG23  THR  33          2HG2      THR  33   8.269  -1.319  12.671
  275    HA   PRO  34           HA       PRO  34   2.207  -3.546  13.402
  276    HB2  PRO  34           2HB      PRO  34   1.627  -2.480  15.799
  277    HB3  PRO  34           1HB      PRO  34   2.671  -3.888  15.617
  278    HG2  PRO  34           2HG      PRO  34   3.411  -1.040  16.106
  279    HG3  PRO  34           1HG      PRO  34   4.121  -2.515  16.782
  280    HD2  PRO  34           2HD      PRO  34   5.189  -1.079  14.680
  281    HD3  PRO  34           1HD      PRO  34   5.520  -2.793  15.000
  282    H    GLU  35           H        GLU  35   2.562  -1.476  11.681
  283    HA   GLU  35           HA       GLU  35   0.161   0.040  12.082
  284    HB2  GLU  35           2HB      GLU  35   2.805   1.499  11.882
  285    HB3  GLU  35           1HB      GLU  35   1.214   2.249  11.854
  286    HG2  GLU  35           2HG      GLU  35   0.834   1.270  14.134
  287    HG3  GLU  35           1HG      GLU  35   2.537   0.813  14.135
  288    H    ARG  36           H        ARG  36   3.070  -0.474  10.056
  289    HA   ARG  36           HA       ARG  36   1.478  -0.814   7.747
  290    HE   ARG  36           HE       ARG  36   2.348   2.951  10.365
  291    HB2  ARG  36           2HB      ARG  36   2.340   1.156   6.481
  292    HB3  ARG  36           1HB      ARG  36   1.232   1.570   7.780
  293    HG2  ARG  36           2HG      ARG  36   3.594   1.725   9.079
  294    HG3  ARG  36           1HG      ARG  36   4.082   2.194   7.450
  295    HD2  ARG  36           2HD      ARG  36   3.429   4.241   8.101
  296    HD3  ARG  36           1HD      ARG  36   1.815   3.636   7.734
  297   HH11  ARG  36          1HH1      ARG  36   2.011   5.870   8.483
  298   HH12  ARG  36          2HH1      ARG  36   1.436   6.813   9.817
  299   HH21  ARG  36          1HH2      ARG  36   1.591   4.189  12.121
  300   HH22  ARG  36          2HH2      ARG  36   1.197   5.859  11.883
  301    H    GLY  37           H        GLY  37   2.786  -0.878   5.723
  302    HA2  GLY  37           2HA      GLY  37   5.431  -2.054   6.297
  303    HA3  GLY  37           1HA      GLY  37   4.399  -2.517   4.952
  304    H    PHE  38           H        PHE  38   7.119  -0.717   5.676
  305    HA   PHE  38           HA       PHE  38   6.615   1.308   3.609
  306    HD1  PHE  38           2HD      PHE  38   7.200   3.767   3.729
  307    HD2  PHE  38           1HD      PHE  38  10.842   1.916   4.949
  308    HE1  PHE  38           2HE      PHE  38   8.473   5.609   2.729
  309    HE2  PHE  38           1HE      PHE  38  12.116   3.753   3.939
  310    HZ   PHE  38           HZ       PHE  38  10.934   5.602   2.819
  311    HB2  PHE  38           2HB      PHE  38   7.469   2.060   5.780
  312    HB3  PHE  38           1HB      PHE  38   8.851   0.989   5.628
  313    H    ILE  39           H        ILE  39   7.435   1.124   1.660
  314    HA   ILE  39           HA       ILE  39   9.787  -0.596   1.204
  315    HB   ILE  39           HB       ILE  39   7.562  -0.657  -0.800
  316   HG12  ILE  39          2HG1      ILE  39   7.661  -2.215   1.780
  317   HG13  ILE  39          1HG1      ILE  39   6.291  -1.396   1.040
  318   HG21  ILE  39          1HG2      ILE  39   8.919  -3.128  -0.511
  319   HG22  ILE  39          2HG2      ILE  39  10.128  -1.846  -0.491
  320   HG23  ILE  39          3HG2      ILE  39   9.003  -1.976  -1.841
  321   HD11  ILE  39          3HD1      ILE  39   6.146  -3.859   0.983
  322   HD12  ILE  39          1HD1      ILE  39   7.566  -3.887  -0.061
  323   HD13  ILE  39          2HD1      ILE  39   6.080  -3.112  -0.613
  324    H    ASP  40           H        ASP  40  11.216   1.004   0.575
  325    HA   ASP  40           HA       ASP  40  10.242   2.938  -1.408
  326    HB2  ASP  40           2HB      ASP  40  12.526   4.067  -0.837
  327    HB3  ASP  40           1HB      ASP  40  11.166   4.227   0.266
  328    H    PHE  41           H        PHE  41  10.802   2.779  -3.412
  329    HA   PHE  41           HA       PHE  41  12.824   0.838  -4.227
  330    HD1  PHE  41           2HD      PHE  41  10.922  -0.289  -3.683
  331    HD2  PHE  41           1HD      PHE  41  10.596   0.310  -7.885
  332    HE1  PHE  41           2HE      PHE  41  10.025  -2.562  -3.932
  333    HE2  PHE  41           1HE      PHE  41   9.696  -1.967  -8.140
  334    HZ   PHE  41           HZ       PHE  41   9.410  -3.405  -6.163
  335    HB2  PHE  41           2HB      PHE  41  10.528   2.232  -5.517
  336    HB3  PHE  41           1HB      PHE  41  11.879   1.809  -6.557
  337    H    GLY  42           H        GLY  42  12.982   3.890  -3.226
  338    HA2  GLY  42           2HA      GLY  42  15.121   5.024  -3.434
  339    HA3  GLY  42           1HA      GLY  42  15.110   4.605  -5.143
  340    H    ASP  43           H        ASP  43  13.800   5.775  -6.571
  341    HA   ASP  43           HA       ASP  43  13.034   8.421  -5.595
  342    HB2  ASP  43           2HB      ASP  43  14.288   7.624  -7.907
  343    HB3  ASP  43           1HB      ASP  43  12.625   7.822  -8.450
  344    H    SER  44           H        SER  44  11.440   6.621  -4.528
  345    HA   SER  44           HA       SER  44   8.856   7.342  -5.026
  346    HG   SER  44           HG       SER  44  10.462   4.437  -6.446
  347    HB2  SER  44           2HB      SER  44   8.229   4.966  -6.167
  348    HB3  SER  44           1HB      SER  44   8.547   6.425  -7.110
  349    H    ASN  45           H        ASN  45   7.283   5.953  -3.788
  350    HA   ASN  45           HA       ASN  45   8.489   3.820  -2.223
  351    HB2  ASN  45           2HB      ASN  45   7.115   5.937  -0.620
  352    HB3  ASN  45           1HB      ASN  45   8.363   4.799  -0.129
  353   HD21  ASN  45          1HD2      ASN  45  10.105   5.832   0.468
  354   HD22  ASN  45          2HD2      ASN  45  10.795   7.213  -0.305
  355    H    CYS  46           H        CYS  46   6.807   2.880  -0.666
  356    HA   CYS  46           HA       CYS  46   4.055   3.331  -1.436
  357    HG   CYS  46           HG       CYS  46   6.281   0.812  -3.639
  358    HB2  CYS  46           2HB      CYS  46   4.084   0.606  -1.649
  359    HB3  CYS  46           1HB      CYS  46   4.101   1.715  -3.014
  360    H    GLU  47           H        GLU  47   3.379   3.708   0.602
  361    HA   GLU  47           HA       GLU  47   4.136   1.818   2.711
  362    HB2  GLU  47           2HB      GLU  47   4.281   4.479   2.787
  363    HB3  GLU  47           1HB      GLU  47   2.600   4.321   3.273
  364    HG2  GLU  47           2HG      GLU  47   3.133   3.385   5.295
  365    HG3  GLU  47           1HG      GLU  47   4.659   2.714   4.715
  366    H    LEU  48           H        LEU  48   2.495   0.942   4.109
  367    HA   LEU  48           HA       LEU  48  -0.257   1.167   3.136
  368    HG   LEU  48           HG       LEU  48  -1.003  -2.059   4.025
  369    HB2  LEU  48           2HB      LEU  48   0.682  -0.740   1.920
  370    HB3  LEU  48           1HB      LEU  48   1.187  -1.479   3.426
  371   HD11  LEU  48          1HD1      LEU  48  -2.939  -1.265   2.486
  372   HD12  LEU  48          2HD1      LEU  48  -1.837   0.051   2.084
  373   HD13  LEU  48          3HD1      LEU  48  -2.338  -0.203   3.756
  374   HD21  LEU  48          3HD2      LEU  48  -0.353  -3.587   2.402
  375   HD22  LEU  48          1HD2      LEU  48  -0.516  -2.417   1.092
  376   HD23  LEU  48          2HD2      LEU  48  -1.954  -3.075   1.873
  377    H    LEU  49           H        LEU  49  -1.440   1.697   4.824
  378    HA   LEU  49           HA       LEU  49  -0.582   0.947   7.523
  379    HG   LEU  49           HG       LEU  49  -1.905   1.808   9.321
  380    HB2  LEU  49           2HB      LEU  49  -1.530   3.268   6.814
  381    HB3  LEU  49           1HB      LEU  49  -3.088   2.469   6.914
  382   HD11  LEU  49          1HD1      LEU  49  -0.174   3.234   9.526
  383   HD12  LEU  49          2HD1      LEU  49  -1.441   4.375   9.979
  384   HD13  LEU  49          3HD1      LEU  49  -0.816   4.360   8.330
  385   HD21  LEU  49          3HD2      LEU  49  -3.481   3.503  10.249
  386   HD22  LEU  49          1HD2      LEU  49  -4.213   2.406   9.077
  387   HD23  LEU  49          2HD2      LEU  49  -3.790   4.050   8.602
  388    H    ALA  50           H        ALA  50  -1.483  -0.660   8.694
  389    HA   ALA  50           HA       ALA  50  -4.013  -1.782   7.727
  390    HB1  ALA  50           3HB      ALA  50  -2.556  -3.209   6.672
  391    HB2  ALA  50           1HB      ALA  50  -2.928  -4.054   8.164
  392    HB3  ALA  50           2HB      ALA  50  -1.408  -3.191   8.012
  393    H    HIS  51           H        HIS  51  -5.409  -1.788   9.302
  394    HA   HIS  51           HA       HIS  51  -4.530  -2.488  11.987
  395    HD1  HIS  51           1HD      HIS  51  -7.461   0.235  13.943
  396    HD2  HIS  51           2HD      HIS  51  -3.582  -1.222  13.595
  397    HE1  HIS  51           1HE      HIS  51  -6.404   0.586  16.197
  398    HE2  HIS  51           2HE      HIS  51  -4.086  -0.378  15.985
  399    HB2  HIS  51           2HB      HIS  51  -5.672  -0.101  11.231
  400    HB3  HIS  51           1HB      HIS  51  -7.070  -1.014  11.779
  401    HA   PRO  52           HA       PRO  52  -7.122  -6.001  12.309
  402    HB2  PRO  52           2HB      PRO  52  -8.833  -4.487  14.238
  403    HB3  PRO  52           1HB      PRO  52  -8.150  -6.113  14.369
  404    HG2  PRO  52           2HG      PRO  52  -7.020  -4.091  15.650
  405    HG3  PRO  52           1HG      PRO  52  -6.021  -5.324  14.864
  406    HD2  PRO  52           2HD      PRO  52  -6.603  -2.529  14.005
  407    HD3  PRO  52           1HD      PRO  52  -5.131  -3.490  13.785
  408    H    ASP  53           H        ASP  53  -8.735  -2.958  11.565
  409    HA   ASP  53           HA       ASP  53 -10.655  -4.514  10.024
  410    HB2  ASP  53           2HB      ASP  53 -11.520  -3.808  12.394
  411    HB3  ASP  53           1HB      ASP  53 -11.750  -2.239  11.627
  412    H    HIS  54           H        HIS  54  -8.459  -2.097   9.874
  413    HA   HIS  54           HA       HIS  54  -9.787  -1.123   7.498
  414    HD1  HIS  54           1HD      HIS  54  -6.999   1.817   9.036
  415    HD2  HIS  54           2HD      HIS  54  -9.872   0.527  11.744
  416    HE1  HIS  54           1HE      HIS  54  -6.110   2.438  11.304
  417    HE2  HIS  54           2HE      HIS  54  -7.946   1.801  12.907
  418    HB2  HIS  54           2HB      HIS  54  -9.334   1.262   7.990
  419    HB3  HIS  54           1HB      HIS  54 -10.530   0.538   9.050
  420    H    VAL  55           H        VAL  55  -8.365  -0.000   5.975
  421    HA   VAL  55           HA       VAL  55  -5.519  -0.326   6.529
  422    HB   VAL  55           HB       VAL  55  -6.694  -2.279   5.189
  423   HG11  VAL  55          1HG1      VAL  55  -7.466  -0.460   3.481
  424   HG12  VAL  55          2HG1      VAL  55  -6.954  -2.054   2.931
  425   HG13  VAL  55          3HG1      VAL  55  -5.845  -0.688   2.827
  426   HG21  VAL  55          3HG2      VAL  55  -4.059  -1.131   4.301
  427   HG22  VAL  55          1HG2      VAL  55  -4.584  -2.810   4.159
  428   HG23  VAL  55          2HG2      VAL  55  -4.306  -2.104   5.752
  429    H    LEU  56           H        LEU  56  -4.259   1.208   5.640
  430    HA   LEU  56           HA       LEU  56  -5.558   3.197   3.892
  431    HG   LEU  56           HG       LEU  56  -6.226   4.808   5.876
  432    HB2  LEU  56           2HB      LEU  56  -4.212   3.540   6.419
  433    HB3  LEU  56           1HB      LEU  56  -3.317   4.383   5.176
  434   HD11  LEU  56          1HD1      LEU  56  -4.401   5.594   7.485
  435   HD12  LEU  56          2HD1      LEU  56  -5.604   6.770   6.958
  436   HD13  LEU  56          3HD1      LEU  56  -3.995   6.773   6.236
  437   HD21  LEU  56          3HD2      LEU  56  -6.269   5.496   3.702
  438   HD22  LEU  56          1HD2      LEU  56  -4.531   5.794   3.646
  439   HD23  LEU  56          2HD2      LEU  56  -5.601   6.956   4.425
  440    H    MET  57           H        MET  57  -4.409   3.933   2.125
  441    HA   MET  57           HA       MET  57  -1.815   2.623   1.669
  442    HB2  MET  57           2HB      MET  57  -3.766   3.147  -0.552
  443    HB3  MET  57           1HB      MET  57  -2.390   2.050  -0.529
  444    HG2  MET  57           2HG      MET  57  -3.538   0.606   1.066
  445    HG3  MET  57           1HG      MET  57  -4.912   1.714   1.078
  446    HE1  MET  57           3HE      MET  57  -7.136   0.426  -1.523
  447    HE2  MET  57           1HE      MET  57  -6.746   1.773  -0.454
  448    HE3  MET  57           2HE      MET  57  -6.898   0.143   0.201
  449    H    ILE  58           H        ILE  58  -0.256   4.135   1.605
  450    HA   ILE  58           HA       ILE  58  -0.851   6.661   0.222
  451    HB   ILE  58           HB       ILE  58   1.024   6.312   2.567
  452   HG12  ILE  58          2HG1      ILE  58  -1.830   6.642   2.534
  453   HG13  ILE  58          1HG1      ILE  58  -0.759   6.491   3.913
  454   HG21  ILE  58          1HG2      ILE  58   0.082   8.790   1.140
  455   HG22  ILE  58          2HG2      ILE  58   1.684   8.058   1.007
  456   HG23  ILE  58          3HG2      ILE  58   1.152   8.745   2.541
  457   HD11  ILE  58          3HD1      ILE  58  -0.573   8.780   4.185
  458   HD12  ILE  58          1HD1      ILE  58  -2.260   8.565   3.724
  459   HD13  ILE  58          2HD1      ILE  58  -1.084   9.124   2.532
  460    H    LEU  59           H        LEU  59   0.647   7.348  -1.256
  461    HA   LEU  59           HA       LEU  59   3.087   5.720  -1.496
  462    HG   LEU  59           HG       LEU  59   1.268   6.704  -5.228
  463    HB2  LEU  59           2HB      LEU  59   2.909   5.583  -3.799
  464    HB3  LEU  59           1HB      LEU  59   1.267   5.331  -3.255
  465   HD11  LEU  59          1HD1      LEU  59   0.647   8.328  -2.781
  466   HD12  LEU  59          2HD1      LEU  59  -0.425   7.164  -3.558
  467   HD13  LEU  59          3HD1      LEU  59   0.043   8.639  -4.406
  468   HD21  LEU  59          3HD2      LEU  59   2.556   9.040  -4.020
  469   HD22  LEU  59          1HD2      LEU  59   2.625   8.425  -5.664
  470   HD23  LEU  59          2HD2      LEU  59   3.635   7.707  -4.415
  471    H    ASN  60           H        ASN  60   4.970   6.726  -2.055
  472    HA   ASN  60           HA       ASN  60   4.860   9.670  -2.220
  473    HB2  ASN  60           2HB      ASN  60   7.097   8.041  -0.987
  474    HB3  ASN  60           1HB      ASN  60   6.966   9.797  -1.021
  475   HD21  ASN  60          1HD2      ASN  60   7.332   9.297   1.338
  476   HD22  ASN  60          2HD2      ASN  60   5.921   9.087   2.313
  477    H    SER  61           H        SER  61   5.102  10.008  -4.360
  478    HA   SER  61           HA       SER  61   7.584   8.988  -5.565
  479    HG   SER  61           HG       SER  61   5.602   6.954  -5.229
  480    HB2  SER  61           2HB      SER  61   5.295   8.764  -7.391
  481    HB3  SER  61           1HB      SER  61   6.652   7.672  -7.145
  482    HA   PRO  62           HA       PRO  62   7.823  13.105  -7.192
  483    HB2  PRO  62           2HB      PRO  62   9.739  12.641  -9.047
  484    HB3  PRO  62           1HB      PRO  62  10.050  12.756  -7.314
  485    HG2  PRO  62           2HG      PRO  62   9.681  10.296  -8.991
  486    HG3  PRO  62           1HG      PRO  62  10.940  10.647  -7.788
  487    HD2  PRO  62           2HD      PRO  62   8.829   9.142  -7.177
  488    HD3  PRO  62           1HD      PRO  62   9.501  10.289  -6.004
  489    H    ASP  63           H        ASP  63   6.704  10.421  -9.049
  490    HA   ASP  63           HA       ASP  63   5.672  12.337 -11.008
  491    HB2  ASP  63           2HB      ASP  63   7.485  11.523 -12.243
  492    HB3  ASP  63           1HB      ASP  63   7.311   9.891 -11.611
  493    H    GLU  64           H        GLU  64   3.625  11.770 -11.904
  494    HA   GLU  64           HA       GLU  64   1.981  10.191 -10.212
  495    HB2  GLU  64           2HB      GLU  64   1.521  11.457 -12.886
  496    HB3  GLU  64           1HB      GLU  64   0.428  10.183 -12.376
  497    HG2  GLU  64           2HG      GLU  64  -0.662  11.955 -11.497
  498    HG3  GLU  64           1HG      GLU  64   0.391  11.563 -10.132
  499    H    ASP  65           H        ASP  65   3.523   9.310 -13.332
  500    HA   ASP  65           HA       ASP  65   2.386   6.837 -13.756
  501    HB2  ASP  65           2HB      ASP  65   4.204   7.991 -15.122
  502    HB3  ASP  65           1HB      ASP  65   5.356   7.343 -13.956
  503    H    SER  66           H        SER  66   5.242   7.578 -11.806
  504    HA   SER  66           HA       SER  66   5.541   5.040 -10.610
  505    HG   SER  66           HG       SER  66   7.829   5.422  -9.099
  506    HB2  SER  66           2HB      SER  66   7.288   6.838 -10.598
  507    HB3  SER  66           1HB      SER  66   6.301   7.723  -9.433
  508    H    LEU  67           H        LEU  67   4.212   8.037  -9.377
  509    HA   LEU  67           HA       LEU  67   3.180   7.439  -6.973
  510    HG   LEU  67           HG       LEU  67   0.967   9.185  -6.465
  511    HB2  LEU  67           2HB      LEU  67   3.009   9.637  -7.785
  512    HB3  LEU  67           1HB      LEU  67   2.157   9.140  -9.216
  513   HD11  LEU  67          1HD1      LEU  67  -0.317  11.065  -7.972
  514   HD12  LEU  67          2HD1      LEU  67   1.370  11.253  -8.442
  515   HD13  LEU  67          3HD1      LEU  67   0.909  11.378  -6.745
  516   HD21  LEU  67          3HD2      LEU  67  -0.387   7.689  -7.570
  517   HD22  LEU  67          1HD2      LEU  67  -0.087   8.433  -9.141
  518   HD23  LEU  67          2HD2      LEU  67  -1.159   9.218  -7.984
  519    H    ALA  68           H        ALA  68   1.234   7.058  -9.960
  520    HA   ALA  68           HA       ALA  68  -0.846   5.669  -8.635
  521    HB1  ALA  68           3HB      ALA  68  -1.339   4.886 -11.074
  522    HB2  ALA  68           1HB      ALA  68  -0.071   6.032 -11.508
  523    HB3  ALA  68           2HB      ALA  68  -1.511   6.591 -10.655
  524    H    HIS  69           H        HIS  69   2.127   4.643 -10.208
  525    HA   HIS  69           HA       HIS  69   1.665   1.912 -10.446
  526    HD1  HIS  69           1HD      HIS  69   6.068   1.882 -11.612
  527    HD2  HIS  69           2HD      HIS  69   2.737  -0.198 -10.253
  528    HE1  HIS  69           1HE      HIS  69   6.519  -0.533 -12.147
  529    HE2  HIS  69           2HE      HIS  69   4.452  -1.762 -11.392
  530    HB2  HIS  69           2HB      HIS  69   3.710   3.301 -11.193
  531    HB3  HIS  69           1HB      HIS  69   4.324   3.018  -9.569
  532    H    MET  70           H        MET  70   2.653   3.838  -7.684
  533    HA   MET  70           HA       MET  70   3.001   1.558  -5.955
  534    HB2  MET  70           2HB      MET  70   2.599   4.135  -4.624
  535    HB3  MET  70           1HB      MET  70   3.931   3.007  -4.476
  536    HG2  MET  70           2HG      MET  70   3.576   5.057  -6.647
  537    HG3  MET  70           1HG      MET  70   4.691   5.145  -5.288
  538    HE1  MET  70           3HE      MET  70   6.971   3.650  -5.116
  539    HE2  MET  70           1HE      MET  70   7.118   2.163  -6.054
  540    HE3  MET  70           2HE      MET  70   5.775   2.366  -4.931
  541    H    GLN  71           H        GLN  71   0.624   4.271  -5.935
  542    HA   GLN  71           HA       GLN  71  -1.007   3.207  -3.967
  543    HB2  GLN  71           2HB      GLN  71  -2.877   4.559  -5.193
  544    HB3  GLN  71           1HB      GLN  71  -1.581   5.389  -4.356
  545    HG2  GLN  71           2HG      GLN  71  -0.964   6.402  -6.223
  546    HG3  GLN  71           1HG      GLN  71  -0.908   4.883  -7.112
  547   HE21  GLN  71          1HE2      GLN  71  -3.207   3.993  -7.549
  548   HE22  GLN  71          2HE2      GLN  71  -4.323   5.143  -8.196
  549    H    ASN  72           H        ASN  72  -0.835   2.340  -7.339
  550    HA   ASN  72           HA       ASN  72  -3.351   0.923  -7.282
  551    HB2  ASN  72           2HB      ASN  72  -2.094   2.022  -9.327
  552    HB3  ASN  72           1HB      ASN  72  -1.319   0.441  -9.416
  553   HD21  ASN  72          1HD2      ASN  72  -2.608   0.922 -11.557
  554   HD22  ASN  72          2HD2      ASN  72  -4.159   0.164 -11.625
  555    H    VAL  73           H        VAL  73   0.093   0.049  -7.319
  556    HA   VAL  73           HA       VAL  73  -0.003  -2.668  -7.485
  557    HB   VAL  73           HB       VAL  73   1.794  -0.827  -5.953
  558   HG11  VAL  73          1HG1      VAL  73   3.252  -2.767  -5.404
  559   HG12  VAL  73          2HG1      VAL  73   1.922  -3.836  -5.852
  560   HG13  VAL  73          3HG1      VAL  73   1.741  -2.726  -4.493
  561   HG21  VAL  73          3HG2      VAL  73   3.263  -1.158  -7.656
  562   HG22  VAL  73          1HG2      VAL  73   1.760  -1.464  -8.526
  563   HG23  VAL  73          2HG2      VAL  73   2.731  -2.815  -7.942
  564    H    VAL  74           H        VAL  74  -0.674  -0.698  -4.629
  565    HA   VAL  74           HA       VAL  74  -1.010  -2.919  -2.866
  566    HB   VAL  74           HB       VAL  74  -1.981  -0.074  -2.595
  567   HG11  VAL  74          1HG1      VAL  74  -1.745  -2.155  -0.428
  568   HG12  VAL  74          2HG1      VAL  74  -3.259  -1.694  -1.205
  569   HG13  VAL  74          3HG1      VAL  74  -2.354  -0.510  -0.265
  570   HG21  VAL  74          3HG2      VAL  74   0.048  -0.572  -0.752
  571   HG22  VAL  74          1HG2      VAL  74   0.164   0.398  -2.220
  572   HG23  VAL  74          2HG2      VAL  74   0.608  -1.309  -2.253
  573    H    ALA  75           H        ALA  75  -3.329  -0.803  -4.602
  574    HA   ALA  75           HA       ALA  75  -5.717  -1.772  -3.686
  575    HB1  ALA  75           3HB      ALA  75  -4.927  -0.921  -6.466
  576    HB2  ALA  75           1HB      ALA  75  -5.777   0.015  -5.235
  577    HB3  ALA  75           2HB      ALA  75  -6.583  -1.336  -6.032
  578    H    ASP  76           H        ASP  76  -3.396  -3.298  -5.754
  579    HA   ASP  76           HA       ASP  76  -5.098  -5.428  -6.639
  580    HB2  ASP  76           2HB      ASP  76  -3.035  -4.653  -7.846
  581    HB3  ASP  76           1HB      ASP  76  -2.076  -5.384  -6.562
  582    H    HIS  77           H        HIS  77  -2.653  -5.064  -4.098
  583    HA   HIS  77           HA       HIS  77  -2.636  -7.718  -3.211
  584    HD1  HIS  77           1HD      HIS  77  -1.045  -6.635  -4.617
  585    HD2  HIS  77           2HD      HIS  77   0.765  -4.852  -1.329
  586    HE1  HIS  77           1HE      HIS  77   1.220  -5.891  -5.417
  587    HE2  HIS  77           2HE      HIS  77   2.328  -4.891  -3.387
  588    HB2  HIS  77           2HB      HIS  77  -2.186  -5.270  -1.494
  589    HB3  HIS  77           1HB      HIS  77  -1.589  -6.892  -1.198
  590    H    LEU  78           H        LEU  78  -4.714  -5.000  -2.249
  591    HA   LEU  78           HA       LEU  78  -6.042  -6.350  -0.159
  592    HG   LEU  78           HG       LEU  78  -5.169  -3.164  -0.424
  593    HB2  LEU  78           2HB      LEU  78  -6.810  -3.989  -1.871
  594    HB3  LEU  78           1HB      LEU  78  -7.816  -4.573  -0.563
  595   HD11  LEU  78          1HD1      LEU  78  -6.311  -1.678   0.995
  596   HD12  LEU  78          2HD1      LEU  78  -7.655  -2.798   1.221
  597   HD13  LEU  78          3HD1      LEU  78  -7.416  -2.009  -0.339
  598   HD21  LEU  78          3HD2      LEU  78  -6.335  -5.042   1.615
  599   HD22  LEU  78          1HD2      LEU  78  -5.285  -3.702   2.076
  600   HD23  LEU  78          2HD2      LEU  78  -4.683  -4.965   1.004
  601    H    GLN  79           H        GLN  79  -6.464  -6.297  -3.627
  602    HA   GLN  79           HA       GLN  79  -9.112  -7.366  -3.600
  603    HB2  GLN  79           2HB      GLN  79  -9.084  -7.061  -5.833
  604    HB3  GLN  79           1HB      GLN  79  -7.652  -6.114  -5.475
  605    HG2  GLN  79           2HG      GLN  79  -6.363  -8.308  -5.861
  606    HG3  GLN  79           1HG      GLN  79  -7.846  -8.864  -6.633
  607   HE21  GLN  79          1HE2      GLN  79  -5.477  -8.676  -8.020
  608   HE22  GLN  79          2HE2      GLN  79  -5.598  -7.413  -9.192
  609    H    ARG  80           H        ARG  80  -5.901  -8.840  -3.999
  610    HA   ARG  80           HA       ARG  80  -6.715 -11.416  -4.678
  611    HE   ARG  80           HE       ARG  80  -2.144 -11.498  -3.677
  612    HB2  ARG  80           2HB      ARG  80  -4.365 -10.667  -2.926
  613    HB3  ARG  80           1HB      ARG  80  -4.561 -12.170  -3.817
  614    HG2  ARG  80           2HG      ARG  80  -4.824 -10.301  -5.780
  615    HG3  ARG  80           1HG      ARG  80  -3.630  -9.557  -4.718
  616    HD2  ARG  80           2HD      ARG  80  -3.469 -12.342  -5.869
  617    HD3  ARG  80           1HD      ARG  80  -2.585 -10.936  -6.463
  618   HH11  ARG  80          1HH1      ARG  80  -1.120 -12.200  -6.939
  619   HH12  ARG  80          2HH1      ARG  80   0.471 -12.694  -6.467
  620   HH21  ARG  80          1HH2      ARG  80  -0.052 -12.148  -3.054
  621   HH22  ARG  80          2HH2      ARG  80   1.078 -12.664  -4.261
  622    H    MET  81           H        MET  81  -6.369  -9.850  -1.575
  623    HA   MET  81           HA       MET  81  -7.172 -12.217  -0.116
  624    HB2  MET  81           2HB      MET  81  -6.933 -10.812   1.884
  625    HB3  MET  81           1HB      MET  81  -5.510 -10.775   0.860
  626    HG2  MET  81           2HG      MET  81  -5.790  -8.579   1.561
  627    HG3  MET  81           1HG      MET  81  -6.414  -8.601  -0.082
  628    HE1  MET  81           3HE      MET  81  -8.361  -7.674   3.812
  629    HE2  MET  81           1HE      MET  81  -7.524  -6.430   2.883
  630    HE3  MET  81           2HE      MET  81  -6.674  -7.902   3.351
  631    H    ALA  82           H        ALA  82  -8.812  -9.710  -1.689
  632    HA   ALA  82           HA       ALA  82 -11.275 -10.440  -0.243
  633    HB1  ALA  82           3HB      ALA  82 -10.323  -7.641  -0.805
  634    HB2  ALA  82           1HB      ALA  82 -10.706  -8.371   0.755
  635    HB3  ALA  82           2HB      ALA  82 -11.995  -8.032  -0.400
  636    H    ASN  83           H        ASN  83 -12.673 -11.239  -1.632
  637    HA   ASN  83           HA       ASN  83 -13.753 -11.750  -3.573
  638    HB2  ASN  83           2HB      ASN  83 -13.696  -8.779  -3.411
  639    HB3  ASN  83           1HB      ASN  83 -14.274  -9.502  -4.910
  640   HD21  ASN  83          1HD2      ASN  83 -14.627 -10.169  -1.438
  641   HD22  ASN  83          2HD2      ASN  83 -16.348 -10.311  -1.470
  642    H    SER  84           H        SER  84 -13.805 -11.005  -6.093
  643    HA   SER  84           HA       SER  84 -11.044 -11.411  -7.008
  644    HG   SER  84           HG       SER  84 -11.576 -11.817  -9.753
  645    HB2  SER  84           2HB      SER  84 -12.828 -13.127  -7.566
  646    HB3  SER  84           1HB      SER  84 -13.564 -11.901  -8.600
  647    H    GLU  85           H        GLU  85 -13.724  -9.232  -7.133
  648    HA   GLU  85           HA       GLU  85 -13.204  -7.850  -9.503
  649    HB2  GLU  85           2HB      GLU  85 -14.413  -5.976  -8.479
  650    HB3  GLU  85           1HB      GLU  85 -15.236  -7.501  -8.186
  651    HG2  GLU  85           2HG      GLU  85 -14.017  -7.522  -5.942
  652    HG3  GLU  85           1HG      GLU  85 -13.664  -5.825  -6.266
  653    H    SER  86           H        SER  86 -12.530  -5.368  -9.336
  654    HA   SER  86           HA       SER  86  -9.778  -5.436  -8.394
  655    HG   SER  86           HG       SER  86 -11.127  -5.364 -10.997
  656    HB2  SER  86           2HB      SER  86 -11.169  -3.243  -9.947
  657    HB3  SER  86           1HB      SER  86  -9.431  -3.468  -9.745
  658    H    LEU  87           H        LEU  87 -10.651  -5.456  -6.155
  659    HA   LEU  87           HA       LEU  87 -11.572  -4.364  -4.266
  660    HG   LEU  87           HG       LEU  87  -8.456  -4.511  -2.669
  661    HB2  LEU  87           2HB      LEU  87  -8.801  -3.945  -4.806
  662    HB3  LEU  87           1HB      LEU  87  -9.435  -2.471  -4.110
  663   HD11  LEU  87          1HD1      LEU  87  -8.834  -2.375  -1.739
  664   HD12  LEU  87          2HD1      LEU  87  -9.748  -3.519  -0.756
  665   HD13  LEU  87          3HD1      LEU  87 -10.580  -2.518  -1.946
  666   HD21  LEU  87          3HD2      LEU  87 -10.104  -5.863  -1.699
  667   HD22  LEU  87          1HD2      LEU  87 -10.436  -5.926  -3.429
  668   HD23  LEU  87          2HD2      LEU  87 -11.416  -4.903  -2.380
  669    H    GLU  88           H        GLU  88 -13.275  -3.030  -4.142
  670    HA   GLU  88           HA       GLU  88 -13.396  -0.583  -5.625
  671    HB2  GLU  88           2HB      GLU  88 -15.437  -1.835  -4.947
  672    HB3  GLU  88           1HB      GLU  88 -15.075  -1.479  -3.264
  673    HG2  GLU  88           2HG      GLU  88 -15.596   0.764  -3.488
  674    HG3  GLU  88           1HG      GLU  88 -15.390   0.739  -5.240
  675    H    ILE  89           H        ILE  89 -11.738   0.763  -5.116
  676    HA   ILE  89           HA       ILE  89 -11.648   1.738  -2.352
  677    HB   ILE  89           HB       ILE  89  -9.299   1.698  -2.213
  678   HG12  ILE  89          2HG1      ILE  89  -8.969   2.539  -4.622
  679   HG13  ILE  89          1HG1      ILE  89  -7.753   1.455  -3.972
  680   HG21  ILE  89          1HG2      ILE  89  -8.653  -0.646  -2.912
  681   HG22  ILE  89          2HG2      ILE  89 -10.290  -0.785  -3.552
  682   HG23  ILE  89          3HG2      ILE  89 -10.041  -0.485  -1.834
  683   HD11  ILE  89          3HD1      ILE  89  -8.260   0.856  -6.242
  684   HD12  ILE  89          1HD1      ILE  89  -9.974   0.711  -5.856
  685   HD13  ILE  89          2HD1      ILE  89  -8.814  -0.417  -5.152
  686    H    ALA  90           H        ALA  90 -11.721   3.971  -2.200
  687    HA   ALA  90           HA       ALA  90 -11.755   5.429  -4.712
  688    HB1  ALA  90           3HB      ALA  90 -12.507   7.333  -3.485
  689    HB2  ALA  90           1HB      ALA  90 -12.045   6.610  -1.947
  690    HB3  ALA  90           2HB      ALA  90 -13.394   5.940  -2.870
  691    H    TRP  91           H        TRP  91  -9.897   5.953  -5.584
  692    HA   TRP  91           HA       TRP  91  -7.596   6.542  -3.883
  693    HD1  TRP  91           HD       TRP  91  -8.964   4.194  -7.439
  694    HE1  TRP  91           1HE      TRP  91  -9.682   5.090  -9.743
  695    HE3  TRP  91           3HE      TRP  91  -6.611   8.732  -7.317
  696    HZ2  TRP  91           2HZ      TRP  91  -9.302   7.412 -11.301
  697    HZ3  TRP  91           3HZ      TRP  91  -6.839  10.231  -9.255
  698    HH2  TRP  91           HH       TRP  91  -8.156   9.584 -11.205
  699    HB2  TRP  91           2HB      TRP  91  -6.299   6.432  -5.998
  700    HB3  TRP  91           1HB      TRP  91  -7.198   4.953  -5.671
  701    H    GLN  92           H        GLN  92  -6.717   8.510  -3.687
  702    HA   GLN  92           HA       GLN  92  -8.153  10.746  -4.864
  703    HB2  GLN  92           2HB      GLN  92  -5.982  10.595  -2.771
  704    HB3  GLN  92           1HB      GLN  92  -6.647  12.109  -3.366
  705    HG2  GLN  92           2HG      GLN  92  -8.764  11.662  -2.452
  706    HG3  GLN  92           1HG      GLN  92  -8.371   9.967  -2.168
  707   HE21  GLN  92          1HE2      GLN  92  -9.260  10.703  -0.020
  708   HE22  GLN  92          2HE2      GLN  92  -8.116  11.295   1.133
  709    HA   PRO  93           HA       PRO  93  -5.519  11.779  -8.223
  710    HB2  PRO  93           2HB      PRO  93  -5.251  14.426  -6.882
  711    HB3  PRO  93           1HB      PRO  93  -5.642  14.059  -8.566
  712    HG2  PRO  93           2HG      PRO  93  -7.552  14.800  -6.860
  713    HG3  PRO  93           1HG      PRO  93  -7.853  13.550  -8.082
  714    HD2  PRO  93           2HD      PRO  93  -7.464  13.276  -5.150
  715    HD3  PRO  93           1HD      PRO  93  -8.413  12.273  -6.265
  716    H    ALA  94           H        ALA  94  -4.476  12.877  -5.018
  717    HA   ALA  94           HA       ALA  94  -2.453  12.301  -3.984
  718    HB1  ALA  94           3HB      ALA  94  -0.671  11.320  -5.056
  719    HB2  ALA  94           1HB      ALA  94  -0.968  12.187  -6.560
  720    HB3  ALA  94           2HB      ALA  94  -1.993  10.825  -6.115
  721    H    GLU  95           H        GLU  95  -2.626  14.402  -6.798
  722    HA   GLU  95           HA       GLU  95  -1.178  16.452  -5.266
  723    HB2  GLU  95           2HB      GLU  95   0.045  15.244  -7.293
  724    HB3  GLU  95           1HB      GLU  95  -0.890  16.398  -8.234
  725    HG2  GLU  95           2HG      GLU  95   0.165  17.997  -6.302
  726    HG3  GLU  95           1HG      GLU  95   1.448  16.810  -6.529
  727    H    SER  96           H        SER  96  -1.673  18.657  -5.907
  728    HA   SER  96           HA       SER  96  -4.301  18.907  -7.215
  729    HG   SER  96           HG       SER  96  -5.135  18.384  -5.066
  730    HB2  SER  96           2HB      SER  96  -3.354  19.924  -4.596
  731    HB3  SER  96           1HB      SER  96  -4.314  21.044  -5.563
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1   7.011  13.393  -5.027
    2    HB2  MET   1           2HB      MET   1   7.605  13.747  -2.705
    3    HB3  MET   1           1HB      MET   1   8.920  14.269  -3.750
    4    HG2  MET   1           2HG      MET   1   7.060  16.410  -3.091
    5    HG3  MET   1           1HG      MET   1   7.834  15.698  -1.680
    6    HE1  MET   1           3HE      MET   1   8.820  19.004  -2.413
    7    HE2  MET   1           1HE      MET   1  10.198  18.386  -1.502
    8    HE3  MET   1           2HE      MET   1   8.567  17.834  -1.117
    9    H    PHE   2           H        PHE   2   4.907  13.359  -5.560
   10    HA   PHE   2           HA       PHE   2   3.064  15.164  -4.151
   11    HD1  PHE   2           2HD      PHE   2   3.583  16.570  -6.521
   12    HD2  PHE   2           1HD      PHE   2   3.005  12.655  -8.087
   13    HE1  PHE   2           2HE      PHE   2   4.882  17.181  -8.518
   14    HE2  PHE   2           1HE      PHE   2   4.289  13.266 -10.089
   15    HZ   PHE   2           HZ       PHE   2   5.238  15.527 -10.308
   16    HB2  PHE   2           2HB      PHE   2   1.991  13.221  -6.118
   17    HB3  PHE   2           1HB      PHE   2   1.586  14.917  -5.882
   18    H    ARG   3           H        ARG   3   0.912  13.976  -3.435
   19    HA   ARG   3           HA       ARG   3   1.464  11.250  -2.608
   20    HE   ARG   3           HE       ARG   3   4.591  10.652   1.502
   21    HB2  ARG   3           2HB      ARG   3   1.985  13.350  -0.815
   22    HB3  ARG   3           1HB      ARG   3   0.477  12.624  -0.273
   23    HG2  ARG   3           2HG      ARG   3   1.748  11.131   0.762
   24    HG3  ARG   3           1HG      ARG   3   2.039  10.444  -0.823
   25    HD2  ARG   3           2HD      ARG   3   4.191  10.996  -0.727
   26    HD3  ARG   3           1HD      ARG   3   3.790  12.676  -0.377
   27   HH11  ARG   3          1HH1      ARG   3   2.905  13.682   1.099
   28   HH12  ARG   3          2HH1      ARG   3   3.119  14.163   2.749
   29   HH21  ARG   3          1HH2      ARG   3   4.872  11.284   3.672
   30   HH22  ARG   3          2HH2      ARG   3   4.236  12.803   4.209
   31    H    SER   4           H        SER   4  -0.253  10.035  -2.795
   32    HA   SER   4           HA       SER   4  -2.943  11.225  -2.693
   33    HG   SER   4           HG       SER   4  -4.485   9.146  -4.181
   34    HB2  SER   4           2HB      SER   4  -2.904  10.445  -4.876
   35    HB3  SER   4           1HB      SER   4  -1.698   9.205  -4.516
   36    H    THR   5           H        THR   5  -4.641   9.636  -1.905
   37    HA   THR   5           HA       THR   5  -3.531   7.509  -0.266
   38    HB   THR   5           HB       THR   5  -4.526   8.234   1.796
   39    HG1  THR   5           1HG      THR   5  -6.365   9.239   1.207
   40   HG21  THR   5          3HG2      THR   5  -3.182   9.967   2.423
   41   HG22  THR   5          1HG2      THR   5  -3.384  10.834   0.903
   42   HG23  THR   5          2HG2      THR   5  -2.336   9.417   0.980
   43    H    SER   6           H        SER   6  -4.706   5.739  -0.318
   44    HA   SER   6           HA       SER   6  -7.521   5.962  -1.179
   45    HG   SER   6           HG       SER   6  -4.599   4.264  -2.546
   46    HB2  SER   6           2HB      SER   6  -6.038   3.368  -1.304
   47    HB3  SER   6           1HB      SER   6  -7.315   3.981  -2.353
   48    H    HIS   7           H        HIS   7  -9.111   5.224   0.125
   49    HA   HIS   7           HA       HIS   7  -8.308   3.798   2.586
   50    HD1  HIS   7           1HD      HIS   7  -9.857   6.955   5.071
   51    HD2  HIS   7           2HD      HIS   7 -10.104   2.850   4.478
   52    HE1  HIS   7           1HE      HIS   7 -10.088   5.956   7.366
   53    HE2  HIS   7           2HE      HIS   7 -10.326   3.479   6.974
   54    HB2  HIS   7           2HB      HIS   7  -9.249   6.227   2.696
   55    HB3  HIS   7           1HB      HIS   7 -10.803   5.456   2.406
   56    H    VAL   8           H        VAL   8  -9.247   1.872   3.015
   57    HA   VAL   8           HA       VAL   8 -11.761   1.168   1.675
   58    HB   VAL   8           HB       VAL   8  -9.556  -0.864   1.779
   59   HG11  VAL   8          1HG1      VAL   8 -10.795  -1.925   0.011
   60   HG12  VAL   8          2HG1      VAL   8 -11.888  -0.546  -0.105
   61   HG13  VAL   8          3HG1      VAL   8 -11.891  -1.556   1.342
   62   HG21  VAL   8          3HG2      VAL   8 -10.024   0.957  -0.575
   63   HG22  VAL   8          1HG2      VAL   8  -8.804  -0.305  -0.417
   64   HG23  VAL   8          2HG2      VAL   8  -8.701   1.149   0.575
   65    H    ARG   9           H        ARG   9 -12.934  -0.577   2.719
   66    HA   ARG   9           HA       ARG   9 -12.152  -0.851   5.534
   67    HE   ARG   9           HE       ARG   9 -15.532   0.854   3.706
   68    HB2  ARG   9           2HB      ARG   9 -14.776  -0.944   4.131
   69    HB3  ARG   9           1HB      ARG   9 -14.584  -1.928   5.574
   70    HG2  ARG   9           2HG      ARG   9 -15.525   0.170   6.208
   71    HG3  ARG   9           1HG      ARG   9 -13.864   0.098   6.804
   72    HD2  ARG   9           2HD      ARG   9 -14.454   2.287   5.806
   73    HD3  ARG   9           1HD      ARG   9 -13.100   1.494   5.003
   74   HH11  ARG   9          1HH1      ARG   9 -13.248   3.461   4.109
   75   HH12  ARG   9          2HH1      ARG   9 -13.612   4.184   2.578
   76   HH21  ARG   9          1HH2      ARG   9 -16.013   1.802   1.693
   77   HH22  ARG   9          2HH2      ARG   9 -15.183   3.243   1.206
   78    H    THR  10           H        THR  10 -10.851  -2.557   5.817
   79    HA   THR  10           HA       THR  10 -11.732  -5.154   4.752
   80    HB   THR  10           HB       THR  10  -9.495  -3.789   3.872
   81    HG1  THR  10           1HG      THR  10 -10.206  -5.364   2.610
   82   HG21  THR  10          3HG2      THR  10  -8.355  -6.123   5.289
   83   HG22  THR  10          1HG2      THR  10  -8.536  -4.608   6.178
   84   HG23  THR  10          2HG2      THR  10  -7.571  -4.657   4.695
   85    H    GLU  11           H        GLU  11 -10.993  -7.037   5.984
   86    HA   GLU  11           HA       GLU  11 -10.611  -6.363   8.824
   87    HB2  GLU  11           2HB      GLU  11 -12.348  -8.173   7.485
   88    HB3  GLU  11           1HB      GLU  11 -11.245  -9.120   8.476
   89    HG2  GLU  11           2HG      GLU  11 -12.289  -8.535  10.338
   90    HG3  GLU  11           1HG      GLU  11 -12.224  -6.825   9.913
   91    H    SER  12           H        SER  12  -9.008  -7.378  10.076
   92    HA   SER  12           HA       SER  12  -6.978  -8.279  10.526
   93    HG   SER  12           HG       SER  12  -5.634 -10.269   8.386
   94    HB2  SER  12           2HB      SER  12  -7.923 -10.398  10.049
   95    HB3  SER  12           1HB      SER  12  -7.871 -10.119   8.308
   96    H    ALA  13           H        ALA  13  -7.274  -6.128   8.540
   97    HA   ALA  13           HA       ALA  13  -5.585  -6.232   6.365
   98    HB1  ALA  13           3HB      ALA  13  -5.431  -3.878   6.463
   99    HB2  ALA  13           1HB      ALA  13  -5.748  -3.888   8.190
  100    HB3  ALA  13           2HB      ALA  13  -7.028  -4.314   7.066
  101    H    ALA  14           H        ALA  14  -4.615  -5.221   9.627
  102    HA   ALA  14           HA       ALA  14  -2.031  -4.518   9.258
  103    HB1  ALA  14           3HB      ALA  14  -1.579  -5.199  11.545
  104    HB2  ALA  14           1HB      ALA  14  -3.038  -6.191  11.547
  105    HB3  ALA  14           2HB      ALA  14  -3.164  -4.437  11.394
  106    H    ARG  15           H        ARG  15  -3.164  -7.813   8.952
  107    HA   ARG  15           HA       ARG  15  -0.515  -8.946   9.138
  108    HE   ARG  15           HE       ARG  15   0.834 -13.324   8.459
  109    HB2  ARG  15           2HB      ARG  15  -2.841 -10.040   9.645
  110    HB3  ARG  15           1HB      ARG  15  -2.840 -10.384   7.925
  111    HG2  ARG  15           2HG      ARG  15  -1.252 -11.570  10.097
  112    HG3  ARG  15           1HG      ARG  15  -1.911 -12.295   8.636
  113    HD2  ARG  15           2HD      ARG  15  -0.098 -11.516   7.317
  114    HD3  ARG  15           1HD      ARG  15   0.460 -10.437   8.593
  115   HH11  ARG  15          1HH1      ARG  15   1.233 -10.361  10.270
  116   HH12  ARG  15          2HH1      ARG  15   2.442 -11.022  11.316
  117   HH21  ARG  15          1HH2      ARG  15   2.420 -14.188   9.840
  118   HH22  ARG  15          2HH2      ARG  15   3.116 -13.191  11.074
  119    H    TYR  16           H        TYR  16  -2.738  -8.097   6.542
  120    HA   TYR  16           HA       TYR  16  -1.174  -9.291   4.488
  121    HD1  TYR  16           1HD      TYR  16  -2.802 -10.673   4.799
  122    HD2  TYR  16           2HD      TYR  16  -5.444  -7.581   3.518
  123    HE1  TYR  16           1HE      TYR  16  -4.704 -12.177   5.092
  124    HE2  TYR  16           2HE      TYR  16  -7.353  -9.092   3.819
  125    HH   TYR  16           HH       TYR  16  -7.094 -12.348   4.082
  126    HB2  TYR  16           2HB      TYR  16  -3.173  -7.037   4.220
  127    HB3  TYR  16           1HB      TYR  16  -2.547  -8.025   2.911
  128    H    VAL  17           H        VAL  17  -0.899  -6.320   6.230
  129    HA   VAL  17           HA       VAL  17   0.807  -5.061   4.257
  130    HB   VAL  17           HB       VAL  17  -0.003  -4.324   7.060
  131   HG11  VAL  17          1HG1      VAL  17   2.457  -3.509   5.686
  132   HG12  VAL  17          2HG1      VAL  17   2.023  -3.410   7.395
  133   HG13  VAL  17          3HG1      VAL  17   1.459  -2.178   6.270
  134   HG21  VAL  17          3HG2      VAL  17  -0.139  -2.777   4.488
  135   HG22  VAL  17          1HG2      VAL  17  -0.836  -2.322   6.042
  136   HG23  VAL  17          2HG2      VAL  17  -1.465  -3.725   5.166
  137    H    ASN  18           H        ASN  18   1.181  -6.682   7.388
  138    HA   ASN  18           HA       ASN  18   4.004  -6.396   7.486
  139    HB2  ASN  18           2HB      ASN  18   2.354  -8.468   8.931
  140    HB3  ASN  18           1HB      ASN  18   3.925  -7.827   9.406
  141   HD21  ASN  18          1HD2      ASN  18   1.743  -7.847  11.104
  142   HD22  ASN  18          2HD2      ASN  18   1.252  -6.218  11.408
  143    H    ARG  19           H        ARG  19   1.900  -8.829   6.080
  144    HA   ARG  19           HA       ARG  19   3.929 -10.815   5.838
  145    HE   ARG  19           HE       ARG  19   1.970 -15.342   6.450
  146    HB2  ARG  19           2HB      ARG  19   1.253 -10.908   5.705
  147    HB3  ARG  19           1HB      ARG  19   1.616 -10.855   3.984
  148    HG2  ARG  19           2HG      ARG  19   2.040 -13.021   4.021
  149    HG3  ARG  19           1HG      ARG  19   3.367 -12.727   5.144
  150    HD2  ARG  19           2HD      ARG  19   2.047 -13.143   7.011
  151    HD3  ARG  19           1HD      ARG  19   0.543 -12.922   6.116
  152   HH11  ARG  19          1HH1      ARG  19   0.118 -13.563   4.087
  153   HH12  ARG  19          2HH1      ARG  19  -0.397 -14.982   3.238
  154   HH21  ARG  19          1HH2      ARG  19   1.295 -17.209   5.334
  155   HH22  ARG  19          2HH2      ARG  19   0.272 -17.052   3.946
  156    H    LEU  20           H        LEU  20   3.187  -8.004   4.037
  157    HA   LEU  20           HA       LEU  20   4.165  -8.911   1.509
  158    HG   LEU  20           HG       LEU  20   1.693  -6.951   2.565
  159    HB2  LEU  20           2HB      LEU  20   3.887  -6.098   2.546
  160    HB3  LEU  20           1HB      LEU  20   4.142  -6.548   0.872
  161   HD11  LEU  20          1HD1      LEU  20   2.061  -5.684  -0.142
  162   HD12  LEU  20          2HD1      LEU  20   2.079  -4.795   1.381
  163   HD13  LEU  20          3HD1      LEU  20   0.616  -5.641   0.871
  164   HD21  LEU  20          3HD2      LEU  20   1.975  -9.049   1.399
  165   HD22  LEU  20          1HD2      LEU  20   2.294  -8.208  -0.119
  166   HD23  LEU  20          2HD2      LEU  20   0.695  -8.126   0.616
  167    H    CYS  21           H        CYS  21   5.604  -6.976   4.128
  168    HA   CYS  21           HA       CYS  21   8.013  -6.390   2.859
  169    HG   CYS  21           HG       CYS  21   6.854  -4.262   5.028
  170    HB2  CYS  21           2HB      CYS  21   7.999  -7.011   5.798
  171    HB3  CYS  21           1HB      CYS  21   8.865  -5.752   4.935
  172    H    LYS  22           H        LYS  22   6.958  -9.307   4.468
  173    HA   LYS  22           HA       LYS  22   9.561 -10.556   4.279
  174    HB2  LYS  22           2HB      LYS  22   6.883 -11.761   4.986
  175    HB3  LYS  22           1HB      LYS  22   8.453 -12.523   5.206
  176    HG2  LYS  22           2HG      LYS  22   8.798 -11.485   7.145
  177    HG3  LYS  22           1HG      LYS  22   8.299  -9.924   6.494
  178    HD2  LYS  22           2HD      LYS  22   6.771 -10.454   8.231
  179    HD3  LYS  22           1HD      LYS  22   5.915 -10.723   6.709
  180    HE2  LYS  22           2HE      LYS  22   5.383 -12.585   8.017
  181    HE3  LYS  22           1HE      LYS  22   6.648 -13.155   6.929
  182    HZ1  LYS  22           3HZ      LYS  22   8.105 -13.413   8.613
  183    HZ2  LYS  22           1HZ      LYS  22   6.701 -13.555   9.545
  184    HZ3  LYS  22           2HZ      LYS  22   7.531 -12.082   9.486
  185    H    HIS  23           H        HIS  23   6.776 -10.182   2.321
  186    HA   HIS  23           HA       HIS  23   7.235 -12.525   0.706
  187    HD1  HIS  23           1HD      HIS  23   6.250 -11.547  -2.353
  188    HD2  HIS  23           2HD      HIS  23   3.487 -13.434   0.111
  189    HE1  HIS  23           1HE      HIS  23   5.099 -13.242  -3.809
  190    HE2  HIS  23           2HE      HIS  23   3.503 -14.440  -2.272
  191    HB2  HIS  23           2HB      HIS  23   4.958 -11.481   1.236
  192    HB3  HIS  23           1HB      HIS  23   5.373 -10.255   0.043
  193    H    TRP  24           H        TRP  24   7.089  -9.019  -0.077
  194    HA   TRP  24           HA       TRP  24   8.604  -9.536  -2.501
  195    HD1  TRP  24           HD       TRP  24   4.926  -6.808  -1.802
  196    HE1  TRP  24           1HE      TRP  24   3.227  -7.971  -3.347
  197    HE3  TRP  24           3HE      TRP  24   8.130  -9.819  -4.414
  198    HZ2  TRP  24           2HZ      TRP  24   3.242  -9.908  -5.400
  199    HZ3  TRP  24           3HZ      TRP  24   7.206 -11.296  -6.151
  200    HH2  TRP  24           HH       TRP  24   4.813 -11.339  -6.633
  201    HB2  TRP  24           2HB      TRP  24   7.431  -6.997  -1.364
  202    HB3  TRP  24           1HB      TRP  24   8.253  -7.109  -2.918
  203    H    GLY  25           H        GLY  25   9.387  -8.795   0.730
  204    HA2  GLY  25           2HA      GLY  25  11.595  -7.058   0.279
  205    HA3  GLY  25           1HA      GLY  25  11.297  -7.995   1.729
  206    H    HIS  26           H        HIS  26  12.245  -8.566  -1.656
  207    HA   HIS  26           HA       HIS  26  14.206 -10.522  -0.654
  208    HD1  HIS  26           1HD      HIS  26  14.897 -12.509  -4.206
  209    HD2  HIS  26           2HD      HIS  26  13.136 -13.115  -0.493
  210    HE1  HIS  26           1HE      HIS  26  15.567 -14.832  -3.517
  211    HE2  HIS  26           2HE      HIS  26  14.566 -15.142  -1.226
  212    HB2  HIS  26           2HB      HIS  26  12.203 -11.000  -2.433
  213    HB3  HIS  26           1HB      HIS  26  13.519 -10.581  -3.525
  214    H    LYS  27           H        LYS  27  13.699  -7.659  -2.568
  215    HA   LYS  27           HA       LYS  27  16.584  -7.264  -2.715
  216    HB2  LYS  27           2HB      LYS  27  16.250  -8.416  -4.771
  217    HB3  LYS  27           1HB      LYS  27  14.789  -7.512  -5.127
  218    HG2  LYS  27           2HG      LYS  27  17.147  -5.813  -4.858
  219    HG3  LYS  27           1HG      LYS  27  17.288  -7.017  -6.140
  220    HD2  LYS  27           2HD      LYS  27  15.798  -5.968  -7.432
  221    HD3  LYS  27           1HD      LYS  27  14.678  -5.741  -6.089
  222    HE2  LYS  27           2HE      LYS  27  15.739  -3.678  -7.279
  223    HE3  LYS  27           1HE      LYS  27  15.546  -3.695  -5.529
  224    HZ1  LYS  27           3HZ      LYS  27  18.054  -4.739  -6.593
  225    HZ2  LYS  27           1HZ      LYS  27  17.767  -3.830  -5.194
  226    HZ3  LYS  27           2HZ      LYS  27  17.821  -3.067  -6.703
  227    H    PHE  28           H        PHE  28  14.054  -6.077  -1.478
  228    HA   PHE  28           HA       PHE  28  14.656  -3.323  -2.253
  229    HD1  PHE  28           2HD      PHE  28  13.172  -1.638  -3.940
  230    HD2  PHE  28           1HD      PHE  28  11.989  -5.721  -4.126
  231    HE1  PHE  28           2HE      PHE  28  13.198  -1.530  -6.399
  232    HE2  PHE  28           1HE      PHE  28  12.015  -5.623  -6.584
  233    HZ   PHE  28           HZ       PHE  28  12.619  -3.526  -7.723
  234    HB2  PHE  28           2HB      PHE  28  11.917  -4.557  -2.075
  235    HB3  PHE  28           1HB      PHE  28  12.178  -2.816  -1.997
  236    H    GLU  29           H        GLU  29  14.024  -1.717  -0.673
  237    HA   GLU  29           HA       GLU  29  14.585  -2.688   1.991
  238    HB2  GLU  29           2HB      GLU  29  14.570  -0.303   2.634
  239    HB3  GLU  29           1HB      GLU  29  15.642  -0.630   1.282
  240    HG2  GLU  29           2HG      GLU  29  14.086   0.318  -0.266
  241    HG3  GLU  29           1HG      GLU  29  12.865   0.482   0.993
  242    H    VAL  30           H        VAL  30  12.897  -3.801   2.801
  243    HA   VAL  30           HA       VAL  30  10.309  -2.416   2.889
  244    HB   VAL  30           HB       VAL  30   9.430  -4.810   3.352
  245   HG11  VAL  30          1HG1      VAL  30  10.431  -3.972   0.635
  246   HG12  VAL  30          2HG1      VAL  30   8.867  -3.594   1.351
  247   HG13  VAL  30          3HG1      VAL  30   9.257  -5.254   0.926
  248   HG21  VAL  30          3HG2      VAL  30  11.869  -5.637   3.530
  249   HG22  VAL  30          1HG2      VAL  30  11.836  -5.623   1.764
  250   HG23  VAL  30          2HG2      VAL  30  10.692  -6.626   2.665
  251    H    GLU  31           H        GLU  31   9.810  -1.602   4.818
  252    HA   GLU  31           HA       GLU  31  10.938  -2.822   7.234
  253    HB2  GLU  31           2HB      GLU  31  10.285  -0.118   6.428
  254    HB3  GLU  31           1HB      GLU  31   9.495  -0.521   7.946
  255    HG2  GLU  31           2HG      GLU  31  11.397   0.012   8.946
  256    HG3  GLU  31           1HG      GLU  31  12.067  -1.474   8.271
  257    H    LEU  32           H        LEU  32   9.566  -3.316   9.042
  258    HA   LEU  32           HA       LEU  32   6.715  -3.602   8.347
  259    HG   LEU  32           HG       LEU  32   5.769  -6.141   8.220
  260    HB2  LEU  32           2HB      LEU  32   8.097  -5.727   8.124
  261    HB3  LEU  32           1HB      LEU  32   8.248  -5.702   9.870
  262   HD11  LEU  32          1HD1      LEU  32   7.619  -7.856   9.378
  263   HD12  LEU  32          2HD1      LEU  32   6.012  -8.276   8.782
  264   HD13  LEU  32          3HD1      LEU  32   6.245  -7.874  10.483
  265   HD21  LEU  32          3HD2      LEU  32   4.920  -4.694   9.854
  266   HD22  LEU  32          1HD2      LEU  32   5.982  -5.339  11.106
  267   HD23  LEU  32          2HD2      LEU  32   4.634  -6.303  10.512
  268    H    THR  33           H        THR  33   5.608  -2.360   9.679
  269    HA   THR  33           HA       THR  33   6.262  -2.476  12.573
  270    HB   THR  33           HB       THR  33   4.972  -0.122  12.405
  271    HG1  THR  33           1HG      THR  33   5.517   0.959  10.552
  272   HG21  THR  33          3HG2      THR  33   7.904  -0.542  11.910
  273   HG22  THR  33          1HG2      THR  33   7.100  -0.249  13.452
  274   HG23  THR  33          2HG2      THR  33   7.170   1.028  12.238
  275    HA   PRO  34           HA       PRO  34   2.085  -3.899  12.904
  276    HB2  PRO  34           2HB      PRO  34   1.458  -3.143  15.429
  277    HB3  PRO  34           1HB      PRO  34   2.551  -4.478  15.063
  278    HG2  PRO  34           2HG      PRO  34   3.188  -1.686  15.899
  279    HG3  PRO  34           1HG      PRO  34   3.972  -3.204  16.369
  280    HD2  PRO  34           2HD      PRO  34   4.970  -1.476  14.483
  281    HD3  PRO  34           1HD      PRO  34   5.323  -3.214  14.519
  282    H    GLU  35           H        GLU  35   2.146  -1.709  11.411
  283    HA   GLU  35           HA       GLU  35  -0.339  -0.406  11.973
  284    HB2  GLU  35           2HB      GLU  35   2.271   1.109  12.079
  285    HB3  GLU  35           1HB      GLU  35   0.732   1.903  11.765
  286    HG2  GLU  35           2HG      GLU  35   1.439   0.350  14.244
  287    HG3  GLU  35           1HG      GLU  35   1.407   2.103  14.094
  288    H    ARG  36           H        ARG  36   2.576  -0.684  10.006
  289    HA   ARG  36           HA       ARG  36   1.117  -0.774   7.593
  290    HE   ARG  36           HE       ARG  36   4.118   4.779   7.527
  291    HB2  ARG  36           2HB      ARG  36   2.279   1.290   6.617
  292    HB3  ARG  36           1HB      ARG  36   0.914   1.579   7.681
  293    HG2  ARG  36           2HG      ARG  36   2.582   1.878   9.548
  294    HG3  ARG  36           1HG      ARG  36   3.837   1.861   8.309
  295    HD2  ARG  36           2HD      ARG  36   2.147   3.683   7.264
  296    HD3  ARG  36           1HD      ARG  36   1.862   3.938   8.984
  297   HH11  ARG  36          1HH1      ARG  36   3.247   3.394  10.609
  298   HH12  ARG  36          2HH1      ARG  36   4.619   4.055  11.434
  299   HH21  ARG  36          1HH2      ARG  36   5.920   5.650   8.610
  300   HH22  ARG  36          2HH2      ARG  36   6.135   5.336  10.300
  301    H    GLY  37           H        GLY  37   2.578  -0.687   5.679
  302    HA2  GLY  37           2HA      GLY  37   5.176  -1.911   6.370
  303    HA3  GLY  37           1HA      GLY  37   4.227  -2.346   4.949
  304    H    PHE  38           H        PHE  38   7.013  -1.207   5.165
  305    HA   PHE  38           HA       PHE  38   6.542   1.156   3.465
  306    HD1  PHE  38           2HD      PHE  38   7.280   3.534   3.536
  307    HD2  PHE  38           1HD      PHE  38  10.781   1.540   4.941
  308    HE1  PHE  38           2HE      PHE  38   8.690   5.294   2.557
  309    HE2  PHE  38           1HE      PHE  38  12.182   3.297   3.954
  310    HZ   PHE  38           HZ       PHE  38  11.138   5.177   2.756
  311    HB2  PHE  38           2HB      PHE  38   7.403   1.842   5.635
  312    HB3  PHE  38           1HB      PHE  38   8.725   0.693   5.509
  313    H    ILE  39           H        ILE  39   7.260   0.889   1.470
  314    HA   ILE  39           HA       ILE  39   9.607  -0.843   1.024
  315    HB   ILE  39           HB       ILE  39   7.355  -0.927  -0.950
  316   HG12  ILE  39          2HG1      ILE  39   7.501  -2.438   1.658
  317   HG13  ILE  39          1HG1      ILE  39   6.116  -1.643   0.919
  318   HG21  ILE  39          1HG2      ILE  39   8.833  -2.205  -2.000
  319   HG22  ILE  39          2HG2      ILE  39   8.675  -3.397  -0.712
  320   HG23  ILE  39          3HG2      ILE  39   9.925  -2.161  -0.618
  321   HD11  ILE  39          3HD1      ILE  39   5.960  -4.093   0.905
  322   HD12  ILE  39          1HD1      ILE  39   7.398  -4.162  -0.112
  323   HD13  ILE  39          2HD1      ILE  39   5.926  -3.399  -0.715
  324    H    ASP  40           H        ASP  40  11.118   0.482   0.112
  325    HA   ASP  40           HA       ASP  40  10.160   2.545  -1.750
  326    HB2  ASP  40           2HB      ASP  40  11.486   3.929  -0.589
  327    HB3  ASP  40           1HB      ASP  40  12.231   2.605   0.293
  328    H    PHE  41           H        PHE  41  10.452   2.269  -3.806
  329    HA   PHE  41           HA       PHE  41  12.026   0.044  -4.780
  330    HD1  PHE  41           1HD      PHE  41  10.139  -1.524  -6.494
  331    HD2  PHE  41           2HD      PHE  41  11.935   1.871  -8.326
  332    HE1  PHE  41           1HE      PHE  41  10.682  -2.883  -8.472
  333    HE2  PHE  41           2HE      PHE  41  12.485   0.517 -10.307
  334    HZ   PHE  41           HZ       PHE  41  11.856  -1.863 -10.381
  335    HB2  PHE  41           2HB      PHE  41   9.738   0.736  -5.666
  336    HB3  PHE  41           1HB      PHE  41  10.534   2.116  -6.404
  337    H    GLY  42           H        GLY  42  12.436   3.364  -4.240
  338    HA2  GLY  42           2HA      GLY  42  15.011   3.749  -4.524
  339    HA3  GLY  42           1HA      GLY  42  14.564   3.661  -6.223
  340    H    ASP  43           H        ASP  43  13.215   5.298  -7.106
  341    HA   ASP  43           HA       ASP  43  13.426   7.836  -5.660
  342    HB2  ASP  43           2HB      ASP  43  13.983   7.182  -8.278
  343    HB3  ASP  43           1HB      ASP  43  12.395   7.929  -8.407
  344    H    SER  44           H        SER  44  11.620   6.594  -4.382
  345    HA   SER  44           HA       SER  44   9.314   7.995  -4.330
  346    HG   SER  44           HG       SER  44   7.022   7.280  -4.993
  347    HB2  SER  44           2HB      SER  44   8.723   7.284  -6.584
  348    HB3  SER  44           1HB      SER  44   8.977   5.607  -6.155
  349    H    ASN  45           H        ASN  45   7.363   6.024  -3.683
  350    HA   ASN  45           HA       ASN  45   8.496   3.963  -2.098
  351    HB2  ASN  45           2HB      ASN  45   8.223   6.578  -0.872
  352    HB3  ASN  45           1HB      ASN  45   7.242   5.380  -0.028
  353   HD21  ASN  45          1HD2      ASN  45   8.518   3.195   0.166
  354   HD22  ASN  45          2HD2      ASN  45  10.101   3.364   0.833
  355    H    CYS  46           H        CYS  46   6.793   2.933  -0.673
  356    HA   CYS  46           HA       CYS  46   4.054   3.546  -1.399
  357    HG   CYS  46           HG       CYS  46   2.528   0.986  -2.984
  358    HB2  CYS  46           2HB      CYS  46   4.702   2.059  -3.199
  359    HB3  CYS  46           1HB      CYS  46   5.350   0.891  -2.053
  360    H    GLU  47           H        GLU  47   3.399   3.841   0.651
  361    HA   GLU  47           HA       GLU  47   4.053   1.795   2.648
  362    HB2  GLU  47           2HB      GLU  47   4.398   4.448   2.831
  363    HB3  GLU  47           1HB      GLU  47   2.742   4.363   3.402
  364    HG2  GLU  47           2HG      GLU  47   3.320   3.314   5.345
  365    HG3  GLU  47           1HG      GLU  47   4.745   2.546   4.647
  366    H    LEU  48           H        LEU  48   2.352   0.985   4.036
  367    HA   LEU  48           HA       LEU  48  -0.359   1.555   3.117
  368    HG   LEU  48           HG       LEU  48   1.510  -1.712   3.903
  369    HB2  LEU  48           2HB      LEU  48  -0.785  -1.003   3.310
  370    HB3  LEU  48           1HB      LEU  48  -0.182  -0.312   1.818
  371   HD11  LEU  48          1HD1      LEU  48   1.216  -2.860   1.215
  372   HD12  LEU  48          2HD1      LEU  48  -0.236  -2.915   2.212
  373   HD13  LEU  48          3HD1      LEU  48   1.260  -3.646   2.792
  374   HD21  LEU  48          3HD2      LEU  48   2.141  -0.115   1.519
  375   HD22  LEU  48          1HD2      LEU  48   2.934  -1.689   1.577
  376   HD23  LEU  48          2HD2      LEU  48   3.149  -0.543   2.899
  377    H    LEU  49           H        LEU  49  -1.660   1.919   4.724
  378    HA   LEU  49           HA       LEU  49  -0.865   1.073   7.421
  379    HG   LEU  49           HG       LEU  49  -2.212   1.872   9.213
  380    HB2  LEU  49           2HB      LEU  49  -1.744   3.438   6.791
  381    HB3  LEU  49           1HB      LEU  49  -3.319   2.668   6.794
  382   HD11  LEU  49          1HD1      LEU  49  -1.872   4.560   9.833
  383   HD12  LEU  49          2HD1      LEU  49  -0.946   4.321   8.351
  384   HD13  LEU  49          3HD1      LEU  49  -0.624   3.317   9.764
  385   HD21  LEU  49          3HD2      LEU  49  -3.838   3.525  10.159
  386   HD22  LEU  49          1HD2      LEU  49  -4.515   2.438   8.946
  387   HD23  LEU  49          2HD2      LEU  49  -4.118   4.101   8.515
  388    H    ALA  50           H        ALA  50  -1.827  -0.578   8.474
  389    HA   ALA  50           HA       ALA  50  -4.386  -1.541   7.443
  390    HB1  ALA  50           3HB      ALA  50  -2.769  -2.785   6.218
  391    HB2  ALA  50           1HB      ALA  50  -3.545  -3.841   7.383
  392    HB3  ALA  50           2HB      ALA  50  -1.922  -3.235   7.699
  393    H    HIS  51           H        HIS  51  -5.718  -1.547   9.065
  394    HA   HIS  51           HA       HIS  51  -4.796  -2.478  11.670
  395    HD1  HIS  51           1HD      HIS  51  -7.746   0.051  13.842
  396    HD2  HIS  51           2HD      HIS  51  -3.843  -1.297  13.356
  397    HE1  HIS  51           1HE      HIS  51  -6.677   0.251  16.108
  398    HE2  HIS  51           2HE      HIS  51  -4.293  -0.486  15.769
  399    HB2  HIS  51           2HB      HIS  51  -5.958  -0.050  11.098
  400    HB3  HIS  51           1HB      HIS  51  -7.352  -1.004  11.582
  401    HA   PRO  52           HA       PRO  52  -7.384  -6.017  11.808
  402    HB2  PRO  52           2HB      PRO  52  -9.088  -4.617  13.828
  403    HB3  PRO  52           1HB      PRO  52  -8.408  -6.250  13.861
  404    HG2  PRO  52           2HG      PRO  52  -7.265  -4.315  15.256
  405    HG3  PRO  52           1HG      PRO  52  -6.269  -5.490  14.378
  406    HD2  PRO  52           2HD      PRO  52  -6.883  -2.651  13.705
  407    HD3  PRO  52           1HD      PRO  52  -5.400  -3.577  13.420
  408    H    ASP  53           H        ASP  53  -9.001  -2.944  11.233
  409    HA   ASP  53           HA       ASP  53 -10.970  -4.436   9.675
  410    HB2  ASP  53           2HB      ASP  53 -11.784  -3.710  12.050
  411    HB3  ASP  53           1HB      ASP  53 -11.944  -2.122  11.307
  412    H    HIS  54           H        HIS  54  -8.743  -1.965   9.607
  413    HA   HIS  54           HA       HIS  54 -10.021  -1.016   7.180
  414    HD1  HIS  54           1HD      HIS  54 -10.212   0.490  11.239
  415    HD2  HIS  54           2HD      HIS  54  -7.158   2.080   8.911
  416    HE1  HIS  54           1HE      HIS  54  -8.573   1.484  12.867
  417    HE2  HIS  54           2HE      HIS  54  -6.770   2.504  11.433
  418    HB2  HIS  54           2HB      HIS  54  -9.593   1.365   7.685
  419    HB3  HIS  54           1HB      HIS  54 -10.783   0.634   8.743
  420    H    VAL  55           H        VAL  55  -8.574   0.133   5.690
  421    HA   VAL  55           HA       VAL  55  -5.740  -0.197   6.288
  422    HB   VAL  55           HB       VAL  55  -6.858  -2.164   4.944
  423   HG11  VAL  55          1HG1      VAL  55  -6.044  -0.530   2.588
  424   HG12  VAL  55          2HG1      VAL  55  -7.683  -0.394   3.223
  425   HG13  VAL  55          3HG1      VAL  55  -7.081  -1.953   2.664
  426   HG21  VAL  55          3HG2      VAL  55  -4.737  -2.668   3.943
  427   HG22  VAL  55          1HG2      VAL  55  -4.467  -1.910   5.511
  428   HG23  VAL  55          2HG2      VAL  55  -4.250  -0.975   4.031
  429    H    LEU  56           H        LEU  56  -4.465   1.331   5.429
  430    HA   LEU  56           HA       LEU  56  -5.705   3.306   3.629
  431    HG   LEU  56           HG       LEU  56  -6.436   4.920   5.575
  432    HB2  LEU  56           2HB      LEU  56  -4.409   3.666   6.183
  433    HB3  LEU  56           1HB      LEU  56  -3.501   4.507   4.950
  434   HD11  LEU  56          1HD1      LEU  56  -4.204   6.863   6.061
  435   HD12  LEU  56          2HD1      LEU  56  -4.693   5.679   7.275
  436   HD13  LEU  56          3HD1      LEU  56  -5.849   6.879   6.696
  437   HD21  LEU  56          3HD2      LEU  56  -4.627   5.997   3.463
  438   HD22  LEU  56          1HD2      LEU  56  -5.818   7.077   4.184
  439   HD23  LEU  56          2HD2      LEU  56  -6.344   5.597   3.385
  440    H    MET  57           H        MET  57  -4.452   4.107   1.937
  441    HA   MET  57           HA       MET  57  -1.885   2.739   1.507
  442    HB2  MET  57           2HB      MET  57  -3.801   3.313  -0.731
  443    HB3  MET  57           1HB      MET  57  -2.420   2.221  -0.719
  444    HG2  MET  57           2HG      MET  57  -3.585   0.767   0.880
  445    HG3  MET  57           1HG      MET  57  -4.976   1.852   0.825
  446    HE1  MET  57           3HE      MET  57  -6.914   1.628  -0.972
  447    HE2  MET  57           1HE      MET  57  -6.729   0.305   0.179
  448    HE3  MET  57           2HE      MET  57  -7.063  -0.042  -1.518
  449    H    ILE  58           H        ILE  58  -0.293   4.224   1.490
  450    HA   ILE  58           HA       ILE  58  -0.819   6.774   0.123
  451    HB   ILE  58           HB       ILE  58   0.969   6.392   2.530
  452   HG12  ILE  58          2HG1      ILE  58  -1.884   6.696   2.399
  453   HG13  ILE  58          1HG1      ILE  58  -0.863   6.536   3.815
  454   HG21  ILE  58          1HG2      ILE  58   0.066   8.888   1.109
  455   HG22  ILE  58          2HG2      ILE  58   1.678   8.170   1.032
  456   HG23  ILE  58          3HG2      ILE  58   1.077   8.828   2.553
  457   HD11  ILE  58          3HD1      ILE  58  -0.724   8.821   4.134
  458   HD12  ILE  58          1HD1      ILE  58  -2.385   8.596   3.590
  459   HD13  ILE  58          2HD1      ILE  58  -1.161   9.188   2.465
  460    H    LEU  59           H        LEU  59   0.741   7.489  -1.272
  461    HA   LEU  59           HA       LEU  59   3.186   5.857  -1.481
  462    HG   LEU  59           HG       LEU  59   1.433   6.932  -5.228
  463    HB2  LEU  59           2HB      LEU  59   3.072   5.798  -3.801
  464    HB3  LEU  59           1HB      LEU  59   1.424   5.502  -3.297
  465   HD11  LEU  59          1HD1      LEU  59   0.123   8.778  -4.398
  466   HD12  LEU  59          2HD1      LEU  59   0.757   8.525  -2.774
  467   HD13  LEU  59          3HD1      LEU  59  -0.275   7.302  -3.517
  468   HD21  LEU  59          3HD2      LEU  59   2.787   8.666  -5.600
  469   HD22  LEU  59          1HD2      LEU  59   3.767   7.971  -4.314
  470   HD23  LEU  59          2HD2      LEU  59   2.635   9.274  -3.959
  471    H    ASN  60           H        ASN  60   5.093   6.902  -1.980
  472    HA   ASN  60           HA       ASN  60   4.963   9.848  -2.060
  473    HB2  ASN  60           2HB      ASN  60   7.303   8.303  -0.945
  474    HB3  ASN  60           1HB      ASN  60   6.935  10.014  -0.750
  475   HD21  ASN  60          1HD2      ASN  60   7.523   8.671   1.457
  476   HD22  ASN  60          2HD2      ASN  60   6.115   8.377   2.415
  477    H    SER  61           H        SER  61   5.217  10.251  -4.184
  478    HA   SER  61           HA       SER  61   7.668   9.184  -5.463
  479    HG   SER  61           HG       SER  61   5.397   6.881  -6.119
  480    HB2  SER  61           2HB      SER  61   5.242   9.327  -7.166
  481    HB3  SER  61           1HB      SER  61   6.586   8.190  -7.217
  482    HA   PRO  62           HA       PRO  62   7.963  13.395  -6.928
  483    HB2  PRO  62           2HB      PRO  62  10.011  13.123  -8.606
  484    HB3  PRO  62           1HB      PRO  62  10.204  12.960  -6.859
  485    HG2  PRO  62           2HG      PRO  62   9.954  10.815  -8.927
  486    HG3  PRO  62           1HG      PRO  62  11.097  10.933  -7.575
  487    HD2  PRO  62           2HD      PRO  62   8.824   9.442  -7.486
  488    HD3  PRO  62           1HD      PRO  62   9.560  10.169  -6.050
  489    H    ASP  63           H        ASP  63   6.872  10.793  -8.823
  490    HA   ASP  63           HA       ASP  63   6.001  12.703 -10.863
  491    HB2  ASP  63           2HB      ASP  63   6.471  11.002 -12.645
  492    HB3  ASP  63           1HB      ASP  63   7.918  11.659 -11.885
  493    H    GLU  64           H        GLU  64   3.952  12.183 -11.802
  494    HA   GLU  64           HA       GLU  64   2.239  10.669 -10.107
  495    HB2  GLU  64           2HB      GLU  64   1.649  12.522 -11.946
  496    HB3  GLU  64           1HB      GLU  64   1.383  11.091 -12.940
  497    HG2  GLU  64           2HG      GLU  64   0.105  10.393 -10.680
  498    HG3  GLU  64           1HG      GLU  64  -0.136  12.135 -10.659
  499    H    ASP  65           H        ASP  65   3.776   9.793 -13.246
  500    HA   ASP  65           HA       ASP  65   2.594   7.347 -13.700
  501    HB2  ASP  65           2HB      ASP  65   4.384   8.459 -15.101
  502    HB3  ASP  65           1HB      ASP  65   5.562   7.881 -13.923
  503    H    SER  66           H        SER  66   5.484   8.020 -11.753
  504    HA   SER  66           HA       SER  66   5.778   5.461 -10.621
  505    HG   SER  66           HG       SER  66   8.220   6.622  -8.528
  506    HB2  SER  66           2HB      SER  66   7.533   7.211 -10.500
  507    HB3  SER  66           1HB      SER  66   6.505   8.139  -9.405
  508    H    LEU  67           H        LEU  67   4.396   8.394  -9.321
  509    HA   LEU  67           HA       LEU  67   3.322   7.711  -6.955
  510    HG   LEU  67           HG       LEU  67   1.137   9.450  -6.413
  511    HB2  LEU  67           2HB      LEU  67   3.179   9.934  -7.708
  512    HB3  LEU  67           1HB      LEU  67   2.335   9.486  -9.159
  513   HD11  LEU  67          1HD1      LEU  67   1.071  11.652  -6.638
  514   HD12  LEU  67          2HD1      LEU  67  -0.143  11.369  -7.886
  515   HD13  LEU  67          3HD1      LEU  67   1.549  11.571  -8.332
  516   HD21  LEU  67          3HD2      LEU  67  -0.989   9.524  -7.930
  517   HD22  LEU  67          1HD2      LEU  67  -0.213   7.983  -7.569
  518   HD23  LEU  67          2HD2      LEU  67   0.084   8.781  -9.115
  519    H    ALA  68           H        ALA  68   1.418   7.436  -9.978
  520    HA   ALA  68           HA       ALA  68  -0.678   6.010  -8.724
  521    HB1  ALA  68           3HB      ALA  68  -1.088   7.166 -10.796
  522    HB2  ALA  68           1HB      ALA  68  -1.374   5.443 -11.051
  523    HB3  ALA  68           2HB      ALA  68   0.114   6.186 -11.636
  524    H    HIS  69           H        HIS  69   2.304   5.025 -10.298
  525    HA   HIS  69           HA       HIS  69   1.819   2.303 -10.627
  526    HD1  HIS  69           1HD      HIS  69   6.079   2.308 -12.037
  527    HD2  HIS  69           2HD      HIS  69   3.041   0.149 -10.200
  528    HE1  HIS  69           1HE      HIS  69   6.566  -0.106 -12.547
  529    HE2  HIS  69           2HE      HIS  69   4.766  -1.398 -11.348
  530    HB2  HIS  69           2HB      HIS  69   3.871   3.692 -11.339
  531    HB3  HIS  69           1HB      HIS  69   4.481   3.380  -9.718
  532    H    MET  70           H        MET  70   2.822   4.147  -7.809
  533    HA   MET  70           HA       MET  70   3.158   1.826  -6.139
  534    HB2  MET  70           2HB      MET  70   2.769   4.516  -4.940
  535    HB3  MET  70           1HB      MET  70   3.924   3.268  -4.511
  536    HG2  MET  70           2HG      MET  70   4.083   5.260  -6.743
  537    HG3  MET  70           1HG      MET  70   5.167   5.060  -5.372
  538    HE1  MET  70           3HE      MET  70   6.287   2.053  -5.278
  539    HE2  MET  70           1HE      MET  70   6.981   3.670  -5.150
  540    HE3  MET  70           2HE      MET  70   7.645   2.514  -6.305
  541    H    GLN  71           H        GLN  71   0.792   4.547  -6.040
  542    HA   GLN  71           HA       GLN  71  -0.830   3.469  -4.084
  543    HB2  GLN  71           2HB      GLN  71  -2.728   4.780  -5.348
  544    HB3  GLN  71           1HB      GLN  71  -1.478   5.621  -4.455
  545    HG2  GLN  71           2HG      GLN  71  -0.789   6.666  -6.283
  546    HG3  GLN  71           1HG      GLN  71  -0.738   5.170  -7.214
  547   HE21  GLN  71          1HE2      GLN  71  -2.981   4.325  -7.796
  548   HE22  GLN  71          2HE2      GLN  71  -4.101   5.500  -8.387
  549    H    ASN  72           H        ASN  72  -0.669   2.617  -7.458
  550    HA   ASN  72           HA       ASN  72  -3.150   1.149  -7.405
  551    HB2  ASN  72           2HB      ASN  72  -1.877   2.240  -9.448
  552    HB3  ASN  72           1HB      ASN  72  -1.081   0.670  -9.506
  553   HD21  ASN  72          1HD2      ASN  72  -2.813   1.821 -11.471
  554   HD22  ASN  72          2HD2      ASN  72  -4.172   0.766 -11.630
  555    H    VAL  73           H        VAL  73   0.305   0.358  -7.295
  556    HA   VAL  73           HA       VAL  73   0.273  -2.371  -7.455
  557    HB   VAL  73           HB       VAL  73   1.970  -0.503  -5.826
  558   HG11  VAL  73          1HG1      VAL  73   3.470  -2.425  -5.327
  559   HG12  VAL  73          2HG1      VAL  73   2.189  -3.509  -5.869
  560   HG13  VAL  73          3HG1      VAL  73   1.933  -2.476  -4.464
  561   HG21  VAL  73          3HG2      VAL  73   3.439  -0.638  -7.532
  562   HG22  VAL  73          1HG2      VAL  73   2.005  -1.108  -8.446
  563   HG23  VAL  73          2HG2      VAL  73   3.103  -2.343  -7.830
  564    H    VAL  74           H        VAL  74  -0.454  -0.392  -4.605
  565    HA   VAL  74           HA       VAL  74  -0.838  -2.609  -2.856
  566    HB   VAL  74           HB       VAL  74  -1.858   0.222  -2.608
  567   HG11  VAL  74          1HG1      VAL  74  -1.589  -1.803  -0.396
  568   HG12  VAL  74          2HG1      VAL  74  -3.102  -1.501  -1.250
  569   HG13  VAL  74          3HG1      VAL  74  -2.340  -0.210  -0.324
  570   HG21  VAL  74          3HG2      VAL  74   0.744  -0.981  -2.186
  571   HG22  VAL  74          1HG2      VAL  74   0.131  -0.217  -0.720
  572   HG23  VAL  74          2HG2      VAL  74   0.280   0.721  -2.203
  573    H    ALA  75           H        ALA  75  -3.106  -0.536  -4.695
  574    HA   ALA  75           HA       ALA  75  -5.515  -1.551  -3.844
  575    HB1  ALA  75           3HB      ALA  75  -6.393  -0.993  -6.094
  576    HB2  ALA  75           1HB      ALA  75  -4.738  -0.737  -6.646
  577    HB3  ALA  75           2HB      ALA  75  -5.423   0.300  -5.393
  578    H    ASP  76           H        ASP  76  -3.076  -3.022  -5.793
  579    HA   ASP  76           HA       ASP  76  -4.714  -5.161  -6.791
  580    HB2  ASP  76           2HB      ASP  76  -2.337  -4.136  -7.578
  581    HB3  ASP  76           1HB      ASP  76  -1.781  -5.536  -6.665
  582    H    HIS  77           H        HIS  77  -2.402  -4.743  -4.144
  583    HA   HIS  77           HA       HIS  77  -2.299  -7.422  -3.316
  584    HD1  HIS  77           1HD      HIS  77  -0.706  -6.242  -4.654
  585    HD2  HIS  77           2HD      HIS  77   0.945  -4.495  -1.265
  586    HE1  HIS  77           1HE      HIS  77   1.558  -5.408  -5.362
  587    HE2  HIS  77           2HE      HIS  77   2.573  -4.436  -3.272
  588    HB2  HIS  77           2HB      HIS  77  -1.986  -4.999  -1.535
  589    HB3  HIS  77           1HB      HIS  77  -1.344  -6.608  -1.257
  590    H    LEU  78           H        LEU  78  -4.505  -4.797  -2.340
  591    HA   LEU  78           HA       LEU  78  -5.819  -6.217  -0.306
  592    HG   LEU  78           HG       LEU  78  -5.126  -3.038  -0.620
  593    HB2  LEU  78           2HB      LEU  78  -6.738  -3.960  -2.087
  594    HB3  LEU  78           1HB      LEU  78  -7.702  -4.590  -0.769
  595   HD11  LEU  78          1HD1      LEU  78  -7.775  -2.673   0.763
  596   HD12  LEU  78          2HD1      LEU  78  -7.293  -1.848  -0.719
  597   HD13  LEU  78          3HD1      LEU  78  -6.401  -1.568   0.775
  598   HD21  LEU  78          3HD2      LEU  78  -4.730  -4.817   0.905
  599   HD22  LEU  78          1HD2      LEU  78  -6.387  -4.760   1.505
  600   HD23  LEU  78          2HD2      LEU  78  -5.273  -3.442   1.864
  601    H    GLN  79           H        GLN  79  -6.026  -6.357  -3.756
  602    HA   GLN  79           HA       GLN  79  -8.594  -7.598  -3.906
  603    HB2  GLN  79           2HB      GLN  79  -6.394  -7.775  -5.961
  604    HB3  GLN  79           1HB      GLN  79  -8.124  -7.942  -6.223
  605    HG2  GLN  79           2HG      GLN  79  -7.739  -5.415  -5.064
  606    HG3  GLN  79           1HG      GLN  79  -6.495  -5.596  -6.297
  607   HE21  GLN  79          1HE2      GLN  79  -8.078  -3.691  -6.904
  608   HE22  GLN  79          2HE2      GLN  79  -9.281  -4.126  -8.065
  609    H    ARG  80           H        ARG  80  -5.287  -8.864  -4.343
  610    HA   ARG  80           HA       ARG  80  -5.908 -11.531  -4.647
  611    HE   ARG  80           HE       ARG  80  -1.578 -13.851  -2.469
  612    HB2  ARG  80           2HB      ARG  80  -3.699 -11.000  -5.089
  613    HB3  ARG  80           1HB      ARG  80  -3.524 -10.046  -3.624
  614    HG2  ARG  80           2HG      ARG  80  -3.050 -11.858  -2.331
  615    HG3  ARG  80           1HG      ARG  80  -3.948 -12.975  -3.361
  616    HD2  ARG  80           2HD      ARG  80  -2.207 -12.796  -5.069
  617    HD3  ARG  80           1HD      ARG  80  -1.312 -11.677  -4.043
  618   HH11  ARG  80          1HH1      ARG  80  -0.441 -13.423  -5.741
  619   HH12  ARG  80          2HH1      ARG  80   0.656 -14.760  -5.667
  620   HH21  ARG  80          1HH2      ARG  80  -0.135 -15.610  -2.371
  621   HH22  ARG  80          2HH2      ARG  80   0.831 -16.002  -3.754
  622    H    MET  81           H        MET  81  -5.644  -9.634  -1.688
  623    HA   MET  81           HA       MET  81  -5.891 -11.959  -0.002
  624    HB2  MET  81           2HB      MET  81  -5.925 -10.380   1.859
  625    HB3  MET  81           1HB      MET  81  -4.595 -10.062   0.765
  626    HG2  MET  81           2HG      MET  81  -5.440  -7.969   1.388
  627    HG3  MET  81           1HG      MET  81  -6.001  -8.244  -0.257
  628    HE1  MET  81           3HE      MET  81  -7.894  -7.017   3.330
  629    HE2  MET  81           1HE      MET  81  -8.181  -6.009   1.911
  630    HE3  MET  81           2HE      MET  81  -6.542  -6.520   2.313
  631    H    ALA  82           H        ALA  82  -8.076 -10.003  -1.705
  632    HA   ALA  82           HA       ALA  82 -10.309 -11.197  -0.201
  633    HB1  ALA  82           3HB      ALA  82 -10.504  -9.095   0.691
  634    HB2  ALA  82           1HB      ALA  82 -11.493  -8.914  -0.758
  635    HB3  ALA  82           2HB      ALA  82  -9.838  -8.304  -0.739
  636    H    ASN  83           H        ASN  83 -10.888 -12.642  -1.752
  637    HA   ASN  83           HA       ASN  83 -11.168 -11.774  -4.518
  638    HB2  ASN  83           2HB      ASN  83 -10.127 -13.960  -4.028
  639    HB3  ASN  83           1HB      ASN  83 -11.628 -14.497  -3.279
  640   HD21  ASN  83          1HD2      ASN  83 -13.181 -15.337  -4.520
  641   HD22  ASN  83          2HD2      ASN  83 -13.134 -15.418  -6.244
  642    H    SER  84           H        SER  84 -12.995 -10.864  -5.161
  643    HA   SER  84           HA       SER  84 -15.508 -12.029  -5.007
  644    HG   SER  84           HG       SER  84 -17.479 -10.692  -2.733
  645    HB2  SER  84           2HB      SER  84 -15.605 -11.634  -2.658
  646    HB3  SER  84           1HB      SER  84 -14.984  -9.993  -2.837
  647    H    GLU  85           H        GLU  85 -13.789  -8.943  -4.973
  648    HA   GLU  85           HA       GLU  85 -15.062  -8.183  -7.461
  649    HB2  GLU  85           2HB      GLU  85 -15.947  -6.083  -6.670
  650    HB3  GLU  85           1HB      GLU  85 -16.630  -7.380  -5.699
  651    HG2  GLU  85           2HG      GLU  85 -14.856  -6.881  -3.985
  652    HG3  GLU  85           1HG      GLU  85 -14.464  -5.443  -4.926
  653    H    SER  86           H        SER  86 -14.125  -6.079  -8.287
  654    HA   SER  86           HA       SER  86 -11.282  -6.172  -8.002
  655    HG   SER  86           HG       SER  86 -10.903  -5.625 -10.666
  656    HB2  SER  86           2HB      SER  86 -13.204  -4.513  -9.599
  657    HB3  SER  86           1HB      SER  86 -11.524  -3.994  -9.458
  658    H    LEU  87           H        LEU  87 -11.457  -5.832  -5.638
  659    HA   LEU  87           HA       LEU  87 -11.748  -4.455  -3.745
  660    HG   LEU  87           HG       LEU  87  -8.246  -4.570  -3.083
  661    HB2  LEU  87           2HB      LEU  87  -9.232  -4.272  -5.115
  662    HB3  LEU  87           1HB      LEU  87  -9.588  -2.735  -4.354
  663   HD11  LEU  87          1HD1      LEU  87  -8.604  -2.572  -1.982
  664   HD12  LEU  87          2HD1      LEU  87  -9.443  -3.718  -0.938
  665   HD13  LEU  87          3HD1      LEU  87 -10.360  -2.719  -2.066
  666   HD21  LEU  87          3HD2      LEU  87 -11.059  -5.372  -2.352
  667   HD22  LEU  87          1HD2      LEU  87  -9.565  -5.987  -1.653
  668   HD23  LEU  87          2HD2      LEU  87  -9.957  -6.339  -3.332
  669    H    GLU  88           H        GLU  88 -13.351  -3.040  -3.437
  670    HA   GLU  88           HA       GLU  88 -13.692  -0.732  -5.105
  671    HB2  GLU  88           2HB      GLU  88 -15.574  -1.823  -3.871
  672    HB3  GLU  88           1HB      GLU  88 -14.845  -1.297  -2.359
  673    HG2  GLU  88           2HG      GLU  88 -15.618   0.790  -2.567
  674    HG3  GLU  88           1HG      GLU  88 -15.275   0.853  -4.296
  675    H    ILE  89           H        ILE  89 -11.886   0.552  -5.073
  676    HA   ILE  89           HA       ILE  89 -11.219   1.727  -2.477
  677    HB   ILE  89           HB       ILE  89  -8.902   1.546  -2.745
  678   HG12  ILE  89          2HG1      ILE  89  -9.014   2.193  -5.265
  679   HG13  ILE  89          1HG1      ILE  89  -7.694   1.182  -4.708
  680   HG21  ILE  89          1HG2      ILE  89  -8.483  -0.855  -3.316
  681   HG22  ILE  89          2HG2      ILE  89 -10.186  -0.962  -3.762
  682   HG23  ILE  89          3HG2      ILE  89  -9.733  -0.563  -2.107
  683   HD11  ILE  89          3HD1      ILE  89  -8.753  -0.782  -5.575
  684   HD12  ILE  89          1HD1      ILE  89  -8.666   0.441  -6.843
  685   HD13  ILE  89          2HD1      ILE  89 -10.193   0.140  -6.013
  686    H    ALA  90           H        ALA  90 -11.189   3.953  -2.490
  687    HA   ALA  90           HA       ALA  90 -11.357   5.217  -5.135
  688    HB1  ALA  90           3HB      ALA  90 -11.827   6.622  -2.514
  689    HB2  ALA  90           1HB      ALA  90 -13.097   5.692  -3.318
  690    HB3  ALA  90           2HB      ALA  90 -12.371   7.082  -4.125
  691    H    TRP  91           H        TRP  91  -9.474   5.784  -5.926
  692    HA   TRP  91           HA       TRP  91  -7.293   6.545  -4.153
  693    HD1  TRP  91           HD       TRP  91  -8.377   3.978  -7.575
  694    HE1  TRP  91           1HE      TRP  91  -9.194   4.664  -9.918
  695    HE3  TRP  91           3HE      TRP  91  -6.493   8.728  -7.735
  696    HZ2  TRP  91           2HZ      TRP  91  -9.057   6.920 -11.609
  697    HZ3  TRP  91           3HZ      TRP  91  -6.880  10.084  -9.751
  698    HH2  TRP  91           HH       TRP  91  -8.135   9.197 -11.648
  699    HB2  TRP  91           2HB      TRP  91  -5.955   6.567  -6.287
  700    HB3  TRP  91           1HB      TRP  91  -6.670   5.010  -5.880
  701    H    GLN  92           H        GLN  92  -6.537   8.557  -3.913
  702    HA   GLN  92           HA       GLN  92  -8.041  10.717  -5.150
  703    HB2  GLN  92           2HB      GLN  92  -5.948  10.682  -2.973
  704    HB3  GLN  92           1HB      GLN  92  -6.677  12.157  -3.592
  705    HG2  GLN  92           2HG      GLN  92  -8.708  11.724  -2.628
  706    HG3  GLN  92           1HG      GLN  92  -8.451   9.980  -2.612
  707   HE21  GLN  92          1HE2      GLN  92  -6.315  12.525  -1.436
  708   HE22  GLN  92          2HE2      GLN  92  -6.330  12.025   0.218
  709    HA   PRO  93           HA       PRO  93  -5.330  11.945  -8.380
  710    HB2  PRO  93           2HB      PRO  93  -5.211  14.575  -6.987
  711    HB3  PRO  93           1HB      PRO  93  -5.539  14.223  -8.688
  712    HG2  PRO  93           2HG      PRO  93  -7.524  14.858  -7.026
  713    HG3  PRO  93           1HG      PRO  93  -7.741  13.621  -8.277
  714    HD2  PRO  93           2HD      PRO  93  -7.422  13.309  -5.340
  715    HD3  PRO  93           1HD      PRO  93  -8.305  12.294  -6.496
  716    H    ALA  94           H        ALA  94  -4.437  13.026  -5.124
  717    HA   ALA  94           HA       ALA  94  -2.425  12.506  -4.037
  718    HB1  ALA  94           3HB      ALA  94  -0.565  11.640  -5.071
  719    HB2  ALA  94           1HB      ALA  94  -0.849  12.542  -6.557
  720    HB3  ALA  94           2HB      ALA  94  -1.823  11.120  -6.194
  721    H    GLU  95           H        GLU  95  -3.675  15.012  -4.953
  722    HA   GLU  95           HA       GLU  95  -1.729  16.819  -4.043
  723    HB2  GLU  95           2HB      GLU  95  -0.853  16.289  -6.376
  724    HB3  GLU  95           1HB      GLU  95  -2.270  17.125  -6.994
  725    HG2  GLU  95           2HG      GLU  95  -1.267  18.937  -5.215
  726    HG3  GLU  95           1HG      GLU  95   0.196  18.189  -5.855
  727    H    SER  96           H        SER  96  -3.815  16.994  -2.859
  728    HA   SER  96           HA       SER  96  -5.284  19.274  -3.852
  729    HG   SER  96           HG       SER  96  -7.651  19.283  -3.801
  730    HB2  SER  96           2HB      SER  96  -6.550  17.443  -4.868
  731    HB3  SER  96           1HB      SER  96  -6.712  16.661  -3.296
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1   6.948  13.350  -5.140
    2    HB2  MET   1           2HB      MET   1   7.599  13.651  -2.825
    3    HB3  MET   1           1HB      MET   1   8.902  14.159  -3.894
    4    HG2  MET   1           2HG      MET   1   7.105  16.330  -3.152
    5    HG3  MET   1           1HG      MET   1   7.905  15.579  -1.775
    6    HE1  MET   1           3HE      MET   1  11.403  15.944  -2.049
    7    HE2  MET   1           1HE      MET   1   9.930  15.591  -1.144
    8    HE3  MET   1           2HE      MET   1  10.567  17.234  -1.184
    9    H    PHE   2           H        PHE   2   4.844  13.391  -5.652
   10    HA   PHE   2           HA       PHE   2   3.048  15.183  -4.175
   11    HD1  PHE   2           2HD      PHE   2   3.554  16.634  -6.587
   12    HD2  PHE   2           1HD      PHE   2   2.964  12.702  -8.110
   13    HE1  PHE   2           2HE      PHE   2   4.882  17.209  -8.577
   14    HE2  PHE   2           1HE      PHE   2   4.284  13.274 -10.102
   15    HZ   PHE   2           HZ       PHE   2   5.248  15.528 -10.339
   16    HB2  PHE   2           2HB      PHE   2   1.905  13.317  -6.169
   17    HB3  PHE   2           1HB      PHE   2   1.572  15.024  -5.913
   18    H    ARG   3           H        ARG   3   0.885  14.018  -3.471
   19    HA   ARG   3           HA       ARG   3   1.412  11.261  -2.701
   20    HE   ARG   3           HE       ARG   3   4.606  10.661   1.381
   21    HB2  ARG   3           2HB      ARG   3   1.905  13.341  -0.864
   22    HB3  ARG   3           1HB      ARG   3   0.403  12.580  -0.349
   23    HG2  ARG   3           2HG      ARG   3   1.704  11.102   0.675
   24    HG3  ARG   3           1HG      ARG   3   1.992  10.432  -0.917
   25    HD2  ARG   3           2HD      ARG   3   4.139  11.005  -0.829
   26    HD3  ARG   3           1HD      ARG   3   3.728  12.676  -0.446
   27   HH11  ARG   3          1HH1      ARG   3   2.685  13.559   1.088
   28   HH12  ARG   3          2HH1      ARG   3   2.850  13.987   2.758
   29   HH21  ARG   3          1HH2      ARG   3   4.823  11.222   3.577
   30   HH22  ARG   3          2HH2      ARG   3   4.064  12.661   4.171
   31    H    SER   4           H        SER   4  -0.313  10.026  -2.809
   32    HA   SER   4           HA       SER   4  -3.003  11.221  -2.742
   33    HG   SER   4           HG       SER   4  -4.541   9.198  -4.508
   34    HB2  SER   4           2HB      SER   4  -2.921  10.474  -4.946
   35    HB3  SER   4           1HB      SER   4  -1.784   9.178  -4.571
   36    H    THR   5           H        THR   5  -4.701   9.568  -2.020
   37    HA   THR   5           HA       THR   5  -3.568   7.436  -0.404
   38    HB   THR   5           HB       THR   5  -4.613   8.094   1.660
   39    HG1  THR   5           1HG      THR   5  -6.133   9.538   1.757
   40   HG21  THR   5          3HG2      THR   5  -3.472  10.717   0.824
   41   HG22  THR   5          1HG2      THR   5  -2.420   9.304   0.927
   42   HG23  THR   5          2HG2      THR   5  -3.311   9.845   2.346
   43    H    SER   6           H        SER   6  -4.741   5.661  -0.329
   44    HA   SER   6           HA       SER   6  -7.538   5.810  -1.266
   45    HG   SER   6           HG       SER   6  -7.439   3.247  -3.308
   46    HB2  SER   6           2HB      SER   6  -5.860   4.547  -2.724
   47    HB3  SER   6           1HB      SER   6  -5.773   3.361  -1.422
   48    H    HIS   7           H        HIS   7  -9.105   5.085   0.070
   49    HA   HIS   7           HA       HIS   7  -8.265   3.669   2.523
   50    HD1  HIS   7           1HD      HIS   7  -9.914   6.793   5.006
   51    HD2  HIS   7           2HD      HIS   7 -10.017   2.680   4.422
   52    HE1  HIS   7           1HE      HIS   7 -10.114   5.792   7.302
   53    HE2  HIS   7           2HE      HIS   7 -10.263   3.307   6.917
   54    HB2  HIS   7           2HB      HIS   7  -9.260   6.074   2.636
   55    HB3  HIS   7           1HB      HIS   7 -10.797   5.271   2.345
   56    H    VAL   8           H        VAL   8  -9.157   1.723   2.962
   57    HA   VAL   8           HA       VAL   8 -11.652   0.953   1.625
   58    HB   VAL   8           HB       VAL   8  -9.383  -1.010   1.736
   59   HG11  VAL   8          1HG1      VAL   8 -10.600  -2.139  -0.000
   60   HG12  VAL   8          2HG1      VAL   8 -11.735  -0.798  -0.137
   61   HG13  VAL   8          3HG1      VAL   8 -11.704  -1.781   1.327
   62   HG21  VAL   8          3HG2      VAL   8  -9.941   0.759  -0.639
   63   HG22  VAL   8          1HG2      VAL   8  -8.663  -0.444  -0.466
   64   HG23  VAL   8          2HG2      VAL   8  -8.622   1.029   0.501
   65    H    ARG   9           H        ARG   9 -12.782  -0.813   2.675
   66    HA   ARG   9           HA       ARG   9 -11.992  -1.057   5.491
   67    HE   ARG   9           HE       ARG   9 -14.439   1.240   3.110
   68    HB2  ARG   9           2HB      ARG   9 -14.618  -1.172   4.097
   69    HB3  ARG   9           1HB      ARG   9 -14.417  -2.162   5.535
   70    HG2  ARG   9           2HG      ARG   9 -15.374  -0.068   6.171
   71    HG3  ARG   9           1HG      ARG   9 -13.717  -0.142   6.779
   72    HD2  ARG   9           2HD      ARG   9 -14.164   2.048   5.845
   73    HD3  ARG   9           1HD      ARG   9 -12.970   1.201   4.863
   74   HH11  ARG   9          1HH1      ARG   9 -16.182   1.946   6.050
   75   HH12  ARG   9          2HH1      ARG   9 -17.651   2.354   5.229
   76   HH21  ARG   9          1HH2      ARG   9 -16.371   1.776   2.029
   77   HH22  ARG   9          2HH2      ARG   9 -17.759   2.258   2.946
   78    H    THR  10           H        THR  10 -10.680  -2.746   5.790
   79    HA   THR  10           HA       THR  10 -11.534  -5.365   4.750
   80    HB   THR  10           HB       THR  10  -9.312  -4.000   3.850
   81    HG1  THR  10           1HG      THR  10 -10.440  -5.887   2.984
   82   HG21  THR  10          3HG2      THR  10  -8.334  -4.686   6.167
   83   HG22  THR  10          1HG2      THR  10  -7.374  -4.847   4.691
   84   HG23  THR  10          2HG2      THR  10  -8.166  -6.262   5.387
   85    H    GLU  11           H        GLU  11 -10.782  -7.224   6.019
   86    HA   GLU  11           HA       GLU  11 -10.423  -6.494   8.849
   87    HB2  GLU  11           2HB      GLU  11 -12.135  -8.346   7.535
   88    HB3  GLU  11           1HB      GLU  11 -11.028  -9.262   8.550
   89    HG2  GLU  11           2HG      GLU  11 -12.086  -8.650  10.396
   90    HG3  GLU  11           1HG      GLU  11 -12.040  -6.949   9.934
   91    H    SER  12           H        SER  12  -8.820  -7.469  10.130
   92    HA   SER  12           HA       SER  12  -6.780  -8.329  10.607
   93    HG   SER  12           HG       SER  12  -5.903 -11.456   8.865
   94    HB2  SER  12           2HB      SER  12  -7.695 -10.471  10.201
   95    HB3  SER  12           1HB      SER  12  -7.663 -10.244   8.452
   96    H    ALA  13           H        ALA  13  -7.080  -6.231   8.586
   97    HA   ALA  13           HA       ALA  13  -5.390  -6.375   6.407
   98    HB1  ALA  13           3HB      ALA  13  -6.851  -4.453   7.085
   99    HB2  ALA  13           1HB      ALA  13  -5.266  -4.026   6.444
  100    HB3  ALA  13           2HB      ALA  13  -5.556  -3.991   8.176
  101    H    ALA  14           H        ALA  14  -4.448  -5.295   9.652
  102    HA   ALA  14           HA       ALA  14  -1.866  -4.585   9.291
  103    HB1  ALA  14           3HB      ALA  14  -1.429  -5.289  11.603
  104    HB2  ALA  14           1HB      ALA  14  -2.953  -6.180  11.597
  105    HB3  ALA  14           2HB      ALA  14  -2.956  -4.424  11.411
  106    H    ARG  15           H        ARG  15  -2.974  -7.891   9.000
  107    HA   ARG  15           HA       ARG  15  -0.314  -8.996   9.240
  108    HE   ARG  15           HE       ARG  15   1.208 -13.308   8.584
  109    HB2  ARG  15           2HB      ARG  15  -2.612 -10.141   9.725
  110    HB3  ARG  15           1HB      ARG  15  -2.621 -10.455   8.000
  111    HG2  ARG  15           2HG      ARG  15  -1.041 -11.688  10.141
  112    HG3  ARG  15           1HG      ARG  15  -1.651 -12.365   8.637
  113    HD2  ARG  15           2HD      ARG  15   0.199 -11.582   7.405
  114    HD3  ARG  15           1HD      ARG  15   0.674 -10.457   8.674
  115   HH11  ARG  15          1HH1      ARG  15   1.254 -10.366  10.469
  116   HH12  ARG  15          2HH1      ARG  15   2.409 -10.971  11.608
  117   HH21  ARG  15          1HH2      ARG  15   2.723 -14.100  10.085
  118   HH22  ARG  15          2HH2      ARG  15   3.242 -13.087  11.391
  119    H    TYR  16           H        TYR  16  -2.520  -8.178   6.614
  120    HA   TYR  16           HA       TYR  16  -0.892  -9.306   4.574
  121    HD1  TYR  16           1HD      TYR  16  -2.513 -10.696   4.817
  122    HD2  TYR  16           2HD      TYR  16  -5.122  -7.625   3.418
  123    HE1  TYR  16           1HE      TYR  16  -4.401 -12.241   4.945
  124    HE2  TYR  16           2HE      TYR  16  -7.014  -9.178   3.556
  125    HH   TYR  16           HH       TYR  16  -7.033 -12.065   3.467
  126    HB2  TYR  16           2HB      TYR  16  -2.908  -7.062   4.334
  127    HB3  TYR  16           1HB      TYR  16  -2.215  -7.963   2.996
  128    H    VAL  17           H        VAL  17  -0.698  -6.375   6.403
  129    HA   VAL  17           HA       VAL  17   1.070  -5.063   4.535
  130    HB   VAL  17           HB       VAL  17   0.075  -4.366   7.271
  131   HG11  VAL  17          1HG1      VAL  17   1.720  -2.263   6.621
  132   HG12  VAL  17          2HG1      VAL  17   2.725  -3.657   6.258
  133   HG13  VAL  17          3HG1      VAL  17   2.042  -3.454   7.874
  134   HG21  VAL  17          3HG2      VAL  17   0.303  -2.754   4.755
  135   HG22  VAL  17          1HG2      VAL  17  -0.613  -2.351   6.206
  136   HG23  VAL  17          2HG2      VAL  17  -1.110  -3.713   5.196
  137    H    ASN  18           H        ASN  18   1.371  -6.763   7.634
  138    HA   ASN  18           HA       ASN  18   4.184  -6.505   7.793
  139    HB2  ASN  18           2HB      ASN  18   2.502  -8.668   9.064
  140    HB3  ASN  18           1HB      ASN  18   4.067  -8.071   9.608
  141   HD21  ASN  18          1HD2      ASN  18   1.758  -8.211  11.199
  142   HD22  ASN  18          2HD2      ASN  18   1.306  -6.603  11.635
  143    H    ARG  19           H        ARG  19   2.087  -8.784   6.152
  144    HA   ARG  19           HA       ARG  19   4.133 -10.753   5.773
  145    HE   ARG  19           HE       ARG  19  -0.055 -12.551   5.105
  146    HB2  ARG  19           2HB      ARG  19   1.435 -10.823   5.650
  147    HB3  ARG  19           1HB      ARG  19   1.820 -10.721   3.938
  148    HG2  ARG  19           2HG      ARG  19   2.217 -12.891   3.923
  149    HG3  ARG  19           1HG      ARG  19   3.553 -12.633   5.044
  150    HD2  ARG  19           2HD      ARG  19   2.068 -14.263   5.983
  151    HD3  ARG  19           1HD      ARG  19   1.949 -12.774   6.918
  152   HH11  ARG  19          1HH1      ARG  19   0.841 -15.008   7.414
  153   HH12  ARG  19          2HH1      ARG  19  -0.787 -15.545   7.662
  154   HH21  ARG  19          1HH2      ARG  19  -2.197 -13.256   5.429
  155   HH22  ARG  19          2HH2      ARG  19  -2.511 -14.550   6.535
  156    H    LEU  20           H        LEU  20   3.314  -7.835   4.170
  157    HA   LEU  20           HA       LEU  20   4.202  -8.523   1.564
  158    HG   LEU  20           HG       LEU  20   1.798  -6.606   2.767
  159    HB2  LEU  20           2HB      LEU  20   4.007  -5.829   2.894
  160    HB3  LEU  20           1HB      LEU  20   4.293  -6.078   1.184
  161   HD11  LEU  20          1HD1      LEU  20   0.807  -5.026   1.367
  162   HD12  LEU  20          2HD1      LEU  20   2.049  -5.211   0.127
  163   HD13  LEU  20          3HD1      LEU  20   2.425  -4.371   1.630
  164   HD21  LEU  20          3HD2      LEU  20   0.864  -7.519   0.586
  165   HD22  LEU  20          1HD2      LEU  20   1.940  -8.592   1.479
  166   HD23  LEU  20          2HD2      LEU  20   2.532  -7.725   0.061
  167    H    CYS  21           H        CYS  21   5.821  -6.846   4.258
  168    HA   CYS  21           HA       CYS  21   8.213  -6.264   2.969
  169    HG   CYS  21           HG       CYS  21   6.853  -7.175   6.795
  170    HB2  CYS  21           2HB      CYS  21   9.248  -6.197   5.185
  171    HB3  CYS  21           1HB      CYS  21   7.660  -5.439   5.231
  172    H    LYS  22           H        LYS  22   7.117  -9.234   4.463
  173    HA   LYS  22           HA       LYS  22   9.637 -10.580   4.034
  174    HB2  LYS  22           2HB      LYS  22   6.965 -11.753   4.822
  175    HB3  LYS  22           1HB      LYS  22   8.532 -12.540   4.954
  176    HG2  LYS  22           2HG      LYS  22   8.932 -11.608   6.938
  177    HG3  LYS  22           1HG      LYS  22   8.511 -10.005   6.346
  178    HD2  LYS  22           2HD      LYS  22   6.991 -10.534   8.119
  179    HD3  LYS  22           1HD      LYS  22   6.099 -10.595   6.601
  180    HE2  LYS  22           2HE      LYS  22   6.684 -13.155   6.712
  181    HE3  LYS  22           1HE      LYS  22   6.887 -12.817   8.434
  182    HZ1  LYS  22           3HZ      LYS  22   4.618 -11.819   8.359
  183    HZ2  LYS  22           1HZ      LYS  22   4.665 -13.491   8.101
  184    HZ3  LYS  22           2HZ      LYS  22   4.449 -12.438   6.795
  185    H    HIS  23           H        HIS  23   6.755  -9.999   2.266
  186    HA   HIS  23           HA       HIS  23   7.049 -12.267   0.507
  187    HD1  HIS  23           1HD      HIS  23   3.170 -12.672   0.145
  188    HD2  HIS  23           2HD      HIS  23   6.055 -11.425  -2.573
  189    HE1  HIS  23           1HE      HIS  23   2.609 -13.835  -2.013
  190    HE2  HIS  23           2HE      HIS  23   4.423 -13.137  -3.617
  191    HB2  HIS  23           2HB      HIS  23   4.836 -11.193   1.197
  192    HB3  HIS  23           1HB      HIS  23   5.234  -9.908   0.060
  193    H    TRP  24           H        TRP  24   7.064  -8.704  -0.044
  194    HA   TRP  24           HA       TRP  24   8.414  -9.170  -2.583
  195    HD1  TRP  24           HD       TRP  24   4.858  -7.345  -1.129
  196    HE1  TRP  24           1HE      TRP  24   3.083  -7.988  -2.877
  197    HE3  TRP  24           3HE      TRP  24   7.902  -7.963  -5.190
  198    HZ2  TRP  24           2HZ      TRP  24   2.985  -8.668  -5.615
  199    HZ3  TRP  24           3HZ      TRP  24   6.888  -8.611  -7.335
  200    HH2  TRP  24           HH       TRP  24   4.479  -8.956  -7.542
  201    HB2  TRP  24           2HB      TRP  24   7.375  -6.651  -1.281
  202    HB3  TRP  24           1HB      TRP  24   8.146  -6.704  -2.862
  203    H    GLY  25           H        GLY  25   9.379  -8.601   0.636
  204    HA2  GLY  25           2HA      GLY  25  11.621  -6.918   0.166
  205    HA3  GLY  25           1HA      GLY  25  11.369  -7.931   1.571
  206    H    HIS  26           H        HIS  26  12.123  -8.333  -1.890
  207    HA   HIS  26           HA       HIS  26  14.021 -10.445  -1.116
  208    HD1  HIS  26           1HD      HIS  26  12.827 -13.267  -3.961
  209    HD2  HIS  26           2HD      HIS  26  11.262 -11.253  -0.681
  210    HE1  HIS  26           1HE      HIS  26  11.443 -14.965  -2.727
  211    HE2  HIS  26           2HE      HIS  26  10.577 -13.746  -0.699
  212    HB2  HIS  26           2HB      HIS  26  12.331 -10.029  -3.559
  213    HB3  HIS  26           1HB      HIS  26  13.813 -10.974  -3.671
  214    H    LYS  27           H        LYS  27  13.607  -7.443  -2.851
  215    HA   LYS  27           HA       LYS  27  16.512  -7.143  -2.964
  216    HB2  LYS  27           2HB      LYS  27  16.059  -8.157  -5.108
  217    HB3  LYS  27           1HB      LYS  27  14.725  -7.056  -5.407
  218    HG2  LYS  27           2HG      LYS  27  17.270  -5.687  -4.970
  219    HG3  LYS  27           1HG      LYS  27  17.280  -6.781  -6.352
  220    HD2  LYS  27           2HD      LYS  27  14.967  -4.937  -6.003
  221    HD3  LYS  27           1HD      LYS  27  16.493  -4.279  -6.594
  222    HE2  LYS  27           2HE      LYS  27  15.844  -6.733  -7.957
  223    HE3  LYS  27           1HE      LYS  27  14.511  -5.586  -8.076
  224    HZ1  LYS  27           3HZ      LYS  27  17.172  -4.518  -8.556
  225    HZ2  LYS  27           1HZ      LYS  27  15.712  -4.182  -9.341
  226    HZ3  LYS  27           2HZ      LYS  27  16.579  -5.582  -9.728
  227    H    PHE  28           H        PHE  28  14.028  -5.921  -1.664
  228    HA   PHE  28           HA       PHE  28  14.785  -3.155  -2.215
  229    HD1  PHE  28           1HD      PHE  28  13.432  -1.134  -3.639
  230    HD2  PHE  28           2HD      PHE  28  12.196  -5.098  -4.569
  231    HE1  PHE  28           1HE      PHE  28  13.623  -0.626  -6.040
  232    HE2  PHE  28           2HE      PHE  28  12.383  -4.598  -6.972
  233    HZ   PHE  28           HZ       PHE  28  13.098  -2.359  -7.709
  234    HB2  PHE  28           2HB      PHE  28  12.005  -4.286  -2.364
  235    HB3  PHE  28           1HB      PHE  28  12.278  -2.588  -1.985
  236    H    GLU  29           H        GLU  29  14.204  -1.670  -0.522
  237    HA   GLU  29           HA       GLU  29  14.551  -2.865   2.074
  238    HB2  GLU  29           2HB      GLU  29  14.373  -0.428   2.830
  239    HB3  GLU  29           1HB      GLU  29  15.725  -0.847   1.788
  240    HG2  GLU  29           2HG      GLU  29  13.352   0.019   0.336
  241    HG3  GLU  29           1HG      GLU  29  14.011   1.238   1.425
  242    H    VAL  30           H        VAL  30  12.871  -3.793   3.043
  243    HA   VAL  30           HA       VAL  30  10.284  -2.389   2.962
  244    HB   VAL  30           HB       VAL  30   9.565  -4.916   3.658
  245   HG11  VAL  30          1HG1      VAL  30   9.710  -3.583   0.982
  246   HG12  VAL  30          2HG1      VAL  30   8.311  -3.847   2.027
  247   HG13  VAL  30          3HG1      VAL  30   9.034  -5.200   1.161
  248   HG21  VAL  30          3HG2      VAL  30  11.601  -5.379   1.506
  249   HG22  VAL  30          1HG2      VAL  30  10.720  -6.557   2.479
  250   HG23  VAL  30          2HG2      VAL  30  11.991  -5.583   3.215
  251    H    GLU  31           H        GLU  31   9.741  -1.522   4.855
  252    HA   GLU  31           HA       GLU  31  10.910  -2.577   7.312
  253    HB2  GLU  31           2HB      GLU  31  10.327   0.004   6.423
  254    HB3  GLU  31           1HB      GLU  31   9.098  -0.323   7.638
  255    HG2  GLU  31           2HG      GLU  31  10.657  -0.567   9.334
  256    HG3  GLU  31           1HG      GLU  31  11.980  -0.871   8.209
  257    H    LEU  32           H        LEU  32   9.558  -3.036   9.167
  258    HA   LEU  32           HA       LEU  32   6.749  -3.595   8.529
  259    HG   LEU  32           HG       LEU  32   6.028  -6.315   8.408
  260    HB2  LEU  32           2HB      LEU  32   8.250  -5.615   8.219
  261    HB3  LEU  32           1HB      LEU  32   8.500  -5.592   9.951
  262   HD11  LEU  32          1HD1      LEU  32   6.219  -8.014  10.482
  263   HD12  LEU  32          2HD1      LEU  32   7.918  -7.589  10.268
  264   HD13  LEU  32          3HD1      LEU  32   7.004  -8.272   8.924
  265   HD21  LEU  32          3HD2      LEU  32   4.817  -6.335  10.611
  266   HD22  LEU  32          1HD2      LEU  32   5.136  -4.730   9.958
  267   HD23  LEU  32          2HD2      LEU  32   6.129  -5.363  11.269
  268    H    THR  33           H        THR  33   5.690  -2.352   9.894
  269    HA   THR  33           HA       THR  33   6.372  -2.543  12.775
  270    HB   THR  33           HB       THR  33   5.283  -0.104  12.715
  271    HG1  THR  33           1HG      THR  33   6.584  -0.299  10.204
  272   HG21  THR  33          3HG2      THR  33   8.140  -0.821  12.186
  273   HG22  THR  33          1HG2      THR  33   7.390  -0.277  13.687
  274   HG23  THR  33          2HG2      THR  33   7.616   0.854  12.354
  275    HA   PRO  34           HA       PRO  34   2.075  -3.452  13.193
  276    HB2  PRO  34           2HB      PRO  34   1.408  -2.380  15.567
  277    HB3  PRO  34           1HB      PRO  34   2.498  -3.759  15.420
  278    HG2  PRO  34           2HG      PRO  34   3.140  -0.885  15.897
  279    HG3  PRO  34           1HG      PRO  34   3.881  -2.331  16.603
  280    HD2  PRO  34           2HD      PRO  34   4.957  -0.885  14.516
  281    HD3  PRO  34           1HD      PRO  34   5.321  -2.590  14.850
  282    H    GLU  35           H        GLU  35   2.445  -1.327  11.492
  283    HA   GLU  35           HA       GLU  35  -0.034   0.096  11.830
  284    HB2  GLU  35           2HB      GLU  35   2.579   1.616  11.668
  285    HB3  GLU  35           1HB      GLU  35   0.977   2.333  11.567
  286    HG2  GLU  35           2HG      GLU  35   2.037   0.821  13.941
  287    HG3  GLU  35           1HG      GLU  35   2.039   2.574  13.776
  288    H    ARG  36           H        ARG  36   2.912  -0.363   9.851
  289    HA   ARG  36           HA       ARG  36   1.374  -0.759   7.521
  290    HE   ARG  36           HE       ARG  36   2.114   3.031  10.096
  291    HB2  ARG  36           2HB      ARG  36   2.186   1.217   6.247
  292    HB3  ARG  36           1HB      ARG  36   1.081   1.630   7.548
  293    HG2  ARG  36           2HG      ARG  36   3.451   1.831   8.829
  294    HG3  ARG  36           1HG      ARG  36   3.917   2.294   7.192
  295    HD2  ARG  36           2HD      ARG  36   3.233   4.336   7.826
  296    HD3  ARG  36           1HD      ARG  36   1.625   3.700   7.489
  297   HH11  ARG  36          1HH1      ARG  36   2.056   6.006   8.273
  298   HH12  ARG  36          2HH1      ARG  36   1.565   6.971   9.624
  299   HH21  ARG  36          1HH2      ARG  36   1.467   4.298  11.875
  300   HH22  ARG  36          2HH2      ARG  36   1.231   6.001  11.669
  301    H    GLY  37           H        GLY  37   2.716  -0.807   5.524
  302    HA2  GLY  37           2HA      GLY  37   5.373  -1.923   6.155
  303    HA3  GLY  37           1HA      GLY  37   4.377  -2.416   4.795
  304    H    PHE  38           H        PHE  38   7.065  -0.598   5.527
  305    HA   PHE  38           HA       PHE  38   6.571   1.431   3.461
  306    HD1  PHE  38           1HD      PHE  38   7.161   3.908   3.628
  307    HD2  PHE  38           2HD      PHE  38  10.793   1.998   4.782
  308    HE1  PHE  38           1HE      PHE  38   8.445   5.749   2.637
  309    HE2  PHE  38           2HE      PHE  38  12.078   3.828   3.769
  310    HZ   PHE  38           HZ       PHE  38  10.906   5.708   2.692
  311    HB2  PHE  38           2HB      PHE  38   7.418   2.179   5.638
  312    HB3  PHE  38           1HB      PHE  38   8.797   1.103   5.491
  313    H    ILE  39           H        ILE  39   7.288   1.120   1.487
  314    HA   ILE  39           HA       ILE  39   9.700  -0.538   1.070
  315    HB   ILE  39           HB       ILE  39   7.469  -0.679  -0.929
  316   HG12  ILE  39          2HG1      ILE  39   7.632  -2.205   1.668
  317   HG13  ILE  39          1HG1      ILE  39   6.234  -1.433   0.933
  318   HG21  ILE  39          1HG2      ILE  39   8.892  -3.110  -0.622
  319   HG22  ILE  39          2HG2      ILE  39  10.069  -1.801  -0.614
  320   HG23  ILE  39          3HG2      ILE  39   8.947  -1.968  -1.962
  321   HD11  ILE  39          3HD1      ILE  39   6.059  -3.171  -0.702
  322   HD12  ILE  39          1HD1      ILE  39   6.155  -3.898   0.902
  323   HD13  ILE  39          2HD1      ILE  39   7.568  -3.899  -0.152
  324    H    ASP  40           H        ASP  40  11.103   1.066   0.420
  325    HA   ASP  40           HA       ASP  40  10.114   2.961  -1.591
  326    HB2  ASP  40           2HB      ASP  40  12.368   4.139  -0.999
  327    HB3  ASP  40           1HB      ASP  40  10.992   4.280   0.087
  328    H    PHE  41           H        PHE  41  10.839   2.976  -3.570
  329    HA   PHE  41           HA       PHE  41  12.873   1.007  -4.342
  330    HD1  PHE  41           2HD      PHE  41  10.982  -0.086  -3.756
  331    HD2  PHE  41           1HD      PHE  41  10.460   0.432  -7.951
  332    HE1  PHE  41           2HE      PHE  41   9.935  -2.302  -3.895
  333    HE2  PHE  41           1HE      PHE  41   9.409  -1.788  -8.094
  334    HZ   PHE  41           HZ       PHE  41   9.145  -3.158  -6.064
  335    HB2  PHE  41           2HB      PHE  41  10.639   2.421  -5.756
  336    HB3  PHE  41           1HB      PHE  41  11.998   1.834  -6.700
  337    H    GLY  42           H        GLY  42  13.110   3.936  -3.230
  338    HA2  GLY  42           2HA      GLY  42  15.178   5.147  -3.447
  339    HA3  GLY  42           1HA      GLY  42  15.186   4.747  -5.160
  340    H    ASP  43           H        ASP  43  14.016   5.996  -6.596
  341    HA   ASP  43           HA       ASP  43  13.156   8.590  -5.585
  342    HB2  ASP  43           2HB      ASP  43  13.157   7.652  -8.460
  343    HB3  ASP  43           1HB      ASP  43  13.143   9.311  -7.870
  344    H    SER  44           H        SER  44  11.532   6.849  -4.547
  345    HA   SER  44           HA       SER  44   8.963   7.532  -5.097
  346    HG   SER  44           HG       SER  44   9.891   4.395  -7.466
  347    HB2  SER  44           2HB      SER  44   8.336   5.204  -6.285
  348    HB3  SER  44           1HB      SER  44   8.738   6.648  -7.216
  349    H    ASN  45           H        ASN  45   7.374   6.123  -3.888
  350    HA   ASN  45           HA       ASN  45   8.537   3.951  -2.351
  351    HB2  ASN  45           2HB      ASN  45   7.302   6.198  -0.777
  352    HB3  ASN  45           1HB      ASN  45   8.348   4.903  -0.208
  353   HD21  ASN  45          1HD2      ASN  45   8.386   7.690  -2.408
  354   HD22  ASN  45          2HD2      ASN  45  10.002   8.172  -2.037
  355    H    CYS  46           H        CYS  46   6.835   2.989  -0.826
  356    HA   CYS  46           HA       CYS  46   4.095   3.597  -1.541
  357    HG   CYS  46           HG       CYS  46   2.459   1.251  -3.043
  358    HB2  CYS  46           2HB      CYS  46   4.746   2.088  -3.336
  359    HB3  CYS  46           1HB      CYS  46   5.337   0.911  -2.167
  360    H    GLU  47           H        GLU  47   3.441   3.900   0.510
  361    HA   GLU  47           HA       GLU  47   4.148   1.928   2.552
  362    HB2  GLU  47           2HB      GLU  47   4.250   4.586   2.699
  363    HB3  GLU  47           1HB      GLU  47   2.567   4.393   3.160
  364    HG2  GLU  47           2HG      GLU  47   3.092   3.422   5.167
  365    HG3  GLU  47           1HG      GLU  47   4.630   2.780   4.589
  366    H    LEU  48           H        LEU  48   2.476   1.018   3.917
  367    HA   LEU  48           HA       LEU  48  -0.252   1.211   2.866
  368    HG   LEU  48           HG       LEU  48  -0.983  -2.007   3.734
  369    HB2  LEU  48           2HB      LEU  48   0.752  -0.677   1.673
  370    HB3  LEU  48           1HB      LEU  48   1.227  -1.413   3.190
  371   HD11  LEU  48          1HD1      LEU  48  -2.852  -1.275   2.062
  372   HD12  LEU  48          2HD1      LEU  48  -1.758   0.068   1.741
  373   HD13  LEU  48          3HD1      LEU  48  -2.359  -0.210   3.376
  374   HD21  LEU  48          3HD2      LEU  48  -1.825  -2.987   1.450
  375   HD22  LEU  48          1HD2      LEU  48  -0.372  -3.612   2.228
  376   HD23  LEU  48          2HD2      LEU  48  -0.235  -2.469   0.892
  377    H    LEU  49           H        LEU  49  -1.474   1.749   4.534
  378    HA   LEU  49           HA       LEU  49  -0.698   0.955   7.246
  379    HG   LEU  49           HG       LEU  49  -2.057   1.814   9.012
  380    HB2  LEU  49           2HB      LEU  49  -1.564   3.302   6.555
  381    HB3  LEU  49           1HB      LEU  49  -3.145   2.545   6.563
  382   HD11  LEU  49          1HD1      LEU  49  -1.656   4.353   9.756
  383   HD12  LEU  49          2HD1      LEU  49  -0.994   4.421   8.122
  384   HD13  LEU  49          3HD1      LEU  49  -0.350   3.265   9.289
  385   HD21  LEU  49          3HD2      LEU  49  -4.355   2.357   8.741
  386   HD22  LEU  49          1HD2      LEU  49  -3.972   3.997   8.216
  387   HD23  LEU  49          2HD2      LEU  49  -3.686   3.517   9.889
  388    H    ALA  50           H        ALA  50  -1.668  -0.647   8.366
  389    HA   ALA  50           HA       ALA  50  -4.228  -1.652   7.376
  390    HB1  ALA  50           3HB      ALA  50  -2.569  -2.920   6.193
  391    HB2  ALA  50           1HB      ALA  50  -3.411  -3.941   7.345
  392    HB3  ALA  50           2HB      ALA  50  -1.788  -3.366   7.710
  393    H    HIS  51           H        HIS  51  -5.557  -1.639   9.001
  394    HA   HIS  51           HA       HIS  51  -4.614  -2.481  11.626
  395    HD1  HIS  51           1HD      HIS  51  -7.593   0.015  13.761
  396    HD2  HIS  51           2HD      HIS  51  -3.641  -1.176  13.248
  397    HE1  HIS  51           1HE      HIS  51  -6.501   0.317  16.005
  398    HE2  HIS  51           2HE      HIS  51  -4.136  -0.489  15.690
  399    HB2  HIS  51           2HB      HIS  51  -5.819  -0.087  10.988
  400    HB3  HIS  51           1HB      HIS  51  -7.190  -1.050  11.518
  401    HA   PRO  52           HA       PRO  52  -7.141  -6.055  11.880
  402    HB2  PRO  52           2HB      PRO  52  -8.857  -4.621  13.867
  403    HB3  PRO  52           1HB      PRO  52  -8.154  -6.243  13.944
  404    HG2  PRO  52           2HG      PRO  52  -7.032  -4.253  15.275
  405    HG3  PRO  52           1HG      PRO  52  -6.024  -5.438  14.428
  406    HD2  PRO  52           2HD      PRO  52  -6.676  -2.628  13.676
  407    HD3  PRO  52           1HD      PRO  52  -5.185  -3.545  13.407
  408    H    ASP  53           H        ASP  53  -8.806  -3.025  11.224
  409    HA   ASP  53           HA       ASP  53 -10.742  -4.582   9.693
  410    HB2  ASP  53           2HB      ASP  53 -11.700  -2.312  11.427
  411    HB3  ASP  53           1HB      ASP  53 -12.661  -3.519  10.581
  412    H    HIS  54           H        HIS  54  -8.550  -2.126   9.557
  413    HA   HIS  54           HA       HIS  54  -9.857  -1.192   7.146
  414    HD1  HIS  54           1HD      HIS  54 -10.092   0.426  11.190
  415    HD2  HIS  54           2HD      HIS  54  -6.975   1.868   8.848
  416    HE1  HIS  54           1HE      HIS  54  -8.449   1.433  12.804
  417    HE2  HIS  54           2HE      HIS  54  -6.602   2.358  11.361
  418    HB2  HIS  54           2HB      HIS  54  -9.450   1.198   7.631
  419    HB3  HIS  54           1HB      HIS  54 -10.629   0.461   8.699
  420    H    VAL  55           H        VAL  55  -8.423  -0.045   5.643
  421    HA   VAL  55           HA       VAL  55  -5.579  -0.339   6.227
  422    HB   VAL  55           HB       VAL  55  -6.698  -2.328   4.911
  423   HG11  VAL  55          1HG1      VAL  55  -7.515  -0.544   3.175
  424   HG12  VAL  55          2HG1      VAL  55  -6.984  -2.140   2.650
  425   HG13  VAL  55          3HG1      VAL  55  -5.894  -0.761   2.516
  426   HG21  VAL  55          3HG2      VAL  55  -4.584  -2.827   3.880
  427   HG22  VAL  55          1HG2      VAL  55  -4.311  -2.085   5.455
  428   HG23  VAL  55          2HG2      VAL  55  -4.098  -1.134   3.985
  429    H    LEU  56           H        LEU  56  -4.317   1.193   5.311
  430    HA   LEU  56           HA       LEU  56  -5.632   3.134   3.520
  431    HG   LEU  56           HG       LEU  56  -6.404   4.715   5.484
  432    HB2  LEU  56           2HB      LEU  56  -4.332   3.540   6.069
  433    HB3  LEU  56           1HB      LEU  56  -3.468   4.412   4.825
  434   HD11  LEU  56          1HD1      LEU  56  -5.879   6.705   6.580
  435   HD12  LEU  56          2HD1      LEU  56  -4.247   6.752   5.914
  436   HD13  LEU  56          3HD1      LEU  56  -4.663   5.560   7.146
  437   HD21  LEU  56          3HD2      LEU  56  -6.404   5.399   3.302
  438   HD22  LEU  56          1HD2      LEU  56  -4.687   5.808   3.312
  439   HD23  LEU  56          2HD2      LEU  56  -5.857   6.891   4.061
  440    H    MET  57           H        MET  57  -4.436   3.930   1.814
  441    HA   MET  57           HA       MET  57  -1.818   2.660   1.394
  442    HB2  MET  57           2HB      MET  57  -3.744   3.191  -0.850
  443    HB3  MET  57           1HB      MET  57  -2.325   2.150  -0.844
  444    HG2  MET  57           2HG      MET  57  -3.437   0.632   0.725
  445    HG3  MET  57           1HG      MET  57  -4.865   1.668   0.694
  446    HE1  MET  57           3HE      MET  57  -6.562   1.513  -2.219
  447    HE2  MET  57           1HE      MET  57  -6.559   1.539  -0.456
  448    HE3  MET  57           2HE      MET  57  -6.991   0.062  -1.316
  449    H    ILE  58           H        ILE  58  -0.276   4.189   1.401
  450    HA   ILE  58           HA       ILE  58  -0.863   6.726   0.037
  451    HB   ILE  58           HB       ILE  58   0.929   6.376   2.446
  452   HG12  ILE  58          2HG1      ILE  58  -1.929   6.702   2.290
  453   HG13  ILE  58          1HG1      ILE  58  -0.921   6.505   3.710
  454   HG21  ILE  58          1HG2      ILE  58   0.012   8.867   1.025
  455   HG22  ILE  58          2HG2      ILE  58   1.616   8.141   0.900
  456   HG23  ILE  58          3HG2      ILE  58   1.064   8.799   2.440
  457   HD11  ILE  58          3HD1      ILE  58  -1.206   9.174   2.381
  458   HD12  ILE  58          1HD1      ILE  58  -0.713   8.797   4.032
  459   HD13  ILE  58          2HD1      ILE  58  -2.394   8.585   3.546
  460    H    LEU  59           H        LEU  59   0.653   7.431  -1.390
  461    HA   LEU  59           HA       LEU  59   3.112   5.824  -1.610
  462    HG   LEU  59           HG       LEU  59   1.329   6.977  -5.316
  463    HB2  LEU  59           2HB      LEU  59   3.006   5.838  -3.937
  464    HB3  LEU  59           1HB      LEU  59   1.367   5.492  -3.431
  465   HD11  LEU  59          1HD1      LEU  59   0.640   8.491  -2.819
  466   HD12  LEU  59          2HD1      LEU  59  -0.372   7.266  -3.585
  467   HD13  LEU  59          3HD1      LEU  59  -0.010   8.771  -4.431
  468   HD21  LEU  59          3HD2      LEU  59   3.650   8.049  -4.393
  469   HD22  LEU  59          1HD2      LEU  59   2.488   9.312  -3.999
  470   HD23  LEU  59          2HD2      LEU  59   2.643   8.750  -5.657
  471    H    ASN  60           H        ASN  60   5.008   6.861  -2.130
  472    HA   ASN  60           HA       ASN  60   4.900   9.806  -2.161
  473    HB2  ASN  60           2HB      ASN  60   7.200   8.210  -1.022
  474    HB3  ASN  60           1HB      ASN  60   6.887   9.935  -0.848
  475   HD21  ASN  60          1HD2      ASN  60   7.412   8.536   1.366
  476   HD22  ASN  60          2HD2      ASN  60   5.985   8.319   2.316
  477    H    SER  61           H        SER  61   5.163  10.209  -4.288
  478    HA   SER  61           HA       SER  61   7.649   9.205  -5.507
  479    HG   SER  61           HG       SER  61   5.606   7.175  -5.255
  480    HB2  SER  61           2HB      SER  61   5.380   9.061  -7.360
  481    HB3  SER  61           1HB      SER  61   6.704   7.930  -7.109
  482    HA   PRO  62           HA       PRO  62   7.908  13.366  -7.033
  483    HB2  PRO  62           2HB      PRO  62   9.873  12.974  -8.836
  484    HB3  PRO  62           1HB      PRO  62  10.139  12.998  -7.092
  485    HG2  PRO  62           2HG      PRO  62   9.798  10.629  -8.901
  486    HG3  PRO  62           1HG      PRO  62  11.032  10.911  -7.656
  487    HD2  PRO  62           2HD      PRO  62   8.888   9.394  -7.176
  488    HD3  PRO  62           1HD      PRO  62   9.563  10.455  -5.926
  489    H    ASP  63           H        ASP  63   6.812  10.741  -8.959
  490    HA   ASP  63           HA       ASP  63   5.867  12.689 -10.934
  491    HB2  ASP  63           2HB      ASP  63   6.321  10.993 -12.747
  492    HB3  ASP  63           1HB      ASP  63   7.756  11.722 -12.034
  493    H    GLU  64           H        GLU  64   3.812  12.187 -11.859
  494    HA   GLU  64           HA       GLU  64   2.109  10.623 -10.207
  495    HB2  GLU  64           2HB      GLU  64   1.715  11.945 -12.862
  496    HB3  GLU  64           1HB      GLU  64   0.597  10.673 -12.405
  497    HG2  GLU  64           2HG      GLU  64  -0.484  12.450 -11.516
  498    HG3  GLU  64           1HG      GLU  64   0.514  11.988 -10.134
  499    H    ASP  65           H        ASP  65   3.676   9.760 -13.323
  500    HA   ASP  65           HA       ASP  65   2.513   7.308 -13.789
  501    HB2  ASP  65           2HB      ASP  65   4.329   8.432 -15.151
  502    HB3  ASP  65           1HB      ASP  65   5.484   7.826 -13.966
  503    H    SER  66           H        SER  66   5.369   7.987 -11.798
  504    HA   SER  66           HA       SER  66   5.620   5.425 -10.644
  505    HG   SER  66           HG       SER  66   7.839   5.943 -10.823
  506    HB2  SER  66           2HB      SER  66   6.472   8.172  -9.721
  507    HB3  SER  66           1HB      SER  66   6.854   6.708  -8.813
  508    H    LEU  67           H        LEU  67   4.297   8.414  -9.384
  509    HA   LEU  67           HA       LEU  67   3.217   7.786  -7.003
  510    HG   LEU  67           HG       LEU  67   1.024   9.532  -6.501
  511    HB2  LEU  67           2HB      LEU  67   3.083   9.999  -7.793
  512    HB3  LEU  67           1HB      LEU  67   2.241   9.526  -9.239
  513   HD11  LEU  67          1HD1      LEU  67  -0.235  11.460  -7.958
  514   HD12  LEU  67          2HD1      LEU  67   1.453  11.645  -8.429
  515   HD13  LEU  67          3HD1      LEU  67   0.998  11.732  -6.728
  516   HD21  LEU  67          3HD2      LEU  67  -0.328   8.074  -7.656
  517   HD22  LEU  67          1HD2      LEU  67  -0.010   8.855  -9.204
  518   HD23  LEU  67          2HD2      LEU  67  -1.087   9.618  -8.038
  519    H    ALA  68           H        ALA  68   1.312   7.484 -10.025
  520    HA   ALA  68           HA       ALA  68  -0.793   6.081  -8.745
  521    HB1  ALA  68           3HB      ALA  68  -1.431   7.115 -10.728
  522    HB2  ALA  68           1HB      ALA  68  -1.325   5.419 -11.200
  523    HB3  ALA  68           2HB      ALA  68  -0.018   6.532 -11.609
  524    H    HIS  69           H        HIS  69   2.129   5.064 -10.431
  525    HA   HIS  69           HA       HIS  69   1.596   2.347 -10.729
  526    HD1  HIS  69           1HD      HIS  69   2.719   0.424 -10.175
  527    HD2  HIS  69           2HD      HIS  69   6.108   1.994 -11.996
  528    HE1  HIS  69           1HE      HIS  69   4.089  -1.565 -10.874
  529    HE2  HIS  69           2HE      HIS  69   6.092  -0.592 -12.052
  530    HB2  HIS  69           2HB      HIS  69   3.602   3.583 -11.619
  531    HB3  HIS  69           1HB      HIS  69   4.282   3.530  -9.996
  532    H    MET  70           H        MET  70   2.701   4.190  -7.965
  533    HA   MET  70           HA       MET  70   3.107   1.878  -6.284
  534    HB2  MET  70           2HB      MET  70   2.810   4.687  -5.266
  535    HB3  MET  70           1HB      MET  70   3.817   3.402  -4.624
  536    HG2  MET  70           2HG      MET  70   4.536   4.210  -7.337
  537    HG3  MET  70           1HG      MET  70   4.678   5.494  -6.142
  538    HE1  MET  70           3HE      MET  70   6.903   3.387  -7.975
  539    HE2  MET  70           1HE      MET  70   5.853   2.086  -7.414
  540    HE3  MET  70           2HE      MET  70   7.540   2.140  -6.904
  541    H    GLN  71           H        GLN  71   0.740   4.602  -6.138
  542    HA   GLN  71           HA       GLN  71  -0.811   3.524  -4.119
  543    HB2  GLN  71           2HB      GLN  71  -2.741   4.852  -5.285
  544    HB3  GLN  71           1HB      GLN  71  -1.429   5.696  -4.491
  545    HG2  GLN  71           2HG      GLN  71  -0.882   6.716  -6.376
  546    HG3  GLN  71           1HG      GLN  71  -0.837   5.198  -7.266
  547   HE21  GLN  71          1HE2      GLN  71  -2.282   8.127  -7.102
  548   HE22  GLN  71          2HE2      GLN  71  -3.762   7.773  -7.918
  549    H    ASN  72           H        ASN  72  -0.747   2.659  -7.493
  550    HA   ASN  72           HA       ASN  72  -3.237   1.201  -7.354
  551    HB2  ASN  72           2HB      ASN  72  -2.017   2.327  -9.435
  552    HB3  ASN  72           1HB      ASN  72  -1.306   0.721  -9.568
  553   HD21  ASN  72          1HD2      ASN  72  -2.426   0.588 -11.590
  554   HD22  ASN  72          2HD2      ASN  72  -4.098   0.153 -11.622
  555    H    VAL  73           H        VAL  73   0.221   0.388  -7.491
  556    HA   VAL  73           HA       VAL  73   0.190  -2.321  -7.702
  557    HB   VAL  73           HB       VAL  73   1.947  -0.483  -6.117
  558   HG11  VAL  73          1HG1      VAL  73   2.146  -3.491  -6.125
  559   HG12  VAL  73          2HG1      VAL  73   1.948  -2.434  -4.727
  560   HG13  VAL  73          3HG1      VAL  73   3.454  -2.409  -5.645
  561   HG21  VAL  73          3HG2      VAL  73   3.361  -0.649  -7.867
  562   HG22  VAL  73          1HG2      VAL  73   1.897  -1.121  -8.729
  563   HG23  VAL  73          2HG2      VAL  73   3.006  -2.355  -8.131
  564    H    VAL  74           H        VAL  74  -0.469  -0.445  -4.777
  565    HA   VAL  74           HA       VAL  74  -0.768  -2.721  -3.080
  566    HB   VAL  74           HB       VAL  74  -1.817   0.085  -2.717
  567   HG11  VAL  74          1HG1      VAL  74  -2.194  -0.423  -0.420
  568   HG12  VAL  74          2HG1      VAL  74  -1.455  -2.014  -0.588
  569   HG13  VAL  74          3HG1      VAL  74  -2.998  -1.673  -1.367
  570   HG21  VAL  74          3HG2      VAL  74   0.320   0.614  -2.358
  571   HG22  VAL  74          1HG2      VAL  74   0.816  -1.077  -2.430
  572   HG23  VAL  74          2HG2      VAL  74   0.245  -0.388  -0.911
  573    H    ALA  75           H        ALA  75  -3.114  -0.622  -4.787
  574    HA   ALA  75           HA       ALA  75  -5.491  -1.640  -3.885
  575    HB1  ALA  75           3HB      ALA  75  -5.468   0.199  -5.430
  576    HB2  ALA  75           1HB      ALA  75  -6.417  -1.109  -6.136
  577    HB3  ALA  75           2HB      ALA  75  -4.773  -0.813  -6.697
  578    H    ASP  76           H        ASP  76  -3.132  -3.113  -5.940
  579    HA   ASP  76           HA       ASP  76  -4.818  -5.253  -6.858
  580    HB2  ASP  76           2HB      ASP  76  -2.479  -4.236  -7.758
  581    HB3  ASP  76           1HB      ASP  76  -1.880  -5.629  -6.863
  582    H    HIS  77           H        HIS  77  -2.351  -4.871  -4.339
  583    HA   HIS  77           HA       HIS  77  -2.230  -7.541  -3.511
  584    HD1  HIS  77           1HD      HIS  77  -0.701  -6.300  -4.901
  585    HD2  HIS  77           2HD      HIS  77   1.090  -4.672  -1.524
  586    HE1  HIS  77           1HE      HIS  77   1.546  -5.472  -5.665
  587    HE2  HIS  77           2HE      HIS  77   2.578  -4.417  -3.624
  588    HB2  HIS  77           2HB      HIS  77  -1.876  -5.119  -1.735
  589    HB3  HIS  77           1HB      HIS  77  -1.223  -6.725  -1.472
  590    H    LEU  78           H        LEU  78  -4.413  -4.932  -2.480
  591    HA   LEU  78           HA       LEU  78  -5.690  -6.394  -0.438
  592    HG   LEU  78           HG       LEU  78  -4.964  -3.192  -0.705
  593    HB2  LEU  78           2HB      LEU  78  -6.623  -4.071  -2.128
  594    HB3  LEU  78           1HB      LEU  78  -7.552  -4.722  -0.793
  595   HD11  LEU  78          1HD1      LEU  78  -7.186  -2.045  -0.669
  596   HD12  LEU  78          2HD1      LEU  78  -6.160  -1.730   0.731
  597   HD13  LEU  78          3HD1      LEU  78  -7.509  -2.858   0.863
  598   HD21  LEU  78          3HD2      LEU  78  -4.985  -3.669   1.766
  599   HD22  LEU  78          1HD2      LEU  78  -4.509  -5.026   0.746
  600   HD23  LEU  78          2HD2      LEU  78  -6.131  -4.967   1.434
  601    H    GLN  79           H        GLN  79  -6.003  -6.333  -3.896
  602    HA   GLN  79           HA       GLN  79  -8.576  -7.572  -4.005
  603    HB2  GLN  79           2HB      GLN  79  -7.870  -6.265  -5.883
  604    HB3  GLN  79           1HB      GLN  79  -6.407  -7.218  -6.073
  605    HG2  GLN  79           2HG      GLN  79  -7.572  -9.051  -6.934
  606    HG3  GLN  79           1HG      GLN  79  -9.122  -8.450  -6.348
  607   HE21  GLN  79          1HE2      GLN  79  -9.308  -5.967  -7.219
  608   HE22  GLN  79          2HE2      GLN  79  -9.216  -5.879  -8.942
  609    H    ARG  80           H        ARG  80  -5.240  -8.810  -4.291
  610    HA   ARG  80           HA       ARG  80  -5.922 -11.453  -4.894
  611    HE   ARG  80           HE       ARG  80  -1.686 -14.693  -4.390
  612    HB2  ARG  80           2HB      ARG  80  -3.696 -10.887  -5.290
  613    HB3  ARG  80           1HB      ARG  80  -3.516 -10.097  -3.732
  614    HG2  ARG  80           2HG      ARG  80  -2.989 -12.009  -2.668
  615    HG3  ARG  80           1HG      ARG  80  -4.044 -13.000  -3.678
  616    HD2  ARG  80           2HD      ARG  80  -2.441 -12.841  -5.513
  617    HD3  ARG  80           1HD      ARG  80  -1.392 -11.833  -4.517
  618   HH11  ARG  80          1HH1      ARG  80  -0.720 -11.827  -2.646
  619   HH12  ARG  80          2HH1      ARG  80   0.314 -12.689  -1.557
  620   HH21  ARG  80          1HH2      ARG  80  -0.326 -15.826  -2.958
  621   HH22  ARG  80          2HH2      ARG  80   0.539 -14.958  -1.734
  622    H    MET  81           H        MET  81  -5.655  -9.717  -1.849
  623    HA   MET  81           HA       MET  81  -5.934 -12.106  -0.264
  624    HB2  MET  81           2HB      MET  81  -5.994 -10.598   1.657
  625    HB3  MET  81           1HB      MET  81  -4.646 -10.239   0.596
  626    HG2  MET  81           2HG      MET  81  -5.514  -8.173   1.298
  627    HG3  MET  81           1HG      MET  81  -6.022  -8.377  -0.375
  628    HE1  MET  81           3HE      MET  81  -8.928  -6.374   1.379
  629    HE2  MET  81           1HE      MET  81  -7.377  -6.233   0.557
  630    HE3  MET  81           2HE      MET  81  -7.430  -6.460   2.304
  631    H    ALA  82           H        ALA  82  -8.088 -10.071  -1.914
  632    HA   ALA  82           HA       ALA  82 -10.352 -11.370  -0.564
  633    HB1  ALA  82           3HB      ALA  82 -10.362  -9.328   0.593
  634    HB2  ALA  82           1HB      ALA  82 -11.567  -9.123  -0.679
  635    HB3  ALA  82           2HB      ALA  82  -9.967  -8.402  -0.855
  636    H    ASN  83           H        ASN  83 -11.348 -12.441  -2.135
  637    HA   ASN  83           HA       ASN  83 -11.360 -11.352  -4.851
  638    HB2  ASN  83           2HB      ASN  83 -11.332 -14.018  -3.701
  639    HB3  ASN  83           1HB      ASN  83 -12.608 -13.851  -4.903
  640   HD21  ASN  83          1HD2      ASN  83 -11.914 -14.705  -6.720
  641   HD22  ASN  83          2HD2      ASN  83 -10.370 -14.435  -7.447
  642    H    SER  84           H        SER  84 -13.567 -12.460  -5.945
  643    HA   SER  84           HA       SER  84 -15.850 -12.409  -6.117
  644    HG   SER  84           HG       SER  84 -18.041 -11.474  -4.487
  645    HB2  SER  84           2HB      SER  84 -15.765 -12.875  -3.562
  646    HB3  SER  84           1HB      SER  84 -16.133 -11.158  -3.402
  647    H    GLU  85           H        GLU  85 -13.806  -9.818  -5.637
  648    HA   GLU  85           HA       GLU  85 -15.380  -8.083  -7.229
  649    HB2  GLU  85           2HB      GLU  85 -15.767  -6.294  -5.610
  650    HB3  GLU  85           1HB      GLU  85 -16.597  -7.766  -5.123
  651    HG2  GLU  85           2HG      GLU  85 -14.604  -8.226  -3.629
  652    HG3  GLU  85           1HG      GLU  85 -14.104  -6.568  -3.962
  653    H    SER  86           H        SER  86 -14.183  -6.355  -8.029
  654    HA   SER  86           HA       SER  86 -11.335  -6.601  -7.713
  655    HG   SER  86           HG       SER  86 -13.766  -4.271  -8.794
  656    HB2  SER  86           2HB      SER  86 -11.432  -4.513  -9.290
  657    HB3  SER  86           1HB      SER  86 -11.912  -6.091  -9.912
  658    H    LEU  87           H        LEU  87 -11.509  -6.120  -5.370
  659    HA   LEU  87           HA       LEU  87 -11.696  -4.659  -3.550
  660    HG   LEU  87           HG       LEU  87  -8.183  -4.708  -3.012
  661    HB2  LEU  87           2HB      LEU  87  -9.240  -4.543  -5.014
  662    HB3  LEU  87           1HB      LEU  87  -9.575  -2.957  -4.342
  663   HD11  LEU  87          1HD1      LEU  87 -10.251  -2.798  -2.013
  664   HD12  LEU  87          2HD1      LEU  87  -8.494  -2.634  -2.040
  665   HD13  LEU  87          3HD1      LEU  87  -9.261  -3.715  -0.877
  666   HD21  LEU  87          3HD2      LEU  87  -9.933  -6.469  -3.088
  667   HD22  LEU  87          1HD2      LEU  87 -10.952  -5.439  -2.083
  668   HD23  LEU  87          2HD2      LEU  87  -9.420  -6.044  -1.457
  669    H    GLU  88           H        GLU  88 -13.314  -3.252  -3.264
  670    HA   GLU  88           HA       GLU  88 -13.719  -1.014  -5.012
  671    HB2  GLU  88           2HB      GLU  88 -15.559  -2.074  -3.691
  672    HB3  GLU  88           1HB      GLU  88 -14.799  -1.483  -2.220
  673    HG2  GLU  88           2HG      GLU  88 -15.376   0.702  -2.635
  674    HG3  GLU  88           1HG      GLU  88 -15.506   0.450  -4.374
  675    H    ILE  89           H        ILE  89 -11.919   0.283  -5.068
  676    HA   ILE  89           HA       ILE  89 -11.184   1.534  -2.524
  677    HB   ILE  89           HB       ILE  89  -8.872   1.372  -2.881
  678   HG12  ILE  89          2HG1      ILE  89  -9.118   1.901  -5.432
  679   HG13  ILE  89          1HG1      ILE  89  -7.744   0.966  -4.874
  680   HG21  ILE  89          1HG2      ILE  89  -8.464  -1.048  -3.374
  681   HG22  ILE  89          2HG2      ILE  89 -10.183  -1.179  -3.745
  682   HG23  ILE  89          3HG2      ILE  89  -9.665  -0.715  -2.128
  683   HD11  ILE  89          3HD1      ILE  89  -8.746   0.065  -6.920
  684   HD12  ILE  89          1HD1      ILE  89 -10.252  -0.209  -6.042
  685   HD13  ILE  89          2HD1      ILE  89  -8.790  -1.080  -5.577
  686    H    ALA  90           H        ALA  90 -11.172   3.758  -2.584
  687    HA   ALA  90           HA       ALA  90 -11.378   4.970  -5.254
  688    HB1  ALA  90           3HB      ALA  90 -11.889   6.423  -2.670
  689    HB2  ALA  90           1HB      ALA  90 -13.134   5.432  -3.437
  690    HB3  ALA  90           2HB      ALA  90 -12.456   6.816  -4.293
  691    H    TRP  91           H        TRP  91  -9.489   5.558  -6.032
  692    HA   TRP  91           HA       TRP  91  -7.355   6.389  -4.236
  693    HD1  TRP  91           HD       TRP  91  -8.348   3.803  -7.708
  694    HE1  TRP  91           1HE      TRP  91  -9.054   4.510 -10.080
  695    HE3  TRP  91           3HE      TRP  91  -6.405   8.532  -7.761
  696    HZ2  TRP  91           2HZ      TRP  91  -8.818   6.772 -11.752
  697    HZ3  TRP  91           3HZ      TRP  91  -6.688   9.902  -9.784
  698    HH2  TRP  91           HH       TRP  91  -7.870   9.038 -11.739
  699    HB2  TRP  91           2HB      TRP  91  -5.951   6.353  -6.303
  700    HB3  TRP  91           1HB      TRP  91  -6.710   4.808  -5.932
  701    H    GLN  92           H        GLN  92  -6.622   8.402  -4.024
  702    HA   GLN  92           HA       GLN  92  -8.114  10.525  -5.338
  703    HB2  GLN  92           2HB      GLN  92  -6.085  10.538  -3.100
  704    HB3  GLN  92           1HB      GLN  92  -6.776  12.005  -3.780
  705    HG2  GLN  92           2HG      GLN  92  -9.036  11.104  -3.188
  706    HG3  GLN  92           1HG      GLN  92  -8.214   9.810  -2.317
  707   HE21  GLN  92          1HE2      GLN  92  -6.611  10.549  -0.673
  708   HE22  GLN  92          2HE2      GLN  92  -7.026  11.930   0.278
  709    HA   PRO  93           HA       PRO  93  -5.333  11.587  -8.578
  710    HB2  PRO  93           2HB      PRO  93  -5.423  14.306  -7.365
  711    HB3  PRO  93           1HB      PRO  93  -5.636  13.828  -9.054
  712    HG2  PRO  93           2HG      PRO  93  -7.744  14.455  -7.553
  713    HG3  PRO  93           1HG      PRO  93  -7.821  13.117  -8.715
  714    HD2  PRO  93           2HD      PRO  93  -7.647  13.042  -5.749
  715    HD3  PRO  93           1HD      PRO  93  -8.405  11.892  -6.868
  716    H    ALA  94           H        ALA  94  -4.656  12.897  -5.363
  717    HA   ALA  94           HA       ALA  94  -2.653  12.538  -4.174
  718    HB1  ALA  94           3HB      ALA  94  -0.669  11.848  -5.123
  719    HB2  ALA  94           1HB      ALA  94  -0.981  12.684  -6.643
  720    HB3  ALA  94           2HB      ALA  94  -1.828  11.182  -6.273
  721    H    GLU  95           H        GLU  95  -0.252  13.954  -4.841
  722    HA   GLU  95           HA       GLU  95   0.607  16.050  -4.604
  723    HB2  GLU  95           2HB      GLU  95  -0.085  16.159  -6.976
  724    HB3  GLU  95           1HB      GLU  95  -1.649  16.788  -6.475
  725    HG2  GLU  95           2HG      GLU  95  -0.109  18.532  -7.280
  726    HG3  GLU  95           1HG      GLU  95  -0.635  18.784  -5.616
  727    H    SER  96           H        SER  96   0.261  16.523  -2.478
  728    HA   SER  96           HA       SER  96  -2.261  17.871  -1.788
  729    HG   SER  96           HG       SER  96  -2.309  15.273   0.353
  730    HB2  SER  96           2HB      SER  96  -0.215  16.592   0.043
  731    HB3  SER  96           1HB      SER  96  -1.736  17.329   0.550
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1   6.965  13.179  -5.297
    2    HB2  MET   1           2HB      MET   1   7.551  12.981  -2.966
    3    HB3  MET   1           1HB      MET   1   8.905  13.658  -3.864
    4    HG2  MET   1           2HG      MET   1   7.200  15.736  -2.808
    5    HG3  MET   1           1HG      MET   1   7.758  14.654  -1.538
    6    HE1  MET   1           3HE      MET   1  10.235  17.556  -1.015
    7    HE2  MET   1           1HE      MET   1   9.496  16.191  -0.178
    8    HE3  MET   1           2HE      MET   1   8.482  17.353  -1.033
    9    H    PHE   2           H        PHE   2   4.894  13.449  -5.886
   10    HA   PHE   2           HA       PHE   2   3.081  15.117  -4.351
   11    HD1  PHE   2           2HD      PHE   2   3.653  16.474  -6.588
   12    HD2  PHE   2           1HD      PHE   2   2.874  12.692  -8.381
   13    HE1  PHE   2           2HE      PHE   2   4.920  17.161  -8.582
   14    HE2  PHE   2           1HE      PHE   2   4.127  13.378 -10.378
   15    HZ   PHE   2           HZ       PHE   2   5.157  15.612 -10.482
   16    HB2  PHE   2           2HB      PHE   2   2.033  13.120  -6.301
   17    HB3  PHE   2           1HB      PHE   2   1.552  14.792  -6.049
   18    H    ARG   3           H        ARG   3   0.926  13.952  -3.570
   19    HA   ARG   3           HA       ARG   3   1.499  11.245  -2.678
   20    HE   ARG   3           HE       ARG   3   4.429  12.405   1.662
   21    HB2  ARG   3           2HB      ARG   3   2.016  13.392  -0.949
   22    HB3  ARG   3           1HB      ARG   3   0.505  12.686  -0.383
   23    HG2  ARG   3           2HG      ARG   3   1.777  11.226   0.695
   24    HG3  ARG   3           1HG      ARG   3   2.061  10.487  -0.866
   25    HD2  ARG   3           2HD      ARG   3   4.209  11.031  -0.789
   26    HD3  ARG   3           1HD      ARG   3   3.820  12.725  -0.502
   27   HH11  ARG   3          1HH1      ARG   3   3.454   9.320   0.356
   28   HH12  ARG   3          2HH1      ARG   3   3.829   8.447   1.804
   29   HH21  ARG   3          1HH2      ARG   3   4.922  11.260   3.568
   30   HH22  ARG   3          2HH2      ARG   3   4.662   9.548   3.628
   31    H    SER   4           H        SER   4  -0.206  10.005  -2.817
   32    HA   SER   4           HA       SER   4  -2.908  11.167  -2.722
   33    HG   SER   4           HG       SER   4  -4.407   8.944  -4.294
   34    HB2  SER   4           2HB      SER   4  -2.920  10.338  -4.877
   35    HB3  SER   4           1HB      SER   4  -1.651   9.157  -4.536
   36    H    THR   5           H        THR   5  -4.582   9.565  -1.907
   37    HA   THR   5           HA       THR   5  -3.445   7.475  -0.241
   38    HB   THR   5           HB       THR   5  -4.446   8.211   1.816
   39    HG1  THR   5           1HG      THR   5  -5.410  10.483   0.431
   40   HG21  THR   5          3HG2      THR   5  -3.306  10.797   0.871
   41   HG22  THR   5          1HG2      THR   5  -2.261   9.383   1.003
   42   HG23  THR   5          2HG2      THR   5  -3.123   9.977   2.418
   43    H    SER   6           H        SER   6  -4.599   5.692  -0.281
   44    HA   SER   6           HA       SER   6  -7.409   5.871  -1.157
   45    HG   SER   6           HG       SER   6  -7.947   3.202  -1.294
   46    HB2  SER   6           2HB      SER   6  -5.862   4.572  -2.626
   47    HB3  SER   6           1HB      SER   6  -5.567   3.470  -1.282
   48    H    HIS   7           H        HIS   7  -9.002   5.191   0.163
   49    HA   HIS   7           HA       HIS   7  -8.231   3.810   2.659
   50    HD1  HIS   7           1HD      HIS   7 -10.088   2.999   4.368
   51    HD2  HIS   7           2HD      HIS   7  -9.656   7.032   5.267
   52    HE1  HIS   7           1HE      HIS   7 -10.180   3.142   6.875
   53    HE2  HIS   7           2HE      HIS   7  -9.995   5.600   7.392
   54    HB2  HIS   7           2HB      HIS   7  -9.206   6.252   2.668
   55    HB3  HIS   7           1HB      HIS   7 -10.741   5.430   2.439
   56    H    VAL   8           H        VAL   8  -9.141   1.865   3.053
   57    HA   VAL   8           HA       VAL   8 -11.654   1.159   1.710
   58    HB   VAL   8           HB       VAL   8  -9.451  -0.876   1.805
   59   HG11  VAL   8          1HG1      VAL   8 -11.806  -1.519   1.326
   60   HG12  VAL   8          2HG1      VAL   8 -10.675  -1.924   0.036
   61   HG13  VAL   8          3HG1      VAL   8 -11.734  -0.524  -0.129
   62   HG21  VAL   8          3HG2      VAL   8  -9.878   0.981  -0.530
   63   HG22  VAL   8          1HG2      VAL   8  -8.666  -0.290  -0.375
   64   HG23  VAL   8          2HG2      VAL   8  -8.568   1.149   0.639
   65    H    ARG   9           H        ARG   9 -12.819  -0.589   2.750
   66    HA   ARG   9           HA       ARG   9 -12.026  -0.868   5.560
   67    HE   ARG   9           HE       ARG   9 -15.321   0.854   3.659
   68    HB2  ARG   9           2HB      ARG   9 -14.662  -0.952   4.173
   69    HB3  ARG   9           1HB      ARG   9 -14.464  -1.897   5.642
   70    HG2  ARG   9           2HG      ARG   9 -15.381   0.241   6.208
   71    HG3  ARG   9           1HG      ARG   9 -13.725   0.146   6.815
   72    HD2  ARG   9           2HD      ARG   9 -14.322   2.319   5.729
   73    HD3  ARG   9           1HD      ARG   9 -12.911   1.512   5.047
   74   HH11  ARG   9          1HH1      ARG   9 -12.824   3.271   3.968
   75   HH12  ARG   9          2HH1      ARG   9 -13.036   3.875   2.359
   76   HH21  ARG   9          1HH2      ARG   9 -15.601   1.644   1.542
   77   HH22  ARG   9          2HH2      ARG   9 -14.612   2.951   0.981
   78    H    THR  10           H        THR  10 -10.751  -2.586   5.849
   79    HA   THR  10           HA       THR  10 -11.666  -5.177   4.793
   80    HB   THR  10           HB       THR  10  -9.406  -3.845   3.914
   81    HG1  THR  10           1HG      THR  10 -10.164  -6.565   3.860
   82   HG21  THR  10          3HG2      THR  10  -8.466  -4.680   6.225
   83   HG22  THR  10          1HG2      THR  10  -7.498  -4.735   4.746
   84   HG23  THR  10          2HG2      THR  10  -8.301  -6.195   5.329
   85    H    GLU  11           H        GLU  11 -10.962  -7.061   6.047
   86    HA   GLU  11           HA       GLU  11 -10.594  -6.361   8.882
   87    HB2  GLU  11           2HB      GLU  11 -12.335  -8.169   7.545
   88    HB3  GLU  11           1HB      GLU  11 -11.253  -9.115   8.559
   89    HG2  GLU  11           2HG      GLU  11 -12.307  -8.496  10.404
   90    HG3  GLU  11           1HG      GLU  11 -12.225  -6.792   9.956
   91    H    SER  12           H        SER  12  -9.018  -7.379  10.164
   92    HA   SER  12           HA       SER  12  -6.997  -8.280  10.645
   93    HG   SER  12           HG       SER  12  -5.600 -10.300  10.120
   94    HB2  SER  12           2HB      SER  12  -7.952 -10.400  10.221
   95    HB3  SER  12           1HB      SER  12  -7.907 -10.164   8.473
   96    H    ALA  13           H        ALA  13  -7.247  -6.164   8.638
   97    HA   ALA  13           HA       ALA  13  -5.546  -6.328   6.466
   98    HB1  ALA  13           3HB      ALA  13  -5.370  -3.973   6.531
   99    HB2  ALA  13           1HB      ALA  13  -5.709  -3.955   8.254
  100    HB3  ALA  13           2HB      ALA  13  -6.978  -4.386   7.122
  101    H    ALA  14           H        ALA  14  -4.618  -5.292   9.729
  102    HA   ALA  14           HA       ALA  14  -2.023  -4.614   9.399
  103    HB1  ALA  14           3HB      ALA  14  -1.620  -5.348  11.709
  104    HB2  ALA  14           1HB      ALA  14  -3.158  -6.212  11.679
  105    HB3  ALA  14           2HB      ALA  14  -3.129  -4.455  11.508
  106    H    ARG  15           H        ARG  15  -3.169  -7.916   9.109
  107    HA   ARG  15           HA       ARG  15  -0.514  -9.037   9.342
  108    HE   ARG  15           HE       ARG  15   0.464 -13.429   9.160
  109    HB2  ARG  15           2HB      ARG  15  -2.784 -10.184   9.870
  110    HB3  ARG  15           1HB      ARG  15  -2.868 -10.469   8.142
  111    HG2  ARG  15           2HG      ARG  15  -1.244 -11.779  10.197
  112    HG3  ARG  15           1HG      ARG  15  -1.879 -12.399   8.676
  113    HD2  ARG  15           2HD      ARG  15  -0.053 -11.477   7.444
  114    HD3  ARG  15           1HD      ARG  15   0.491 -10.546   8.838
  115   HH11  ARG  15          1HH1      ARG  15   2.336 -10.579   8.393
  116   HH12  ARG  15          2HH1      ARG  15   3.852 -11.328   8.762
  117   HH21  ARG  15          1HH2      ARG  15   2.459 -14.409   9.641
  118   HH22  ARG  15          2HH2      ARG  15   3.924 -13.500   9.468
  119    H    TYR  16           H        TYR  16  -2.721  -8.225   6.707
  120    HA   TYR  16           HA       TYR  16  -1.094  -9.380   4.684
  121    HD1  TYR  16           2HD      TYR  16  -2.728 -10.761   4.922
  122    HD2  TYR  16           1HD      TYR  16  -5.327  -7.655   3.590
  123    HE1  TYR  16           2HE      TYR  16  -4.635 -12.274   5.119
  124    HE2  TYR  16           1HE      TYR  16  -7.241  -9.175   3.795
  125    HH   TYR  16           HH       TYR  16  -7.601 -11.696   3.749
  126    HB2  TYR  16           2HB      TYR  16  -3.084  -7.118   4.397
  127    HB3  TYR  16           1HB      TYR  16  -2.413  -8.074   3.086
  128    H    VAL  17           H        VAL  17  -0.879  -6.436   6.489
  129    HA   VAL  17           HA       VAL  17   0.894  -5.144   4.613
  130    HB   VAL  17           HB       VAL  17  -0.068  -4.446   7.363
  131   HG11  VAL  17          1HG1      VAL  17   2.579  -3.766   6.337
  132   HG12  VAL  17          2HG1      VAL  17   1.899  -3.524   7.949
  133   HG13  VAL  17          3HG1      VAL  17   1.591  -2.353   6.676
  134   HG21  VAL  17          3HG2      VAL  17  -1.288  -3.769   5.332
  135   HG22  VAL  17          1HG2      VAL  17   0.134  -2.853   4.832
  136   HG23  VAL  17          2HG2      VAL  17  -0.725  -2.405   6.305
  137    H    ASN  18           H        ASN  18   1.219  -6.831   7.729
  138    HA   ASN  18           HA       ASN  18   4.041  -6.592   7.818
  139    HB2  ASN  18           2HB      ASN  18   2.417  -8.746   9.170
  140    HB3  ASN  18           1HB      ASN  18   3.966  -8.084   9.679
  141   HD21  ASN  18          1HD2      ASN  18   3.296  -5.343   9.209
  142   HD22  ASN  18          2HD2      ASN  18   2.167  -4.879  10.431
  143    H    ARG  19           H        ARG  19   1.892  -8.855   6.252
  144    HA   ARG  19           HA       ARG  19   3.875 -10.877   5.865
  145    HE   ARG  19           HE       ARG  19   1.366 -15.424   5.631
  146    HB2  ARG  19           2HB      ARG  19   1.192 -10.901   5.790
  147    HB3  ARG  19           1HB      ARG  19   1.521 -10.750   4.070
  148    HG2  ARG  19           2HG      ARG  19   1.936 -12.909   3.946
  149    HG3  ARG  19           1HG      ARG  19   3.235 -12.742   5.124
  150    HD2  ARG  19           2HD      ARG  19   1.988 -13.557   6.806
  151    HD3  ARG  19           1HD      ARG  19   0.526 -12.744   6.248
  152   HH11  ARG  19          1HH1      ARG  19  -0.596 -12.725   4.608
  153   HH12  ARG  19          2HH1      ARG  19  -1.678 -13.704   3.676
  154   HH21  ARG  19          1HH2      ARG  19  -0.058 -16.713   4.406
  155   HH22  ARG  19          2HH2      ARG  19  -1.374 -15.967   3.562
  156    H    LEU  20           H        LEU  20   3.138  -7.935   4.261
  157    HA   LEU  20           HA       LEU  20   4.020  -8.670   1.656
  158    HG   LEU  20           HG       LEU  20   1.621  -6.723   2.854
  159    HB2  LEU  20           2HB      LEU  20   3.836  -5.953   2.942
  160    HB3  LEU  20           1HB      LEU  20   4.102  -6.239   1.235
  161   HD11  LEU  20          1HD1      LEU  20   1.867  -5.364   0.194
  162   HD12  LEU  20          2HD1      LEU  20   2.231  -4.507   1.692
  163   HD13  LEU  20          3HD1      LEU  20   0.617  -5.173   1.426
  164   HD21  LEU  20          3HD2      LEU  20   2.306  -7.874   0.146
  165   HD22  LEU  20          1HD2      LEU  20   0.651  -7.681   0.722
  166   HD23  LEU  20          2HD2      LEU  20   1.766  -8.734   1.588
  167    H    CYS  21           H        CYS  21   5.620  -6.979   4.356
  168    HA   CYS  21           HA       CYS  21   8.013  -6.416   3.051
  169    HG   CYS  21           HG       CYS  21   7.298  -4.260   5.192
  170    HB2  CYS  21           2HB      CYS  21   7.854  -7.189   5.970
  171    HB3  CYS  21           1HB      CYS  21   9.004  -6.106   5.202
  172    H    LYS  22           H        LYS  22   6.839  -9.379   4.460
  173    HA   LYS  22           HA       LYS  22   9.373 -10.741   4.136
  174    HB2  LYS  22           2HB      LYS  22   6.662 -11.870   4.829
  175    HB3  LYS  22           1HB      LYS  22   8.208 -12.693   4.991
  176    HG2  LYS  22           2HG      LYS  22   8.592 -11.778   6.983
  177    HG3  LYS  22           1HG      LYS  22   8.175 -10.162   6.412
  178    HD2  LYS  22           2HD      LYS  22   6.622 -10.693   8.124
  179    HD3  LYS  22           1HD      LYS  22   5.753 -10.851   6.594
  180    HE2  LYS  22           2HE      LYS  22   5.132 -12.739   7.826
  181    HE3  LYS  22           1HE      LYS  22   6.357 -13.322   6.701
  182    HZ1  LYS  22           3HZ      LYS  22   6.451 -13.101   9.596
  183    HZ2  LYS  22           1HZ      LYS  22   7.873 -12.678   8.784
  184    HZ3  LYS  22           2HZ      LYS  22   7.203 -14.215   8.570
  185    H    HIS  23           H        HIS  23   6.552 -10.109   2.283
  186    HA   HIS  23           HA       HIS  23   6.856 -12.362   0.514
  187    HD1  HIS  23           1HD      HIS  23   3.032 -12.783   0.334
  188    HD2  HIS  23           2HD      HIS  23   5.781 -11.666  -2.575
  189    HE1  HIS  23           1HE      HIS  23   2.408 -14.095  -1.719
  190    HE2  HIS  23           2HE      HIS  23   4.140 -13.469  -3.438
  191    HB2  HIS  23           2HB      HIS  23   4.660 -11.156   1.201
  192    HB3  HIS  23           1HB      HIS  23   5.100  -9.997  -0.049
  193    H    TRP  24           H        TRP  24   6.906  -8.798  -0.028
  194    HA   TRP  24           HA       TRP  24   8.314  -9.265  -2.532
  195    HD1  TRP  24           HD       TRP  24   4.735  -7.111  -1.211
  196    HE1  TRP  24           1HE      TRP  24   2.983  -7.837  -2.951
  197    HE3  TRP  24           3HE      TRP  24   7.874  -8.446  -5.020
  198    HZ2  TRP  24           2HZ      TRP  24   2.936  -8.842  -5.588
  199    HZ3  TRP  24           3HZ      TRP  24   6.894  -9.281  -7.117
  200    HH2  TRP  24           HH       TRP  24   4.476  -9.474  -7.393
  201    HB2  TRP  24           2HB      TRP  24   7.283  -6.738  -1.238
  202    HB3  TRP  24           1HB      TRP  24   8.077  -6.800  -2.809
  203    H    GLY  25           H        GLY  25   9.205  -8.718   0.712
  204    HA2  GLY  25           2HA      GLY  25  11.486  -7.070   0.296
  205    HA3  GLY  25           1HA      GLY  25  11.178  -8.072   1.700
  206    H    HIS  26           H        HIS  26  11.993  -8.524  -1.741
  207    HA   HIS  26           HA       HIS  26  13.847 -10.651  -0.906
  208    HD1  HIS  26           1HD      HIS  26  12.171 -13.553  -2.499
  209    HD2  HIS  26           2HD      HIS  26  15.600 -11.602  -3.806
  210    HE1  HIS  26           1HE      HIS  26  13.803 -15.376  -3.079
  211    HE2  HIS  26           2HE      HIS  26  15.899 -14.170  -3.786
  212    HB2  HIS  26           2HB      HIS  26  11.872 -11.107  -2.535
  213    HB3  HIS  26           1HB      HIS  26  12.877 -10.288  -3.726
  214    H    LYS  27           H        LYS  27  13.504  -7.663  -2.687
  215    HA   LYS  27           HA       LYS  27  16.405  -7.387  -2.744
  216    HB2  LYS  27           2HB      LYS  27  16.059  -8.470  -4.853
  217    HB3  LYS  27           1HB      LYS  27  14.681  -7.450  -5.226
  218    HG2  LYS  27           2HG      LYS  27  17.161  -5.960  -4.805
  219    HG3  LYS  27           1HG      LYS  27  17.222  -7.096  -6.151
  220    HD2  LYS  27           2HD      LYS  27  15.834  -5.868  -7.404
  221    HD3  LYS  27           1HD      LYS  27  14.731  -5.593  -6.058
  222    HE2  LYS  27           2HE      LYS  27  15.407  -3.463  -6.248
  223    HE3  LYS  27           1HE      LYS  27  16.810  -4.012  -5.338
  224    HZ1  LYS  27           3HZ      LYS  27  17.565  -4.604  -7.821
  225    HZ2  LYS  27           1HZ      LYS  27  17.908  -3.126  -7.071
  226    HZ3  LYS  27           2HZ      LYS  27  16.596  -3.252  -8.130
  227    H    PHE  28           H        PHE  28  13.934  -6.140  -1.507
  228    HA   PHE  28           HA       PHE  28  14.648  -3.390  -2.173
  229    HD1  PHE  28           2HD      PHE  28  12.999  -1.391  -3.661
  230    HD2  PHE  28           1HD      PHE  28  12.283  -5.528  -4.365
  231    HE1  PHE  28           2HE      PHE  28  13.154  -1.005  -6.089
  232    HE2  PHE  28           1HE      PHE  28  12.439  -5.150  -6.790
  233    HZ   PHE  28           HZ       PHE  28  12.877  -2.888  -7.654
  234    HB2  PHE  28           2HB      PHE  28  11.878  -4.555  -2.205
  235    HB3  PHE  28           1HB      PHE  28  12.145  -2.837  -1.913
  236    H    GLU  29           H        GLU  29  13.959  -1.842  -0.540
  237    HA   GLU  29           HA       GLU  29  14.437  -2.947   2.093
  238    HB2  GLU  29           2HB      GLU  29  14.300  -0.492   2.767
  239    HB3  GLU  29           1HB      GLU  29  15.602  -0.946   1.675
  240    HG2  GLU  29           2HG      GLU  29  13.165  -0.127   0.307
  241    HG3  GLU  29           1HG      GLU  29  13.872   1.127   1.324
  242    H    VAL  30           H        VAL  30  12.741  -3.924   3.016
  243    HA   VAL  30           HA       VAL  30  10.174  -2.486   3.022
  244    HB   VAL  30           HB       VAL  30   9.405  -4.973   3.715
  245   HG11  VAL  30          1HG1      VAL  30   8.972  -5.304   1.189
  246   HG12  VAL  30          2HG1      VAL  30   9.640  -3.682   1.034
  247   HG13  VAL  30          3HG1      VAL  30   8.208  -3.957   2.031
  248   HG21  VAL  30          3HG2      VAL  30  11.798  -5.746   3.380
  249   HG22  VAL  30          1HG2      VAL  30  11.514  -5.522   1.651
  250   HG23  VAL  30          2HG2      VAL  30  10.536  -6.671   2.567
  251    H    GLU  31           H        GLU  31   9.754  -1.560   4.915
  252    HA   GLU  31           HA       GLU  31  10.894  -2.682   7.360
  253    HB2  GLU  31           2HB      GLU  31  10.108  -0.031   6.456
  254    HB3  GLU  31           1HB      GLU  31   9.427  -0.405   8.033
  255    HG2  GLU  31           2HG      GLU  31  11.461  -0.474   9.054
  256    HG3  GLU  31           1HG      GLU  31  12.304  -0.977   7.588
  257    H    LEU  32           H        LEU  32   9.663  -3.462   9.036
  258    HA   LEU  32           HA       LEU  32   6.763  -3.681   8.519
  259    HG   LEU  32           HG       LEU  32   5.867  -6.343   8.417
  260    HB2  LEU  32           2HB      LEU  32   8.128  -5.802   8.206
  261    HB3  LEU  32           1HB      LEU  32   8.392  -5.792   9.939
  262   HD11  LEU  32          1HD1      LEU  32   6.503  -7.827  10.844
  263   HD12  LEU  32          2HD1      LEU  32   7.754  -7.930   9.607
  264   HD13  LEU  32          3HD1      LEU  32   6.099  -8.407   9.230
  265   HD21  LEU  32          3HD2      LEU  32   4.695  -6.298  10.656
  266   HD22  LEU  32          1HD2      LEU  32   5.072  -4.721   9.965
  267   HD23  LEU  32          2HD2      LEU  32   6.065  -5.376  11.266
  268    H    THR  33           H        THR  33   5.775  -2.389   9.881
  269    HA   THR  33           HA       THR  33   6.507  -2.553  12.752
  270    HB   THR  33           HB       THR  33   5.394  -0.114  12.647
  271    HG1  THR  33           1HG      THR  33   5.091  -0.019  10.448
  272   HG21  THR  33          3HG2      THR  33   7.811   0.757  12.102
  273   HG22  THR  33          1HG2      THR  33   8.219  -0.948  12.293
  274   HG23  THR  33          2HG2      THR  33   7.451  -0.072  13.617
  275    HA   PRO  34           HA       PRO  34   2.222  -3.450  13.280
  276    HB2  PRO  34           2HB      PRO  34   1.607  -2.366  15.658
  277    HB3  PRO  34           1HB      PRO  34   2.720  -3.725  15.497
  278    HG2  PRO  34           2HG      PRO  34   3.321  -0.834  15.921
  279    HG3  PRO  34           1HG      PRO  34   4.105  -2.258  16.626
  280    HD2  PRO  34           2HD      PRO  34   5.091  -0.818  14.483
  281    HD3  PRO  34           1HD      PRO  34   5.510  -2.505  14.844
  282    H    GLU  35           H        GLU  35   2.522  -1.347  11.542
  283    HA   GLU  35           HA       GLU  35   0.046   0.070  11.944
  284    HB2  GLU  35           2HB      GLU  35   2.664   1.567  11.689
  285    HB3  GLU  35           1HB      GLU  35   1.075   2.304  11.537
  286    HG2  GLU  35           2HG      GLU  35   2.041   0.866  13.996
  287    HG3  GLU  35           1HG      GLU  35   2.172   2.604  13.746
  288    H    ARG  36           H        ARG  36   2.913  -0.422   9.866
  289    HA   ARG  36           HA       ARG  36   1.299  -0.888   7.604
  290    HE   ARG  36           HE       ARG  36   2.260   2.892  10.035
  291    HB2  ARG  36           2HB      ARG  36   1.973   1.052   6.249
  292    HB3  ARG  36           1HB      ARG  36   1.015   1.530   7.642
  293    HG2  ARG  36           2HG      ARG  36   3.530   1.707   8.647
  294    HG3  ARG  36           1HG      ARG  36   3.792   2.151   6.959
  295    HD2  ARG  36           2HD      ARG  36   3.232   4.204   7.702
  296    HD3  ARG  36           1HD      ARG  36   1.592   3.599   7.479
  297   HH11  ARG  36          1HH1      ARG  36   2.117   5.887   8.252
  298   HH12  ARG  36          2HH1      ARG  36   1.746   6.845   9.645
  299   HH21  ARG  36          1HH2      ARG  36   1.771   4.149  11.870
  300   HH22  ARG  36          2HH2      ARG  36   1.549   5.859  11.700
  301    H    GLY  37           H        GLY  37   2.582  -0.980   5.566
  302    HA2  GLY  37           2HA      GLY  37   5.248  -2.099   6.154
  303    HA3  GLY  37           1HA      GLY  37   4.234  -2.558   4.793
  304    H    PHE  38           H        PHE  38   6.936  -0.751   5.556
  305    HA   PHE  38           HA       PHE  38   6.440   1.293   3.510
  306    HD1  PHE  38           2HD      PHE  38   7.084   3.835   3.756
  307    HD2  PHE  38           1HD      PHE  38  10.665   1.739   4.748
  308    HE1  PHE  38           2HE      PHE  38   8.426   5.645   2.782
  309    HE2  PHE  38           1HE      PHE  38  11.999   3.543   3.756
  310    HZ   PHE  38           HZ       PHE  38  10.881   5.500   2.765
  311    HB2  PHE  38           2HB      PHE  38   7.289   2.044   5.673
  312    HB3  PHE  38           1HB      PHE  38   8.651   0.947   5.548
  313    H    ILE  39           H        ILE  39   7.204   1.048   1.523
  314    HA   ILE  39           HA       ILE  39   9.616  -0.604   1.112
  315    HB   ILE  39           HB       ILE  39   7.404  -0.803  -0.895
  316   HG12  ILE  39          2HG1      ILE  39   7.554  -2.290   1.724
  317   HG13  ILE  39          1HG1      ILE  39   6.161  -1.519   0.979
  318   HG21  ILE  39          1HG2      ILE  39   8.822  -3.221  -0.556
  319   HG22  ILE  39          2HG2      ILE  39  10.005  -1.916  -0.523
  320   HG23  ILE  39          3HG2      ILE  39   8.912  -2.079  -1.895
  321   HD11  ILE  39          3HD1      ILE  39   7.483  -3.988  -0.114
  322   HD12  ILE  39          1HD1      ILE  39   5.952  -3.271  -0.619
  323   HD13  ILE  39          2HD1      ILE  39   6.100  -3.999   0.980
  324    H    ASP  40           H        ASP  40  10.992   1.015   0.445
  325    HA   ASP  40           HA       ASP  40   9.973   2.897  -1.555
  326    HB2  ASP  40           2HB      ASP  40  12.238   4.071  -1.015
  327    HB3  ASP  40           1HB      ASP  40  10.894   4.205   0.112
  328    H    PHE  41           H        PHE  41  10.443   2.611  -3.560
  329    HA   PHE  41           HA       PHE  41  12.331   0.631  -4.446
  330    HD1  PHE  41           2HD      PHE  41  12.873   2.355  -7.667
  331    HD2  PHE  41           1HD      PHE  41  10.219  -0.796  -6.608
  332    HE1  PHE  41           2HE      PHE  41  13.634   1.064  -9.619
  333    HE2  PHE  41           1HE      PHE  41  10.970  -2.092  -8.559
  334    HZ   PHE  41           HZ       PHE  41  12.680  -1.162 -10.068
  335    HB2  PHE  41           2HB      PHE  41  10.076   1.268  -5.512
  336    HB3  PHE  41           1HB      PHE  41  10.898   2.683  -6.144
  337    H    GLY  42           H        GLY  42  12.521   3.828  -3.541
  338    HA2  GLY  42           2HA      GLY  42  14.849   4.686  -3.454
  339    HA3  GLY  42           1HA      GLY  42  14.943   4.294  -5.164
  340    H    ASP  43           H        ASP  43  13.402   5.442  -6.603
  341    HA   ASP  43           HA       ASP  43  13.181   8.241  -5.776
  342    HB2  ASP  43           2HB      ASP  43  12.683   7.094  -8.529
  343    HB3  ASP  43           1HB      ASP  43  12.990   8.775  -8.105
  344    H    SER  44           H        SER  44  11.415   6.828  -4.433
  345    HA   SER  44           HA       SER  44   8.977   7.975  -4.748
  346    HG   SER  44           HG       SER  44   7.077   5.140  -5.614
  347    HB2  SER  44           2HB      SER  44   7.839   6.933  -6.387
  348    HB3  SER  44           1HB      SER  44   9.314   6.090  -6.818
  349    H    ASN  45           H        ASN  45   7.151   6.105  -3.821
  350    HA   ASN  45           HA       ASN  45   8.363   4.381  -1.868
  351    HB2  ASN  45           2HB      ASN  45   6.918   6.870  -0.925
  352    HB3  ASN  45           1HB      ASN  45   7.411   5.541   0.115
  353   HD21  ASN  45          1HD2      ASN  45   9.450   5.467   0.860
  354   HD22  ASN  45          2HD2      ASN  45  10.668   6.635   0.492
  355    H    CYS  46           H        CYS  46   6.691   3.214  -0.565
  356    HA   CYS  46           HA       CYS  46   3.944   3.561  -1.382
  357    HG   CYS  46           HG       CYS  46   3.180   0.086  -2.867
  358    HB2  CYS  46           2HB      CYS  46   4.777   2.150  -3.180
  359    HB3  CYS  46           1HB      CYS  46   5.453   1.019  -2.016
  360    H    GLU  47           H        GLU  47   3.234   3.783   0.653
  361    HA   GLU  47           HA       GLU  47   4.029   1.795   2.655
  362    HB2  GLU  47           2HB      GLU  47   4.142   4.449   2.867
  363    HB3  GLU  47           1HB      GLU  47   2.468   4.244   3.359
  364    HG2  GLU  47           2HG      GLU  47   3.036   3.193   5.321
  365    HG3  GLU  47           1HG      GLU  47   4.581   2.610   4.696
  366    H    LEU  48           H        LEU  48   2.386   0.860   4.014
  367    HA   LEU  48           HA       LEU  48  -0.351   1.066   2.982
  368    HG   LEU  48           HG       LEU  48  -1.142  -2.129   3.801
  369    HB2  LEU  48           2HB      LEU  48   0.690  -0.831   1.807
  370    HB3  LEU  48           1HB      LEU  48   1.093  -1.572   3.343
  371   HD11  LEU  48          1HD1      LEU  48  -1.829  -0.067   1.747
  372   HD12  LEU  48          2HD1      LEU  48  -2.424  -0.248   3.399
  373   HD13  LEU  48          3HD1      LEU  48  -2.967  -1.356   2.141
  374   HD21  LEU  48          3HD2      LEU  48  -0.390  -3.689   2.259
  375   HD22  LEU  48          1HD2      LEU  48  -0.427  -2.538   0.925
  376   HD23  LEU  48          2HD2      LEU  48  -1.935  -3.165   1.588
  377    H    LEU  49           H        LEU  49  -1.451   1.749   4.677
  378    HA   LEU  49           HA       LEU  49  -0.733   0.886   7.376
  379    HG   LEU  49           HG       LEU  49  -2.064   1.762   9.149
  380    HB2  LEU  49           2HB      LEU  49  -1.534   3.264   6.709
  381    HB3  LEU  49           1HB      LEU  49  -3.138   2.551   6.709
  382   HD11  LEU  49          1HD1      LEU  49  -1.550   4.215   9.979
  383   HD12  LEU  49          2HD1      LEU  49  -0.997   4.405   8.315
  384   HD13  LEU  49          3HD1      LEU  49  -0.282   3.165   9.347
  385   HD21  LEU  49          3HD2      LEU  49  -3.704   3.282  10.093
  386   HD22  LEU  49          1HD2      LEU  49  -4.372   2.466   8.679
  387   HD23  LEU  49          2HD2      LEU  49  -3.827   4.139   8.556
  388    H    ALA  50           H        ALA  50  -1.742  -0.695   8.486
  389    HA   ALA  50           HA       ALA  50  -4.326  -1.627   7.487
  390    HB1  ALA  50           3HB      ALA  50  -1.920  -3.393   7.796
  391    HB2  ALA  50           1HB      ALA  50  -2.712  -2.928   6.291
  392    HB3  ALA  50           2HB      ALA  50  -3.557  -3.938   7.449
  393    H    HIS  51           H        HIS  51  -5.659  -1.612   9.102
  394    HA   HIS  51           HA       HIS  51  -4.747  -2.481  11.729
  395    HD1  HIS  51           1HD      HIS  51  -7.703   0.109  13.822
  396    HD2  HIS  51           2HD      HIS  51  -3.794  -1.244  13.393
  397    HE1  HIS  51           1HE      HIS  51  -6.646   0.369  16.088
  398    HE2  HIS  51           2HE      HIS  51  -4.310  -0.533  15.824
  399    HB2  HIS  51           2HB      HIS  51  -5.896  -0.064  11.093
  400    HB3  HIS  51           1HB      HIS  51  -7.296  -0.998  11.595
  401    HA   PRO  52           HA       PRO  52  -7.347  -6.006  11.944
  402    HB2  PRO  52           2HB      PRO  52  -9.064  -4.550  13.915
  403    HB3  PRO  52           1HB      PRO  52  -8.389  -6.184  13.995
  404    HG2  PRO  52           2HG      PRO  52  -7.250  -4.217  15.348
  405    HG3  PRO  52           1HG      PRO  52  -6.252  -5.417  14.510
  406    HD2  PRO  52           2HD      PRO  52  -6.849  -2.594  13.758
  407    HD3  PRO  52           1HD      PRO  52  -5.367  -3.533  13.507
  408    H    ASP  53           H        ASP  53  -8.944  -2.941  11.282
  409    HA   ASP  53           HA       ASP  53 -10.887  -4.446   9.713
  410    HB2  ASP  53           2HB      ASP  53 -11.741  -3.722  12.078
  411    HB3  ASP  53           1HB      ASP  53 -11.911  -2.141  11.321
  412    H    HIS  54           H        HIS  54  -8.633  -2.056   9.605
  413    HA   HIS  54           HA       HIS  54  -9.907  -1.049   7.207
  414    HD1  HIS  54           1HD      HIS  54  -7.219   2.063   8.792
  415    HD2  HIS  54           2HD      HIS  54  -9.866   0.319  11.476
  416    HE1  HIS  54           1HE      HIS  54  -6.299   2.580  11.072
  417    HE2  HIS  54           2HE      HIS  54  -8.004   1.652  12.677
  418    HB2  HIS  54           2HB      HIS  54  -9.431   1.321   7.730
  419    HB3  HIS  54           1HB      HIS  54 -10.640   0.601   8.777
  420    H    VAL  55           H        VAL  55  -8.439   0.087   5.721
  421    HA   VAL  55           HA       VAL  55  -5.607  -0.280   6.307
  422    HB   VAL  55           HB       VAL  55  -6.763  -2.243   4.984
  423   HG11  VAL  55          1HG1      VAL  55  -7.037  -2.044   2.722
  424   HG12  VAL  55          2HG1      VAL  55  -5.916  -0.688   2.595
  425   HG13  VAL  55          3HG1      VAL  55  -7.534  -0.437   3.249
  426   HG21  VAL  55          3HG2      VAL  55  -4.133  -1.102   4.073
  427   HG22  VAL  55          1HG2      VAL  55  -4.655  -2.784   3.959
  428   HG23  VAL  55          2HG2      VAL  55  -4.375  -2.054   5.539
  429    H    LEU  56           H        LEU  56  -4.307   1.226   5.402
  430    HA   LEU  56           HA       LEU  56  -5.559   3.207   3.613
  431    HG   LEU  56           HG       LEU  56  -6.314   4.815   5.534
  432    HB2  LEU  56           2HB      LEU  56  -4.297   3.564   6.181
  433    HB3  LEU  56           1HB      LEU  56  -3.371   4.411   4.966
  434   HD11  LEU  56          1HD1      LEU  56  -4.562   5.555   7.267
  435   HD12  LEU  56          2HD1      LEU  56  -5.773   6.721   6.734
  436   HD13  LEU  56          3HD1      LEU  56  -4.137   6.793   6.083
  437   HD21  LEU  56          3HD2      LEU  56  -5.692   6.985   4.183
  438   HD22  LEU  56          1HD2      LEU  56  -6.151   5.505   3.343
  439   HD23  LEU  56          2HD2      LEU  56  -4.449   5.945   3.493
  440    H    MET  57           H        MET  57  -4.295   4.048   1.948
  441    HA   MET  57           HA       MET  57  -1.704   2.730   1.531
  442    HB2  MET  57           2HB      MET  57  -3.588   3.281  -0.736
  443    HB3  MET  57           1HB      MET  57  -2.215   2.181  -0.689
  444    HG2  MET  57           2HG      MET  57  -3.420   0.720   0.853
  445    HG3  MET  57           1HG      MET  57  -4.793   1.828   0.823
  446    HE1  MET  57           3HE      MET  57  -6.765   1.604  -0.932
  447    HE2  MET  57           1HE      MET  57  -6.539   0.259   0.185
  448    HE3  MET  57           2HE      MET  57  -6.902  -0.056  -1.512
  449    H    ILE  58           H        ILE  58  -0.148   4.261   1.524
  450    HA   ILE  58           HA       ILE  58  -0.736   6.793   0.149
  451    HB   ILE  58           HB       ILE  58   1.074   6.463   2.546
  452   HG12  ILE  58          2HG1      ILE  58  -1.783   6.716   2.433
  453   HG13  ILE  58          1HG1      ILE  58  -0.749   6.589   3.842
  454   HG21  ILE  58          1HG2      ILE  58   1.161   8.893   2.543
  455   HG22  ILE  58          2HG2      ILE  58   0.112   8.938   1.124
  456   HG23  ILE  58          3HG2      ILE  58   1.729   8.238   1.008
  457   HD11  ILE  58          3HD1      ILE  58  -0.667   8.871   4.154
  458   HD12  ILE  58          1HD1      ILE  58  -2.317   8.625   3.583
  459   HD13  ILE  58          2HD1      ILE  58  -1.080   9.225   2.477
  460    H    LEU  59           H        LEU  59   0.783   7.518  -1.272
  461    HA   LEU  59           HA       LEU  59   3.279   5.964  -1.467
  462    HG   LEU  59           HG       LEU  59   1.447   6.883  -5.217
  463    HB2  LEU  59           2HB      LEU  59   3.148   5.851  -3.787
  464    HB3  LEU  59           1HB      LEU  59   1.519   5.499  -3.255
  465   HD11  LEU  59          1HD1      LEU  59  -0.287   7.224  -3.569
  466   HD12  LEU  59          2HD1      LEU  59   0.106   8.738  -4.386
  467   HD13  LEU  59          3HD1      LEU  59   0.706   8.435  -2.757
  468   HD21  LEU  59          3HD2      LEU  59   2.702   8.687  -5.635
  469   HD22  LEU  59          1HD2      LEU  59   3.744   8.042  -4.372
  470   HD23  LEU  59          2HD2      LEU  59   2.566   9.297  -3.993
  471    H    ASN  60           H        ASN  60   5.139   7.062  -2.025
  472    HA   ASN  60           HA       ASN  60   4.907   9.999  -2.196
  473    HB2  ASN  60           2HB      ASN  60   6.139   8.656  -0.121
  474    HB3  ASN  60           1HB      ASN  60   7.483   8.972  -1.212
  475   HD21  ASN  60          1HD2      ASN  60   6.501  11.410  -2.274
  476   HD22  ASN  60          2HD2      ASN  60   6.607  12.601  -1.027
  477    H    SER  61           H        SER  61   5.137  10.304  -4.342
  478    HA   SER  61           HA       SER  61   7.625   9.244  -5.550
  479    HG   SER  61           HG       SER  61   5.255   6.862  -6.310
  480    HB2  SER  61           2HB      SER  61   5.222   9.243  -7.284
  481    HB3  SER  61           1HB      SER  61   6.604   8.154  -7.278
  482    HA   PRO  62           HA       PRO  62   8.066  13.398  -7.067
  483    HB2  PRO  62           2HB      PRO  62   9.990  12.896  -8.895
  484    HB3  PRO  62           1HB      PRO  62  10.278  12.941  -7.154
  485    HG2  PRO  62           2HG      PRO  62   9.816  10.553  -8.909
  486    HG3  PRO  62           1HG      PRO  62  11.082  10.811  -7.690
  487    HD2  PRO  62           2HD      PRO  62   8.897   9.392  -7.132
  488    HD3  PRO  62           1HD      PRO  62   9.616  10.471  -5.925
  489    H    ASP  63           H        ASP  63   6.806  10.790  -8.913
  490    HA   ASP  63           HA       ASP  63   5.764  12.735 -10.806
  491    HB2  ASP  63           2HB      ASP  63   7.591  10.486 -11.570
  492    HB3  ASP  63           1HB      ASP  63   6.349  11.026 -12.696
  493    H    GLU  64           H        GLU  64   3.843  12.009 -11.913
  494    HA   GLU  64           HA       GLU  64   2.192  10.378 -10.287
  495    HB2  GLU  64           2HB      GLU  64   1.820  11.559 -13.011
  496    HB3  GLU  64           1HB      GLU  64   0.762  10.245 -12.527
  497    HG2  GLU  64           2HG      GLU  64  -0.458  11.980 -11.751
  498    HG3  GLU  64           1HG      GLU  64   0.540  11.676 -10.325
  499    H    ASP  65           H        ASP  65   3.933   9.494 -13.297
  500    HA   ASP  65           HA       ASP  65   2.918   6.977 -13.734
  501    HB2  ASP  65           2HB      ASP  65   4.770   8.147 -15.014
  502    HB3  ASP  65           1HB      ASP  65   5.874   7.591 -13.758
  503    H    SER  66           H        SER  66   5.623   7.821 -11.618
  504    HA   SER  66           HA       SER  66   5.915   5.318 -10.363
  505    HG   SER  66           HG       SER  66   8.248   5.971 -10.337
  506    HB2  SER  66           2HB      SER  66   6.607   8.121  -9.473
  507    HB3  SER  66           1HB      SER  66   7.039   6.684  -8.545
  508    H    LEU  67           H        LEU  67   4.440   8.301  -9.269
  509    HA   LEU  67           HA       LEU  67   3.272   7.715  -6.924
  510    HG   LEU  67           HG       LEU  67   1.132   9.545  -6.508
  511    HB2  LEU  67           2HB      LEU  67   3.154   9.893  -7.841
  512    HB3  LEU  67           1HB      LEU  67   2.313   9.337  -9.257
  513   HD11  LEU  67          1HD1      LEU  67   0.976  11.693  -6.976
  514   HD12  LEU  67          2HD1      LEU  67  -0.215  11.238  -8.193
  515   HD13  LEU  67          3HD1      LEU  67   1.476  11.441  -8.647
  516   HD21  LEU  67          3HD2      LEU  67   0.044   8.551  -9.096
  517   HD22  LEU  67          1HD2      LEU  67  -1.019   9.362  -7.949
  518   HD23  LEU  67          2HD2      LEU  67  -0.166   7.898  -7.471
  519    H    ALA  68           H        ALA  68   1.515   7.264 -10.012
  520    HA   ALA  68           HA       ALA  68  -0.619   5.860  -8.789
  521    HB1  ALA  68           3HB      ALA  68  -1.225   6.739 -10.831
  522    HB2  ALA  68           1HB      ALA  68  -0.936   5.056 -11.272
  523    HB3  ALA  68           2HB      ALA  68   0.291   6.279 -11.607
  524    H    HIS  69           H        HIS  69   2.418   4.842 -10.258
  525    HA   HIS  69           HA       HIS  69   1.983   2.115 -10.501
  526    HD1  HIS  69           1HD      HIS  69   3.128   0.222  -9.762
  527    HD2  HIS  69           2HD      HIS  69   6.476   1.846 -11.612
  528    HE1  HIS  69           1HE      HIS  69   4.527  -1.744 -10.465
  529    HE2  HIS  69           2HE      HIS  69   6.505  -0.741 -11.660
  530    HB2  HIS  69           2HB      HIS  69   4.047   3.431 -11.196
  531    HB3  HIS  69           1HB      HIS  69   4.577   3.311  -9.522
  532    H    MET  70           H        MET  70   2.866   4.032  -7.684
  533    HA   MET  70           HA       MET  70   3.131   1.761  -5.943
  534    HB2  MET  70           2HB      MET  70   2.690   4.561  -4.980
  535    HB3  MET  70           1HB      MET  70   3.667   3.300  -4.254
  536    HG2  MET  70           2HG      MET  70   4.299   5.015  -6.621
  537    HG3  MET  70           1HG      MET  70   5.174   4.871  -5.103
  538    HE1  MET  70           3HE      MET  70   7.605   4.044  -7.572
  539    HE2  MET  70           1HE      MET  70   6.175   5.051  -7.802
  540    HE3  MET  70           2HE      MET  70   6.401   3.602  -8.783
  541    H    GLN  71           H        GLN  71   0.743   4.451  -6.027
  542    HA   GLN  71           HA       GLN  71  -0.969   3.371  -4.133
  543    HB2  GLN  71           2HB      GLN  71  -2.792   4.722  -5.466
  544    HB3  GLN  71           1HB      GLN  71  -1.581   5.534  -4.493
  545    HG2  GLN  71           2HG      GLN  71  -0.777   6.599  -6.264
  546    HG3  GLN  71           1HG      GLN  71  -0.724   5.125  -7.232
  547   HE21  GLN  71          1HE2      GLN  71  -2.170   8.095  -6.843
  548   HE22  GLN  71          2HE2      GLN  71  -3.541   7.863  -7.868
  549    H    ASN  72           H        ASN  72  -0.668   2.563  -7.510
  550    HA   ASN  72           HA       ASN  72  -3.173   1.126  -7.564
  551    HB2  ASN  72           2HB      ASN  72  -1.833   2.269  -9.543
  552    HB3  ASN  72           1HB      ASN  72  -1.074   0.683  -9.637
  553   HD21  ASN  72          1HD2      ASN  72  -2.213  -1.028 -10.413
  554   HD22  ASN  72          2HD2      ASN  72  -3.798  -0.896 -11.088
  555    H    VAL  73           H        VAL  73   0.279   0.263  -7.549
  556    HA   VAL  73           HA       VAL  73   0.151  -2.462  -7.731
  557    HB   VAL  73           HB       VAL  73   1.994  -0.645  -6.223
  558   HG11  VAL  73          1HG1      VAL  73   2.069  -3.657  -6.131
  559   HG12  VAL  73          2HG1      VAL  73   1.950  -2.543  -4.768
  560   HG13  VAL  73          3HG1      VAL  73   3.435  -2.619  -5.717
  561   HG21  VAL  73          3HG2      VAL  73   1.884  -1.362  -8.812
  562   HG22  VAL  73          1HG2      VAL  73   2.956  -2.618  -8.190
  563   HG23  VAL  73          2HG2      VAL  73   3.377  -0.918  -7.984
  564    H    VAL  74           H        VAL  74  -0.444  -0.489  -4.853
  565    HA   VAL  74           HA       VAL  74  -0.762  -2.702  -3.085
  566    HB   VAL  74           HB       VAL  74  -1.745   0.138  -2.816
  567   HG11  VAL  74          1HG1      VAL  74  -2.998  -1.512  -1.413
  568   HG12  VAL  74          2HG1      VAL  74  -2.128  -0.287  -0.493
  569   HG13  VAL  74          3HG1      VAL  74  -1.473  -1.917  -0.628
  570   HG21  VAL  74          3HG2      VAL  74   0.294  -0.339  -0.983
  571   HG22  VAL  74          1HG2      VAL  74   0.405   0.614  -2.461
  572   HG23  VAL  74          2HG2      VAL  74   0.850  -1.093  -2.475
  573    H    ALA  75           H        ALA  75  -3.100  -0.624  -4.828
  574    HA   ALA  75           HA       ALA  75  -5.477  -1.598  -3.875
  575    HB1  ALA  75           3HB      ALA  75  -6.411  -1.129  -6.149
  576    HB2  ALA  75           1HB      ALA  75  -4.766  -0.821  -6.702
  577    HB3  ALA  75           2HB      ALA  75  -5.483   0.199  -5.455
  578    H    ASP  76           H        ASP  76  -3.148  -3.142  -5.909
  579    HA   ASP  76           HA       ASP  76  -4.859  -5.290  -6.760
  580    HB2  ASP  76           2HB      ASP  76  -2.514  -4.309  -7.699
  581    HB3  ASP  76           1HB      ASP  76  -1.929  -5.699  -6.790
  582    H    HIS  77           H        HIS  77  -2.370  -4.855  -4.268
  583    HA   HIS  77           HA       HIS  77  -2.250  -7.506  -3.381
  584    HD1  HIS  77           1HD      HIS  77  -0.719  -6.307  -4.801
  585    HD2  HIS  77           2HD      HIS  77   1.083  -4.596  -1.470
  586    HE1  HIS  77           1HE      HIS  77   1.527  -5.501  -5.591
  587    HE2  HIS  77           2HE      HIS  77   2.558  -4.383  -3.583
  588    HB2  HIS  77           2HB      HIS  77  -1.880  -5.046  -1.657
  589    HB3  HIS  77           1HB      HIS  77  -1.232  -6.651  -1.365
  590    H    LEU  78           H        LEU  78  -4.417  -4.864  -2.387
  591    HA   LEU  78           HA       LEU  78  -5.689  -6.264  -0.304
  592    HG   LEU  78           HG       LEU  78  -4.990  -3.058  -0.641
  593    HB2  LEU  78           2HB      LEU  78  -6.611  -3.989  -2.060
  594    HB3  LEU  78           1HB      LEU  78  -7.562  -4.608  -0.726
  595   HD11  LEU  78          1HD1      LEU  78  -6.207  -1.611   0.798
  596   HD12  LEU  78          2HD1      LEU  78  -7.544  -2.754   0.918
  597   HD13  LEU  78          3HD1      LEU  78  -7.218  -1.936  -0.610
  598   HD21  LEU  78          3HD2      LEU  78  -6.072  -4.943   1.429
  599   HD22  LEU  78          1HD2      LEU  78  -5.137  -3.521   1.889
  600   HD23  LEU  78          2HD2      LEU  78  -4.414  -4.755   0.858
  601    H    GLN  79           H        GLN  79  -6.032  -6.293  -3.764
  602    HA   GLN  79           HA       GLN  79  -8.591  -7.563  -3.807
  603    HB2  GLN  79           2HB      GLN  79  -7.875  -6.257  -5.711
  604    HB3  GLN  79           1HB      GLN  79  -6.472  -7.287  -5.943
  605    HG2  GLN  79           2HG      GLN  79  -7.701  -8.996  -6.850
  606    HG3  GLN  79           1HG      GLN  79  -9.184  -8.507  -6.032
  607   HE21  GLN  79          1HE2      GLN  79  -9.801  -9.015  -8.391
  608   HE22  GLN  79          2HE2      GLN  79  -9.858  -7.651  -9.451
  609    H    ARG  80           H        ARG  80  -5.244  -8.760  -4.088
  610    HA   ARG  80           HA       ARG  80  -5.869 -11.416  -4.676
  611    HE   ARG  80           HE       ARG  80  -0.582 -13.476  -2.862
  612    HB2  ARG  80           2HB      ARG  80  -3.643 -10.839  -5.022
  613    HB3  ARG  80           1HB      ARG  80  -3.511 -10.009  -3.480
  614    HG2  ARG  80           2HG      ARG  80  -3.069 -11.920  -2.327
  615    HG3  ARG  80           1HG      ARG  80  -3.955 -12.945  -3.459
  616    HD2  ARG  80           2HD      ARG  80  -2.179 -12.662  -5.110
  617    HD3  ARG  80           1HD      ARG  80  -1.301 -11.617  -3.994
  618   HH11  ARG  80          1HH1      ARG  80  -3.182 -14.383  -5.006
  619   HH12  ARG  80          2HH1      ARG  80  -2.962 -16.082  -4.756
  620   HH21  ARG  80          1HH2      ARG  80  -0.292 -15.710  -2.531
  621   HH22  ARG  80          2HH2      ARG  80  -1.322 -16.836  -3.350
  622    H    MET  81           H        MET  81  -5.665  -9.678  -1.620
  623    HA   MET  81           HA       MET  81  -5.987 -12.083  -0.061
  624    HB2  MET  81           2HB      MET  81  -6.059 -10.574   1.878
  625    HB3  MET  81           1HB      MET  81  -4.664 -10.298   0.856
  626    HG2  MET  81           2HG      MET  81  -5.419  -8.180   1.507
  627    HG3  MET  81           1HG      MET  81  -5.922  -8.373  -0.168
  628    HE1  MET  81           3HE      MET  81  -8.120  -6.089   1.953
  629    HE2  MET  81           1HE      MET  81  -6.494  -6.643   2.355
  630    HE3  MET  81           2HE      MET  81  -7.862  -7.125   3.358
  631    H    ALA  82           H        ALA  82  -8.099  -9.964  -1.669
  632    HA   ALA  82           HA       ALA  82 -10.377 -11.139  -0.209
  633    HB1  ALA  82           3HB      ALA  82 -10.450  -8.981   0.629
  634    HB2  ALA  82           1HB      ALA  82 -11.538  -8.883  -0.755
  635    HB3  ALA  82           2HB      ALA  82  -9.893  -8.262  -0.883
  636    H    ASN  83           H        ASN  83 -10.974 -12.608  -1.728
  637    HA   ASN  83           HA       ASN  83 -11.186 -11.818  -4.520
  638    HB2  ASN  83           2HB      ASN  83 -11.138 -14.370  -3.028
  639    HB3  ASN  83           1HB      ASN  83 -12.151 -14.351  -4.468
  640   HD21  ASN  83          1HD2      ASN  83 -10.890 -15.684  -5.681
  641   HD22  ASN  83          2HD2      ASN  83  -9.315 -15.256  -6.245
  642    H    SER  84           H        SER  84 -12.957 -10.824  -5.195
  643    HA   SER  84           HA       SER  84 -15.520 -11.888  -5.071
  644    HG   SER  84           HG       SER  84 -17.377 -10.605  -2.575
  645    HB2  SER  84           2HB      SER  84 -14.923 -10.886  -2.597
  646    HB3  SER  84           1HB      SER  84 -15.700  -9.497  -3.357
  647    H    GLU  85           H        GLU  85 -13.596  -8.945  -5.161
  648    HA   GLU  85           HA       GLU  85 -14.742  -8.181  -7.680
  649    HB2  GLU  85           2HB      GLU  85 -15.664  -6.054  -6.999
  650    HB3  GLU  85           1HB      GLU  85 -16.434  -7.329  -6.064
  651    HG2  GLU  85           2HG      GLU  85 -14.094  -6.303  -4.714
  652    HG3  GLU  85           1HG      GLU  85 -15.241  -5.017  -5.091
  653    H    SER  86           H        SER  86 -13.741  -6.069  -8.456
  654    HA   SER  86           HA       SER  86 -10.924  -6.188  -7.984
  655    HG   SER  86           HG       SER  86 -10.271  -4.162 -10.564
  656    HB2  SER  86           2HB      SER  86 -11.788  -5.608 -10.199
  657    HB3  SER  86           1HB      SER  86 -12.574  -4.176  -9.537
  658    H    LEU  87           H        LEU  87 -11.258  -5.865  -5.636
  659    HA   LEU  87           HA       LEU  87 -11.636  -4.518  -3.746
  660    HG   LEU  87           HG       LEU  87  -8.187  -4.622  -2.915
  661    HB2  LEU  87           2HB      LEU  87  -9.058  -4.307  -4.979
  662    HB3  LEU  87           1HB      LEU  87  -9.463  -2.768  -4.244
  663   HD11  LEU  87          1HD1      LEU  87  -9.321  -3.706  -0.817
  664   HD12  LEU  87          2HD1      LEU  87 -10.327  -2.774  -1.927
  665   HD13  LEU  87          3HD1      LEU  87  -8.577  -2.547  -1.918
  666   HD21  LEU  87          3HD2      LEU  87  -9.545  -6.024  -1.546
  667   HD22  LEU  87          1HD2      LEU  87  -9.980  -6.330  -3.225
  668   HD23  LEU  87          2HD2      LEU  87 -11.025  -5.335  -2.210
  669    H    GLU  88           H        GLU  88 -13.254  -3.115  -3.476
  670    HA   GLU  88           HA       GLU  88 -13.557  -0.799  -5.137
  671    HB2  GLU  88           2HB      GLU  88 -15.476  -1.912  -3.992
  672    HB3  GLU  88           1HB      GLU  88 -14.809  -1.407  -2.445
  673    HG2  GLU  88           2HG      GLU  88 -15.148   0.793  -4.323
  674    HG3  GLU  88           1HG      GLU  88 -16.656  -0.033  -3.930
  675    H    ILE  89           H        ILE  89 -11.771   0.503  -5.030
  676    HA   ILE  89           HA       ILE  89 -11.206   1.669  -2.406
  677    HB   ILE  89           HB       ILE  89  -8.882   1.516  -2.596
  678   HG12  ILE  89          2HG1      ILE  89  -8.877   2.226  -5.076
  679   HG13  ILE  89          1HG1      ILE  89  -7.605   1.147  -4.532
  680   HG21  ILE  89          1HG2      ILE  89 -10.100  -0.991  -3.690
  681   HG22  ILE  89          2HG2      ILE  89  -9.693  -0.614  -2.017
  682   HG23  ILE  89          3HG2      ILE  89  -8.411  -0.871  -3.201
  683   HD11  ILE  89          3HD1      ILE  89 -10.084   0.332  -6.025
  684   HD12  ILE  89          1HD1      ILE  89  -8.813  -0.755  -5.460
  685   HD13  ILE  89          2HD1      ILE  89  -8.455   0.462  -6.687
  686    H    ALA  90           H        ALA  90 -11.202   3.899  -2.409
  687    HA   ALA  90           HA       ALA  90 -11.362   5.172  -5.044
  688    HB1  ALA  90           3HB      ALA  90 -12.331   7.056  -4.009
  689    HB2  ALA  90           1HB      ALA  90 -11.793   6.561  -2.406
  690    HB3  ALA  90           2HB      ALA  90 -13.078   5.666  -3.225
  691    H    TRP  91           H        TRP  91  -9.490   5.735  -5.865
  692    HA   TRP  91           HA       TRP  91  -7.284   6.497  -4.120
  693    HD1  TRP  91           HD       TRP  91  -8.440   4.025  -7.653
  694    HE1  TRP  91           1HE      TRP  91  -9.159   4.832  -9.988
  695    HE3  TRP  91           3HE      TRP  91  -6.337   8.684  -7.584
  696    HZ2  TRP  91           2HZ      TRP  91  -8.873   7.139 -11.590
  697    HZ3  TRP  91           3HZ      TRP  91  -6.606  10.129  -9.557
  698    HH2  TRP  91           HH       TRP  91  -7.848   9.370 -11.518
  699    HB2  TRP  91           2HB      TRP  91  -5.932   6.437  -6.209
  700    HB3  TRP  91           1HB      TRP  91  -6.749   4.914  -5.869
  701    H    GLN  92           H        GLN  92  -6.513   8.507  -3.916
  702    HA   GLN  92           HA       GLN  92  -8.019  10.660  -5.162
  703    HB2  GLN  92           2HB      GLN  92  -5.903  10.639  -3.005
  704    HB3  GLN  92           1HB      GLN  92  -6.635  12.109  -3.632
  705    HG2  GLN  92           2HG      GLN  92  -8.700  11.633  -2.700
  706    HG3  GLN  92           1HG      GLN  92  -8.345   9.914  -2.545
  707   HE21  GLN  92          1HE2      GLN  92  -6.422  12.712  -1.574
  708   HE22  GLN  92          2HE2      GLN  92  -6.385  12.327   0.110
  709    HA   PRO  93           HA       PRO  93  -5.325  11.831  -8.427
  710    HB2  PRO  93           2HB      PRO  93  -5.159  14.473  -7.060
  711    HB3  PRO  93           1HB      PRO  93  -5.506  14.108  -8.754
  712    HG2  PRO  93           2HG      PRO  93  -7.467  14.785  -7.078
  713    HG3  PRO  93           1HG      PRO  93  -7.712  13.545  -8.321
  714    HD2  PRO  93           2HD      PRO  93  -7.380  13.244  -5.385
  715    HD3  PRO  93           1HD      PRO  93  -8.279  12.232  -6.531
  716    H    ALA  94           H        ALA  94  -4.388  12.937  -5.189
  717    HA   ALA  94           HA       ALA  94  -2.375  12.401  -4.114
  718    HB1  ALA  94           3HB      ALA  94  -0.528  11.500  -5.161
  719    HB2  ALA  94           1HB      ALA  94  -0.856  12.339  -6.676
  720    HB3  ALA  94           2HB      ALA  94  -1.826  10.942  -6.218
  721    H    GLU  95           H        GLU  95  -3.544  14.893  -4.708
  722    HA   GLU  95           HA       GLU  95  -1.130  16.571  -4.831
  723    HB2  GLU  95           2HB      GLU  95  -2.756  16.585  -6.896
  724    HB3  GLU  95           1HB      GLU  95  -3.742  17.608  -5.861
  725    HG2  GLU  95           2HG      GLU  95  -2.251  19.337  -5.908
  726    HG3  GLU  95           1HG      GLU  95  -0.868  18.282  -6.189
  727    H    SER  96           H        SER  96  -4.528  16.387  -3.818
  728    HA   SER  96           HA       SER  96  -5.625  17.213  -2.005
  729    HG   SER  96           HG       SER  96  -3.773  15.177  -1.189
  730    HB2  SER  96           2HB      SER  96  -3.163  17.857  -0.490
  731    HB3  SER  96           1HB      SER  96  -4.578  16.925  -0.003
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1   6.858  13.314  -5.117
    2    HB2  MET   1           2HB      MET   1   7.473  13.573  -2.796
    3    HB3  MET   1           1HB      MET   1   8.783  14.144  -3.823
    4    HG2  MET   1           2HG      MET   1   6.958  16.277  -3.107
    5    HG3  MET   1           1HG      MET   1   7.634  15.480  -1.692
    6    HE1  MET   1           3HE      MET   1   7.738  18.382  -3.009
    7    HE2  MET   1           1HE      MET   1   8.531  18.169  -4.570
    8    HE3  MET   1           2HE      MET   1   9.389  18.957  -3.246
    9    H    PHE   2           H        PHE   2   4.765  13.313  -5.648
   10    HA   PHE   2           HA       PHE   2   2.916  15.098  -4.233
   11    HD1  PHE   2           1HD      PHE   2   3.398  16.496  -6.691
   12    HD2  PHE   2           2HD      PHE   2   2.947  12.499  -8.090
   13    HE1  PHE   2           1HE      PHE   2   4.732  17.045  -8.682
   14    HE2  PHE   2           2HE      PHE   2   4.276  13.045 -10.082
   15    HZ   PHE   2           HZ       PHE   2   5.174  15.318 -10.382
   16    HB2  PHE   2           2HB      PHE   2   1.834  13.150  -6.185
   17    HB3  PHE   2           1HB      PHE   2   1.461  14.857  -5.980
   18    H    ARG   3           H        ARG   3   0.765  13.891  -3.523
   19    HA   ARG   3           HA       ARG   3   1.345  11.172  -2.692
   20    HE   ARG   3           HE       ARG   3   4.499  10.690   1.444
   21    HB2  ARG   3           2HB      ARG   3   1.859  13.276  -0.902
   22    HB3  ARG   3           1HB      ARG   3   0.366  12.526  -0.347
   23    HG2  ARG   3           2HG      ARG   3   1.671  11.049   0.669
   24    HG3  ARG   3           1HG      ARG   3   1.954  10.370  -0.920
   25    HD2  ARG   3           2HD      ARG   3   4.101  10.913  -0.803
   26    HD3  ARG   3           1HD      ARG   3   3.689  12.605  -0.542
   27   HH11  ARG   3          1HH1      ARG   3   2.799  13.685   0.876
   28   HH12  ARG   3          2HH1      ARG   3   3.011  14.258   2.495
   29   HH21  ARG   3          1HH2      ARG   3   4.781  11.443   3.575
   30   HH22  ARG   3          2HH2      ARG   3   4.138  12.986   4.027
   31    H    SER   4           H        SER   4  -0.357   9.941  -2.869
   32    HA   SER   4           HA       SER   4  -3.060  11.097  -2.747
   33    HG   SER   4           HG       SER   4  -3.246   7.702  -3.894
   34    HB2  SER   4           2HB      SER   4  -3.075  10.300  -4.911
   35    HB3  SER   4           1HB      SER   4  -1.791   9.129  -4.595
   36    H    THR   5           H        THR   5  -4.731   9.494  -1.944
   37    HA   THR   5           HA       THR   5  -3.595   7.374  -0.315
   38    HB   THR   5           HB       THR   5  -4.582   8.095   1.754
   39    HG1  THR   5           1HG      THR   5  -5.868   9.860   1.912
   40   HG21  THR   5          3HG2      THR   5  -2.393   9.264   0.940
   41   HG22  THR   5          1HG2      THR   5  -3.240   9.837   2.374
   42   HG23  THR   5          2HG2      THR   5  -3.433  10.685   0.842
   43    H    SER   6           H        SER   6  -4.759   5.596  -0.384
   44    HA   SER   6           HA       SER   6  -7.579   5.811  -1.222
   45    HG   SER   6           HG       SER   6  -8.090   3.069  -1.397
   46    HB2  SER   6           2HB      SER   6  -6.063   4.530  -2.737
   47    HB3  SER   6           1HB      SER   6  -5.756   3.402  -1.417
   48    H    HIS   7           H        HIS   7  -9.169   5.061   0.081
   49    HA   HIS   7           HA       HIS   7  -8.350   3.662   2.554
   50    HD1  HIS   7           1HD      HIS   7  -9.719   6.146   5.393
   51    HD2  HIS   7           2HD      HIS   7 -11.603   2.884   3.636
   52    HE1  HIS   7           1HE      HIS   7 -10.901   4.961   7.268
   53    HE2  HIS   7           2HE      HIS   7 -11.956   2.940   6.198
   54    HB2  HIS   7           2HB      HIS   7  -9.153   5.940   2.997
   55    HB3  HIS   7           1HB      HIS   7 -10.664   5.575   2.177
   56    H    VAL   8           H        VAL   8  -9.286   1.746   3.023
   57    HA   VAL   8           HA       VAL   8 -11.780   0.995   1.670
   58    HB   VAL   8           HB       VAL   8  -9.572  -1.028   1.824
   59   HG11  VAL   8          1HG1      VAL   8 -10.774  -2.109   0.058
   60   HG12  VAL   8          2HG1      VAL   8 -11.838  -0.718  -0.139
   61   HG13  VAL   8          3HG1      VAL   8 -11.919  -1.689   1.331
   62   HG21  VAL   8          3HG2      VAL   8  -8.684   0.979   0.631
   63   HG22  VAL   8          1HG2      VAL   8  -9.979   0.781  -0.551
   64   HG23  VAL   8          2HG2      VAL   8  -8.763  -0.481  -0.354
   65    H    ARG   9           H        ARG   9 -12.942  -0.750   2.731
   66    HA   ARG   9           HA       ARG   9 -12.174  -0.977   5.559
   67    HE   ARG   9           HE       ARG   9 -15.548   2.194   6.739
   68    HB2  ARG   9           2HB      ARG   9 -14.784  -1.025   4.149
   69    HB3  ARG   9           1HB      ARG   9 -14.622  -2.103   5.526
   70    HG2  ARG   9           2HG      ARG   9 -15.550  -0.082   6.326
   71    HG3  ARG   9           1HG      ARG   9 -13.872  -0.132   6.873
   72    HD2  ARG   9           2HD      ARG   9 -13.229   1.576   5.503
   73    HD3  ARG   9           1HD      ARG   9 -14.440   1.196   4.280
   74   HH11  ARG   9          1HH1      ARG   9 -14.203   3.072   3.640
   75   HH12  ARG   9          2HH1      ARG   9 -14.991   4.612   3.595
   76   HH21  ARG   9          1HH2      ARG   9 -16.587   4.219   6.679
   77   HH22  ARG   9          2HH2      ARG   9 -16.344   5.264   5.319
   78    H    THR  10           H        THR  10 -10.861  -2.672   5.855
   79    HA   THR  10           HA       THR  10 -11.737  -5.290   4.833
   80    HB   THR  10           HB       THR  10  -9.517  -3.942   3.904
   81    HG1  THR  10           1HG      THR  10 -10.190  -6.686   3.952
   82   HG21  THR  10          3HG2      THR  10  -8.518  -4.616   6.210
   83   HG22  THR  10          1HG2      THR  10  -7.575  -4.804   4.726
   84   HG23  THR  10          2HG2      THR  10  -8.375  -6.203   5.447
   85    H    GLU  11           H        GLU  11 -10.982  -7.148   6.103
   86    HA   GLU  11           HA       GLU  11 -10.568  -6.406   8.922
   87    HB2  GLU  11           2HB      GLU  11 -12.385  -8.173   7.701
   88    HB3  GLU  11           1HB      GLU  11 -11.233  -9.183   8.565
   89    HG2  GLU  11           2HG      GLU  11 -11.994  -6.957  10.193
   90    HG3  GLU  11           1HG      GLU  11 -13.430  -7.794   9.606
   91    H    SER  12           H        SER  12  -8.993  -7.478  10.201
   92    HA   SER  12           HA       SER  12  -6.945  -8.340  10.633
   93    HG   SER  12           HG       SER  12  -5.862 -11.040  10.175
   94    HB2  SER  12           2HB      SER  12  -7.895 -10.468  10.232
   95    HB3  SER  12           1HB      SER  12  -7.888 -10.234   8.484
   96    H    ALA  13           H        ALA  13  -7.249  -6.220   8.657
   97    HA   ALA  13           HA       ALA  13  -5.601  -6.381   6.434
   98    HB1  ALA  13           3HB      ALA  13  -7.043  -4.447   7.140
   99    HB2  ALA  13           1HB      ALA  13  -5.470  -4.033   6.463
  100    HB3  ALA  13           2HB      ALA  13  -5.722  -3.991   8.200
  101    H    ALA  14           H        ALA  14  -4.616  -5.407   9.700
  102    HA   ALA  14           HA       ALA  14  -2.043  -4.645   9.317
  103    HB1  ALA  14           3HB      ALA  14  -1.556  -5.547  11.592
  104    HB2  ALA  14           1HB      ALA  14  -3.156  -6.291  11.566
  105    HB3  ALA  14           2HB      ALA  14  -2.997  -4.536  11.466
  106    H    ARG  15           H        ARG  15  -3.138  -7.932   8.926
  107    HA   ARG  15           HA       ARG  15  -0.487  -9.059   9.077
  108    HE   ARG  15           HE       ARG  15   1.044 -13.318   8.501
  109    HB2  ARG  15           2HB      ARG  15  -2.795 -10.174   9.560
  110    HB3  ARG  15           1HB      ARG  15  -2.832 -10.433   7.826
  111    HG2  ARG  15           2HG      ARG  15  -1.323 -11.814   9.905
  112    HG3  ARG  15           1HG      ARG  15  -1.861 -12.370   8.326
  113    HD2  ARG  15           2HD      ARG  15   0.068 -11.619   7.262
  114    HD3  ARG  15           1HD      ARG  15   0.454 -10.478   8.547
  115   HH11  ARG  15          1HH1      ARG  15   0.914 -10.377  10.383
  116   HH12  ARG  15          2HH1      ARG  15   2.006 -10.959  11.592
  117   HH21  ARG  15          1HH2      ARG  15   2.477 -14.081  10.094
  118   HH22  ARG  15          2HH2      ARG  15   2.893 -13.059  11.430
  119    H    TYR  16           H        TYR  16  -2.686  -8.093   6.506
  120    HA   TYR  16           HA       TYR  16  -1.156  -9.269   4.411
  121    HD1  TYR  16           1HD      TYR  16  -2.797 -10.614   4.737
  122    HD2  TYR  16           2HD      TYR  16  -5.364  -7.515   3.322
  123    HE1  TYR  16           1HE      TYR  16  -4.708 -12.126   4.893
  124    HE2  TYR  16           2HE      TYR  16  -7.280  -9.035   3.486
  125    HH   TYR  16           HH       TYR  16  -7.481 -11.575   5.197
  126    HB2  TYR  16           2HB      TYR  16  -3.130  -6.984   4.248
  127    HB3  TYR  16           1HB      TYR  16  -2.490  -7.878   2.880
  128    H    VAL  17           H        VAL  17  -0.807  -6.349   6.223
  129    HA   VAL  17           HA       VAL  17   0.914  -5.094   4.255
  130    HB   VAL  17           HB       VAL  17   0.125  -4.367   7.069
  131   HG11  VAL  17          1HG1      VAL  17   1.585  -2.223   6.264
  132   HG12  VAL  17          2HG1      VAL  17   2.563  -3.553   5.647
  133   HG13  VAL  17          3HG1      VAL  17   2.170  -3.465   7.367
  134   HG21  VAL  17          3HG2      VAL  17  -0.061  -2.838   4.486
  135   HG22  VAL  17          1HG2      VAL  17  -0.706  -2.348   6.052
  136   HG23  VAL  17          2HG2      VAL  17  -1.375  -3.758   5.220
  137    H    ASN  18           H        ASN  18   1.266  -6.731   7.385
  138    HA   ASN  18           HA       ASN  18   4.093  -6.491   7.484
  139    HB2  ASN  18           2HB      ASN  18   2.462  -8.587   8.909
  140    HB3  ASN  18           1HB      ASN  18   3.996  -7.880   9.409
  141   HD21  ASN  18          1HD2      ASN  18   2.098  -7.899  11.235
  142   HD22  ASN  18          2HD2      ASN  18   1.413  -6.329  11.467
  143    H    ARG  19           H        ARG  19   1.956  -8.878   6.048
  144    HA   ARG  19           HA       ARG  19   3.932 -10.907   5.800
  145    HE   ARG  19           HE       ARG  19  -0.225 -13.089   4.700
  146    HB2  ARG  19           2HB      ARG  19   1.285 -10.973   5.652
  147    HB3  ARG  19           1HB      ARG  19   1.616 -10.789   3.935
  148    HG2  ARG  19           2HG      ARG  19   2.009 -12.954   3.788
  149    HG3  ARG  19           1HG      ARG  19   3.353 -12.777   4.915
  150    HD2  ARG  19           2HD      ARG  19   2.028 -14.352   5.967
  151    HD3  ARG  19           1HD      ARG  19   1.530 -12.846   6.736
  152   HH11  ARG  19          1HH1      ARG  19   0.787 -15.267   7.233
  153   HH12  ARG  19          2HH1      ARG  19  -0.733 -16.092   7.303
  154   HH21  ARG  19          1HH2      ARG  19  -2.226 -14.174   4.791
  155   HH22  ARG  19          2HH2      ARG  19  -2.444 -15.472   5.917
  156    H    LEU  20           H        LEU  20   3.297  -8.048   4.036
  157    HA   LEU  20           HA       LEU  20   4.310  -8.940   1.515
  158    HG   LEU  20           HG       LEU  20   1.848  -6.961   2.557
  159    HB2  LEU  20           2HB      LEU  20   4.057  -6.136   2.581
  160    HB3  LEU  20           1HB      LEU  20   4.329  -6.573   0.907
  161   HD11  LEU  20          1HD1      LEU  20   0.817  -5.606   0.875
  162   HD12  LEU  20          2HD1      LEU  20   2.269  -5.662  -0.126
  163   HD13  LEU  20          3HD1      LEU  20   2.289  -4.794   1.409
  164   HD21  LEU  20          3HD2      LEU  20   0.862  -8.094   0.582
  165   HD22  LEU  20          1HD2      LEU  20   2.126  -9.045   1.359
  166   HD23  LEU  20          2HD2      LEU  20   2.466  -8.181  -0.141
  167    H    CYS  21           H        CYS  21   5.714  -7.071   4.199
  168    HA   CYS  21           HA       CYS  21   8.166  -6.507   3.006
  169    HG   CYS  21           HG       CYS  21   5.921  -5.706   5.652
  170    HB2  CYS  21           2HB      CYS  21   8.068  -7.198   5.925
  171    HB3  CYS  21           1HB      CYS  21   8.980  -5.935   5.114
  172    H    LYS  22           H        LYS  22   6.992  -9.433   4.504
  173    HA   LYS  22           HA       LYS  22   9.571 -10.744   4.358
  174    HB2  LYS  22           2HB      LYS  22   6.858 -11.913   4.973
  175    HB3  LYS  22           1HB      LYS  22   8.413 -12.687   5.242
  176    HG2  LYS  22           2HG      LYS  22   8.668 -11.692   7.213
  177    HG3  LYS  22           1HG      LYS  22   8.272 -10.108   6.547
  178    HD2  LYS  22           2HD      LYS  22   6.632 -10.577   8.198
  179    HD3  LYS  22           1HD      LYS  22   5.846 -10.809   6.634
  180    HE2  LYS  22           2HE      LYS  22   5.172 -12.648   7.904
  181    HE3  LYS  22           1HE      LYS  22   6.470 -13.269   6.884
  182    HZ1  LYS  22           3HZ      LYS  22   7.240 -12.237   9.497
  183    HZ2  LYS  22           1HZ      LYS  22   7.830 -13.573   8.643
  184    HZ3  LYS  22           2HZ      LYS  22   6.370 -13.686   9.489
  185    H    HIS  23           H        HIS  23   6.818 -10.291   2.352
  186    HA   HIS  23           HA       HIS  23   7.282 -12.613   0.707
  187    HD1  HIS  23           1HD      HIS  23   3.568 -13.270   0.251
  188    HD2  HIS  23           2HD      HIS  23   6.314 -11.834  -2.516
  189    HE1  HIS  23           1HE      HIS  23   3.114 -14.544  -1.870
  190    HE2  HIS  23           2HE      HIS  23   4.842 -13.717  -3.506
  191    HB2  HIS  23           2HB      HIS  23   5.008 -11.531   1.223
  192    HB3  HIS  23           1HB      HIS  23   5.459 -10.321   0.025
  193    H    TRP  24           H        TRP  24   7.241  -9.084   0.043
  194    HA   TRP  24           HA       TRP  24   8.812  -9.577  -2.368
  195    HD1  TRP  24           HD       TRP  24   9.874  -8.521  -3.967
  196    HE1  TRP  24           1HE      TRP  24  10.456  -6.756  -5.747
  197    HE3  TRP  24           3HE      TRP  24   6.647  -4.824  -2.530
  198    HZ2  TRP  24           2HZ      TRP  24   9.652  -4.143  -6.450
  199    HZ3  TRP  24           3HZ      TRP  24   6.616  -2.723  -3.811
  200    HH2  TRP  24           HH       TRP  24   8.089  -2.391  -5.730
  201    HB2  TRP  24           2HB      TRP  24   6.852  -8.051  -2.416
  202    HB3  TRP  24           1HB      TRP  24   7.698  -6.968  -1.318
  203    H    GLY  25           H        GLY  25   9.478  -8.874   0.891
  204    HA2  GLY  25           2HA      GLY  25  11.651  -7.067   0.529
  205    HA3  GLY  25           1HA      GLY  25  11.333  -8.021   1.961
  206    H    HIS  26           H        HIS  26  12.311  -8.657  -1.407
  207    HA   HIS  26           HA       HIS  26  14.378 -10.466  -0.350
  208    HD1  HIS  26           1HD      HIS  26  14.569  -9.607  -4.375
  209    HD2  HIS  26           2HD      HIS  26  10.715 -10.796  -3.373
  210    HE1  HIS  26           1HE      HIS  26  13.106  -8.794  -6.251
  211    HE2  HIS  26           2HE      HIS  26  10.792  -9.603  -5.667
  212    HB2  HIS  26           2HB      HIS  26  14.282 -11.631  -2.510
  213    HB3  HIS  26           1HB      HIS  26  12.703 -11.612  -1.731
  214    H    LYS  27           H        LYS  27  13.696  -7.699  -2.321
  215    HA   LYS  27           HA       LYS  27  16.543  -7.111  -2.502
  216    HB2  LYS  27           2HB      LYS  27  16.244  -8.385  -4.532
  217    HB3  LYS  27           1HB      LYS  27  14.786  -7.497  -4.940
  218    HG2  LYS  27           2HG      LYS  27  17.093  -5.748  -4.653
  219    HG3  LYS  27           1HG      LYS  27  17.332  -6.998  -5.875
  220    HD2  LYS  27           2HD      LYS  27  14.770  -5.469  -5.827
  221    HD3  LYS  27           1HD      LYS  27  16.214  -4.716  -6.505
  222    HE2  LYS  27           2HE      LYS  27  16.150  -7.288  -7.589
  223    HE3  LYS  27           1HE      LYS  27  14.479  -6.725  -7.640
  224    HZ1  LYS  27           3HZ      LYS  27  16.190  -6.181  -9.548
  225    HZ2  LYS  27           1HZ      LYS  27  16.558  -4.876  -8.535
  226    HZ3  LYS  27           2HZ      LYS  27  14.979  -5.086  -9.106
  227    H    PHE  28           H        PHE  28  14.113  -6.048  -1.194
  228    HA   PHE  28           HA       PHE  28  14.341  -3.304  -2.166
  229    HD1  PHE  28           2HD      PHE  28  12.349  -5.587  -4.243
  230    HD2  PHE  28           1HD      PHE  28  11.962  -1.488  -3.152
  231    HE1  PHE  28           2HE      PHE  28  12.115  -4.982  -6.616
  232    HE2  PHE  28           1HE      PHE  28  11.719  -0.884  -5.515
  233    HZ   PHE  28           HZ       PHE  28  11.798  -2.624  -7.256
  234    HB2  PHE  28           2HB      PHE  28  11.852  -4.924  -1.957
  235    HB3  PHE  28           1HB      PHE  28  11.767  -3.225  -1.507
  236    H    GLU  29           H        GLU  29  14.069  -1.708  -0.588
  237    HA   GLU  29           HA       GLU  29  14.631  -2.568   2.096
  238    HB2  GLU  29           2HB      GLU  29  14.326  -0.038   2.549
  239    HB3  GLU  29           1HB      GLU  29  15.684  -0.549   1.556
  240    HG2  GLU  29           2HG      GLU  29  13.210   0.058   0.096
  241    HG3  GLU  29           1HG      GLU  29  13.974   1.424   0.907
  242    H    VAL  30           H        VAL  30  12.822  -3.791   2.694
  243    HA   VAL  30           HA       VAL  30  10.301  -2.310   2.887
  244    HB   VAL  30           HB       VAL  30   9.290  -4.617   3.263
  245   HG11  VAL  30          1HG1      VAL  30   9.156  -3.336   1.133
  246   HG12  VAL  30          2HG1      VAL  30   9.145  -5.082   0.908
  247   HG13  VAL  30          3HG1      VAL  30  10.615  -4.160   0.592
  248   HG21  VAL  30          3HG2      VAL  30  11.652  -5.581   3.700
  249   HG22  VAL  30          1HG2      VAL  30  11.766  -5.657   1.940
  250   HG23  VAL  30          2HG2      VAL  30  10.490  -6.541   2.783
  251    H    GLU  31           H        GLU  31   9.746  -1.543   4.812
  252    HA   GLU  31           HA       GLU  31  10.907  -2.738   7.222
  253    HB2  GLU  31           2HB      GLU  31  10.437  -0.076   6.423
  254    HB3  GLU  31           1HB      GLU  31   9.304  -0.394   7.729
  255    HG2  GLU  31           2HG      GLU  31  10.972  -0.744   9.274
  256    HG3  GLU  31           1HG      GLU  31  12.169  -1.152   8.046
  257    H    LEU  32           H        LEU  32   9.554  -3.230   9.046
  258    HA   LEU  32           HA       LEU  32   6.708  -3.592   8.380
  259    HG   LEU  32           HG       LEU  32   5.864  -6.234   8.252
  260    HB2  LEU  32           2HB      LEU  32   8.138  -5.690   8.160
  261    HB3  LEU  32           1HB      LEU  32   8.300  -5.646   9.903
  262   HD11  LEU  32          1HD1      LEU  32   6.090  -8.304   9.047
  263   HD12  LEU  32          2HD1      LEU  32   6.375  -7.736  10.691
  264   HD13  LEU  32          3HD1      LEU  32   7.709  -7.810   9.541
  265   HD21  LEU  32          3HD2      LEU  32   4.607  -6.228  10.454
  266   HD22  LEU  32          1HD2      LEU  32   4.957  -4.650   9.753
  267   HD23  LEU  32          2HD2      LEU  32   5.925  -5.255  11.098
  268    H    THR  33           H        THR  33   5.641  -2.297   9.710
  269    HA   THR  33           HA       THR  33   6.324  -2.403  12.597
  270    HB   THR  33           HB       THR  33   5.136  -0.048  12.526
  271    HG1  THR  33           1HG      THR  33   4.711  -0.245  10.235
  272   HG21  THR  33          3HG2      THR  33   7.476   0.909  11.657
  273   HG22  THR  33          1HG2      THR  33   7.947  -0.752  12.014
  274   HG23  THR  33          2HG2      THR  33   7.232   0.252  13.276
  275    HA   PRO  34           HA       PRO  34   2.143  -3.754  13.021
  276    HB2  PRO  34           2HB      PRO  34   1.530  -2.897  15.517
  277    HB3  PRO  34           1HB      PRO  34   2.620  -4.247  15.201
  278    HG2  PRO  34           2HG      PRO  34   3.264  -1.425  15.920
  279    HG3  PRO  34           1HG      PRO  34   4.051  -2.923  16.446
  280    HD2  PRO  34           2HD      PRO  34   5.034  -1.271  14.483
  281    HD3  PRO  34           1HD      PRO  34   5.392  -3.006  14.592
  282    H    GLU  35           H        GLU  35   2.163  -1.677  11.417
  283    HA   GLU  35           HA       GLU  35  -0.305  -0.344  11.929
  284    HB2  GLU  35           2HB      GLU  35   2.289   1.196  12.044
  285    HB3  GLU  35           1HB      GLU  35   0.748   1.968  11.684
  286    HG2  GLU  35           2HG      GLU  35  -0.003   0.810  13.906
  287    HG3  GLU  35           1HG      GLU  35   1.730   0.779  14.227
  288    H    ARG  36           H        ARG  36   2.640  -0.609   9.987
  289    HA   ARG  36           HA       ARG  36   1.183  -0.788   7.574
  290    HE   ARG  36           HE       ARG  36   4.565   3.799   7.637
  291    HB2  ARG  36           2HB      ARG  36   2.296   1.286   6.556
  292    HB3  ARG  36           1HB      ARG  36   0.915   1.551   7.606
  293    HG2  ARG  36           2HG      ARG  36   2.533   1.973   9.473
  294    HG3  ARG  36           1HG      ARG  36   3.822   1.920   8.270
  295    HD2  ARG  36           2HD      ARG  36   1.899   3.659   7.227
  296    HD3  ARG  36           1HD      ARG  36   2.018   4.064   8.939
  297   HH11  ARG  36          1HH1      ARG  36   1.932   5.975   8.355
  298   HH12  ARG  36          2HH1      ARG  36   2.901   7.400   8.195
  299   HH21  ARG  36          1HH2      ARG  36   5.842   5.673   7.428
  300   HH22  ARG  36          2HH2      ARG  36   5.121   7.230   7.668
  301    H    GLY  37           H        GLY  37   2.634  -0.709   5.649
  302    HA2  GLY  37           2HA      GLY  37   5.259  -1.865   6.347
  303    HA3  GLY  37           1HA      GLY  37   4.317  -2.329   4.929
  304    H    PHE  38           H        PHE  38   7.061  -1.231   5.014
  305    HA   PHE  38           HA       PHE  38   6.571   1.182   3.382
  306    HD1  PHE  38           1HD      PHE  38   7.272   3.609   3.655
  307    HD2  PHE  38           2HD      PHE  38  10.847   1.490   4.583
  308    HE1  PHE  38           1HE      PHE  38   8.601   5.434   2.690
  309    HE2  PHE  38           2HE      PHE  38  12.179   3.301   3.595
  310    HZ   PHE  38           HZ       PHE  38  11.058   5.277   2.645
  311    HB2  PHE  38           2HB      PHE  38   7.497   1.794   5.558
  312    HB3  PHE  38           1HB      PHE  38   8.823   0.662   5.337
  313    H    ILE  39           H        ILE  39   7.001   0.669   1.351
  314    HA   ILE  39           HA       ILE  39   9.450  -0.916   0.823
  315    HB   ILE  39           HB       ILE  39   7.107  -1.067  -1.049
  316   HG12  ILE  39          2HG1      ILE  39   7.479  -2.628   1.504
  317   HG13  ILE  39          1HG1      ILE  39   6.011  -1.911   0.850
  318   HG21  ILE  39          1HG2      ILE  39   8.705  -3.442  -0.811
  319   HG22  ILE  39          2HG2      ILE  39   9.740  -2.037  -1.049
  320   HG23  ILE  39          3HG2      ILE  39   8.458  -2.393  -2.206
  321   HD11  ILE  39          3HD1      ILE  39   6.002  -4.359   0.780
  322   HD12  ILE  39          1HD1      ILE  39   7.402  -4.320  -0.291
  323   HD13  ILE  39          2HD1      ILE  39   5.864  -3.637  -0.821
  324    H    ASP  40           H        ASP  40  10.824   0.685   0.112
  325    HA   ASP  40           HA       ASP  40   9.752   2.482  -1.952
  326    HB2  ASP  40           2HB      ASP  40  11.713   3.983  -1.252
  327    HB3  ASP  40           1HB      ASP  40  10.328   3.875  -0.174
  328    H    PHE  41           H        PHE  41  10.689   2.676  -3.828
  329    HA   PHE  41           HA       PHE  41  12.797   0.797  -4.555
  330    HD1  PHE  41           1HD      PHE  41  14.108   0.753  -6.420
  331    HD2  PHE  41           2HD      PHE  41  10.137   0.521  -7.939
  332    HE1  PHE  41           1HE      PHE  41  14.841  -0.913  -8.071
  333    HE2  PHE  41           2HE      PHE  41  10.866  -1.149  -9.592
  334    HZ   PHE  41           HZ       PHE  41  13.220  -1.867  -9.660
  335    HB2  PHE  41           2HB      PHE  41  10.570   1.579  -5.848
  336    HB3  PHE  41           1HB      PHE  41  11.694   2.748  -6.518
  337    H    GLY  42           H        GLY  42  12.802   3.719  -3.201
  338    HA2  GLY  42           2HA      GLY  42  14.914   4.861  -2.874
  339    HA3  GLY  42           1HA      GLY  42  15.283   4.555  -4.567
  340    H    ASP  43           H        ASP  43  13.983   5.677  -6.185
  341    HA   ASP  43           HA       ASP  43  13.286   8.375  -5.295
  342    HB2  ASP  43           2HB      ASP  43  14.072   7.129  -7.884
  343    HB3  ASP  43           1HB      ASP  43  12.972   8.503  -7.966
  344    H    SER  44           H        SER  44  11.556   6.637  -4.338
  345    HA   SER  44           HA       SER  44   9.040   7.452  -4.909
  346    HG   SER  44           HG       SER  44  10.163   4.267  -6.767
  347    HB2  SER  44           2HB      SER  44   8.337   5.205  -6.212
  348    HB3  SER  44           1HB      SER  44   8.806   6.673  -7.071
  349    H    ASN  45           H        ASN  45   7.382   6.043  -3.766
  350    HA   ASN  45           HA       ASN  45   8.464   3.754  -2.362
  351    HB2  ASN  45           2HB      ASN  45   7.352   5.889  -0.582
  352    HB3  ASN  45           1HB      ASN  45   8.464   4.583  -0.193
  353   HD21  ASN  45          1HD2      ASN  45   8.304   7.505  -2.205
  354   HD22  ASN  45          2HD2      ASN  45   9.922   8.015  -1.886
  355    H    CYS  46           H        CYS  46   6.793   2.789  -0.838
  356    HA   CYS  46           HA       CYS  46   4.050   3.536  -1.453
  357    HG   CYS  46           HG       CYS  46   2.196   1.952  -2.220
  358    HB2  CYS  46           2HB      CYS  46   4.845   1.939  -3.243
  359    HB3  CYS  46           1HB      CYS  46   4.978   0.715  -1.984
  360    H    GLU  47           H        GLU  47   3.446   3.842   0.610
  361    HA   GLU  47           HA       GLU  47   4.088   1.799   2.611
  362    HB2  GLU  47           2HB      GLU  47   4.427   4.433   2.785
  363    HB3  GLU  47           1HB      GLU  47   2.752   4.380   3.303
  364    HG2  GLU  47           2HG      GLU  47   3.251   3.305   5.268
  365    HG3  GLU  47           1HG      GLU  47   4.729   2.585   4.633
  366    H    LEU  48           H        LEU  48   2.402   0.952   3.993
  367    HA   LEU  48           HA       LEU  48  -0.325   1.482   3.076
  368    HG   LEU  48           HG       LEU  48   1.605  -1.730   3.921
  369    HB2  LEU  48           2HB      LEU  48  -0.701  -1.082   3.306
  370    HB3  LEU  48           1HB      LEU  48  -0.106  -0.402   1.805
  371   HD11  LEU  48          1HD1      LEU  48   1.426  -3.686   2.827
  372   HD12  LEU  48          2HD1      LEU  48   1.328  -2.919   1.243
  373   HD13  LEU  48          3HD1      LEU  48  -0.104  -3.012   2.266
  374   HD21  LEU  48          3HD2      LEU  48   3.038  -1.714   1.599
  375   HD22  LEU  48          1HD2      LEU  48   3.226  -0.548   2.908
  376   HD23  LEU  48          2HD2      LEU  48   2.212  -0.155   1.518
  377    H    LEU  49           H        LEU  49  -1.655   1.822   4.680
  378    HA   LEU  49           HA       LEU  49  -0.840   1.047   7.394
  379    HG   LEU  49           HG       LEU  49  -2.204   1.852   9.177
  380    HB2  LEU  49           2HB      LEU  49  -1.823   3.368   6.698
  381    HB3  LEU  49           1HB      LEU  49  -3.362   2.529   6.768
  382   HD11  LEU  49          1HD1      LEU  49  -1.793   4.451   9.843
  383   HD12  LEU  49          2HD1      LEU  49  -1.078   4.390   8.233
  384   HD13  LEU  49          3HD1      LEU  49  -0.514   3.289   9.490
  385   HD21  LEU  49          3HD2      LEU  49  -3.808   3.515  10.113
  386   HD22  LEU  49          1HD2      LEU  49  -4.515   2.431   8.915
  387   HD23  LEU  49          2HD2      LEU  49  -4.101   4.088   8.471
  388    H    ALA  50           H        ALA  50  -1.741  -0.610   8.482
  389    HA   ALA  50           HA       ALA  50  -4.234  -1.737   7.432
  390    HB1  ALA  50           3HB      ALA  50  -2.787  -3.118   6.334
  391    HB2  ALA  50           1HB      ALA  50  -3.073  -4.012   7.816
  392    HB3  ALA  50           2HB      ALA  50  -1.596  -3.084   7.635
  393    H    HIS  51           H        HIS  51  -5.619  -1.649   9.037
  394    HA   HIS  51           HA       HIS  51  -4.752  -2.486  11.690
  395    HD1  HIS  51           1HD      HIS  51  -7.737   0.133  13.716
  396    HD2  HIS  51           2HD      HIS  51  -3.847  -1.291  13.363
  397    HE1  HIS  51           1HE      HIS  51  -6.713   0.400  15.997
  398    HE2  HIS  51           2HE      HIS  51  -4.389  -0.548  15.779
  399    HB2  HIS  51           2HB      HIS  51  -5.916  -0.086  11.020
  400    HB3  HIS  51           1HB      HIS  51  -7.310  -1.034  11.513
  401    HA   PRO  52           HA       PRO  52  -7.313  -6.041  11.881
  402    HB2  PRO  52           2HB      PRO  52  -9.022  -4.632  13.885
  403    HB3  PRO  52           1HB      PRO  52  -8.308  -6.247  13.946
  404    HG2  PRO  52           2HG      PRO  52  -7.207  -4.252  15.294
  405    HG3  PRO  52           1HG      PRO  52  -6.192  -5.438  14.456
  406    HD2  PRO  52           2HD      PRO  52  -6.831  -2.626  13.701
  407    HD3  PRO  52           1HD      PRO  52  -5.343  -3.549  13.444
  408    H    ASP  53           H        ASP  53  -8.962  -2.986  11.281
  409    HA   ASP  53           HA       ASP  53 -10.923  -4.510   9.745
  410    HB2  ASP  53           2HB      ASP  53 -11.728  -3.791  12.129
  411    HB3  ASP  53           1HB      ASP  53 -11.929  -2.212  11.375
  412    H    HIS  54           H        HIS  54  -8.693  -2.116   9.581
  413    HA   HIS  54           HA       HIS  54 -10.007  -1.130   7.202
  414    HD1  HIS  54           1HD      HIS  54  -7.282   1.915   8.756
  415    HD2  HIS  54           2HD      HIS  54 -10.034   0.382  11.465
  416    HE1  HIS  54           1HE      HIS  54  -6.377   2.489  11.029
  417    HE2  HIS  54           2HE      HIS  54  -8.144   1.698  12.640
  418    HB2  HIS  54           2HB      HIS  54  -9.556   1.251   7.710
  419    HB3  HIS  54           1HB      HIS  54 -10.753   0.523   8.766
  420    H    VAL  55           H        VAL  55  -8.558   0.014   5.706
  421    HA   VAL  55           HA       VAL  55  -5.721  -0.319   6.294
  422    HB   VAL  55           HB       VAL  55  -6.849  -2.300   4.985
  423   HG11  VAL  55          1HG1      VAL  55  -7.149  -2.121   2.731
  424   HG12  VAL  55          2HG1      VAL  55  -6.039  -0.760   2.579
  425   HG13  VAL  55          3HG1      VAL  55  -7.653  -0.512   3.242
  426   HG21  VAL  55          3HG2      VAL  55  -4.739  -2.820   3.966
  427   HG22  VAL  55          1HG2      VAL  55  -4.457  -2.052   5.527
  428   HG23  VAL  55          2HG2      VAL  55  -4.247  -1.127   4.039
  429    H    LEU  56           H        LEU  56  -4.451   1.197   5.403
  430    HA   LEU  56           HA       LEU  56  -5.712   3.148   3.592
  431    HG   LEU  56           HG       LEU  56  -6.453   4.786   5.500
  432    HB2  LEU  56           2HB      LEU  56  -4.431   3.541   6.143
  433    HB3  LEU  56           1HB      LEU  56  -3.513   4.370   4.909
  434   HD11  LEU  56          1HD1      LEU  56  -5.886   6.747   6.621
  435   HD12  LEU  56          2HD1      LEU  56  -4.239   6.745   5.991
  436   HD13  LEU  56          3HD1      LEU  56  -4.719   5.563   7.209
  437   HD21  LEU  56          3HD2      LEU  56  -5.831   6.928   4.097
  438   HD22  LEU  56          1HD2      LEU  56  -6.333   5.437   3.303
  439   HD23  LEU  56          2HD2      LEU  56  -4.620   5.852   3.404
  440    H    MET  57           H        MET  57  -4.476   3.941   1.889
  441    HA   MET  57           HA       MET  57  -1.897   2.598   1.462
  442    HB2  MET  57           2HB      MET  57  -3.832   3.130  -0.772
  443    HB3  MET  57           1HB      MET  57  -2.434   2.060  -0.761
  444    HG2  MET  57           2HG      MET  57  -3.572   0.608   0.870
  445    HG3  MET  57           1HG      MET  57  -4.985   1.662   0.785
  446    HE1  MET  57           3HE      MET  57  -6.564   1.773  -0.592
  447    HE2  MET  57           1HE      MET  57  -7.129   0.211  -1.186
  448    HE3  MET  57           2HE      MET  57  -6.545   1.427  -2.322
  449    H    ILE  58           H        ILE  58  -0.326   4.102   1.433
  450    HA   ILE  58           HA       ILE  58  -0.887   6.637   0.051
  451    HB   ILE  58           HB       ILE  58   0.931   6.290   2.440
  452   HG12  ILE  58          2HG1      ILE  58  -1.927   6.582   2.340
  453   HG13  ILE  58          1HG1      ILE  58  -0.888   6.422   3.742
  454   HG21  ILE  58          1HG2      ILE  58   1.048   8.715   2.435
  455   HG22  ILE  58          2HG2      ILE  58  -0.018   8.776   1.031
  456   HG23  ILE  58          3HG2      ILE  58   1.589   8.058   0.890
  457   HD11  ILE  58          3HD1      ILE  58  -2.416   8.484   3.532
  458   HD12  ILE  58          1HD1      ILE  58  -1.197   9.077   2.402
  459   HD13  ILE  58          2HD1      ILE  58  -0.750   8.703   4.066
  460    H    LEU  59           H        LEU  59   0.629   7.332  -1.382
  461    HA   LEU  59           HA       LEU  59   3.084   5.717  -1.611
  462    HG   LEU  59           HG       LEU  59   1.310   6.908  -5.309
  463    HB2  LEU  59           2HB      LEU  59   2.967   5.729  -3.933
  464    HB3  LEU  59           1HB      LEU  59   1.319   5.417  -3.434
  465   HD11  LEU  59          1HD1      LEU  59   0.024   8.733  -4.421
  466   HD12  LEU  59          2HD1      LEU  59   0.687   8.451  -2.813
  467   HD13  LEU  59          3HD1      LEU  59  -0.365   7.246  -3.556
  468   HD21  LEU  59          3HD2      LEU  59   2.673   8.643  -5.656
  469   HD22  LEU  59          1HD2      LEU  59   3.669   7.902  -4.407
  470   HD23  LEU  59          2HD2      LEU  59   2.555   9.202  -3.995
  471    H    ASN  60           H        ASN  60   4.987   6.770  -2.091
  472    HA   ASN  60           HA       ASN  60   4.859   9.713  -2.133
  473    HB2  ASN  60           2HB      ASN  60   7.105   8.105  -0.899
  474    HB3  ASN  60           1HB      ASN  60   6.860   9.848  -0.809
  475   HD21  ASN  60          1HD2      ASN  60   7.264   8.472   1.470
  476   HD22  ASN  60          2HD2      ASN  60   5.804   8.378   2.389
  477    H    SER  61           H        SER  61   5.171  10.121  -4.248
  478    HA   SER  61           HA       SER  61   7.706   9.187  -5.405
  479    HG   SER  61           HG       SER  61   5.749   7.028  -5.195
  480    HB2  SER  61           2HB      SER  61   5.491   8.899  -7.307
  481    HB3  SER  61           1HB      SER  61   6.855   7.830  -6.995
  482    HA   PRO  62           HA       PRO  62   7.826  13.326  -7.002
  483    HB2  PRO  62           2HB      PRO  62   9.830  12.980  -8.772
  484    HB3  PRO  62           1HB      PRO  62  10.068  13.049  -7.025
  485    HG2  PRO  62           2HG      PRO  62   9.847  10.634  -8.790
  486    HG3  PRO  62           1HG      PRO  62  11.053  10.990  -7.534
  487    HD2  PRO  62           2HD      PRO  62   8.969   9.398  -7.043
  488    HD3  PRO  62           1HD      PRO  62   9.576  10.519  -5.812
  489    H    ASP  63           H        ASP  63   6.869  10.627  -8.905
  490    HA   ASP  63           HA       ASP  63   5.884  12.510 -10.926
  491    HB2  ASP  63           2HB      ASP  63   6.431  10.820 -12.708
  492    HB3  ASP  63           1HB      ASP  63   7.836  11.574 -11.960
  493    H    GLU  64           H        GLU  64   3.870  11.918 -11.885
  494    HA   GLU  64           HA       GLU  64   2.183  10.335 -10.235
  495    HB2  GLU  64           2HB      GLU  64   1.802  11.582 -12.929
  496    HB3  GLU  64           1HB      GLU  64   0.711  10.292 -12.456
  497    HG2  GLU  64           2HG      GLU  64  -0.436  12.054 -11.627
  498    HG3  GLU  64           1HG      GLU  64   0.565  11.672 -10.220
  499    H    ASP  65           H        ASP  65   3.846   9.457 -13.295
  500    HA   ASP  65           HA       ASP  65   2.771   6.961 -13.738
  501    HB2  ASP  65           2HB      ASP  65   4.586   8.113 -15.076
  502    HB3  ASP  65           1HB      ASP  65   5.729   7.568 -13.849
  503    H    SER  66           H        SER  66   5.551   7.770 -11.692
  504    HA   SER  66           HA       SER  66   5.846   5.240 -10.474
  505    HG   SER  66           HG       SER  66   7.790   7.042 -11.337
  506    HB2  SER  66           2HB      SER  66   6.612   8.031  -9.611
  507    HB3  SER  66           1HB      SER  66   6.999   6.606  -8.644
  508    H    LEU  67           H        LEU  67   4.427   8.223  -9.306
  509    HA   LEU  67           HA       LEU  67   3.312   7.621  -6.937
  510    HG   LEU  67           HG       LEU  67   1.031   9.289  -6.535
  511    HB2  LEU  67           2HB      LEU  67   3.131   9.811  -7.766
  512    HB3  LEU  67           1HB      LEU  67   2.349   9.288  -9.229
  513   HD11  LEU  67          1HD1      LEU  67   1.483  11.403  -8.471
  514   HD12  LEU  67          2HD1      LEU  67   1.013  11.495  -6.773
  515   HD13  LEU  67          3HD1      LEU  67  -0.206  11.198  -8.013
  516   HD21  LEU  67          3HD2      LEU  67  -0.257   7.819  -7.738
  517   HD22  LEU  67          1HD2      LEU  67   0.128   8.589  -9.278
  518   HD23  LEU  67          2HD2      LEU  67  -1.012   9.351  -8.169
  519    H    ALA  68           H        ALA  68   1.481   7.216  -9.990
  520    HA   ALA  68           HA       ALA  68  -0.634   5.805  -8.742
  521    HB1  ALA  68           3HB      ALA  68   0.216   6.006 -11.633
  522    HB2  ALA  68           1HB      ALA  68  -1.066   6.902 -10.818
  523    HB3  ALA  68           2HB      ALA  68  -1.244   5.170 -11.101
  524    H    HIS  69           H        HIS  69   2.344   4.795 -10.333
  525    HA   HIS  69           HA       HIS  69   1.860   2.068 -10.597
  526    HD1  HIS  69           1HD      HIS  69   6.429   1.979 -11.368
  527    HD2  HIS  69           2HD      HIS  69   2.990  -0.061 -10.237
  528    HE1  HIS  69           1HE      HIS  69   6.994  -0.462 -11.581
  529    HE2  HIS  69           2HE      HIS  69   4.928  -1.677 -10.806
  530    HB2  HIS  69           2HB      HIS  69   3.874   3.298 -11.452
  531    HB3  HIS  69           1HB      HIS  69   4.499   3.317  -9.807
  532    H    MET  70           H        MET  70   2.808   3.976  -7.828
  533    HA   MET  70           HA       MET  70   3.192   1.691  -6.094
  534    HB2  MET  70           2HB      MET  70   2.862   4.504  -5.113
  535    HB3  MET  70           1HB      MET  70   3.889   3.239  -4.464
  536    HG2  MET  70           2HG      MET  70   4.622   4.015  -7.173
  537    HG3  MET  70           1HG      MET  70   4.694   5.345  -6.021
  538    HE1  MET  70           3HE      MET  70   7.482   1.826  -6.468
  539    HE2  MET  70           1HE      MET  70   6.128   2.320  -7.482
  540    HE3  MET  70           2HE      MET  70   5.838   1.370  -6.027
  541    H    GLN  71           H        GLN  71   0.816   4.420  -6.054
  542    HA   GLN  71           HA       GLN  71  -0.784   3.379  -4.057
  543    HB2  GLN  71           2HB      GLN  71  -2.691   4.657  -5.307
  544    HB3  GLN  71           1HB      GLN  71  -1.404   5.539  -4.513
  545    HG2  GLN  71           2HG      GLN  71  -0.841   6.505  -6.417
  546    HG3  GLN  71           1HG      GLN  71  -0.731   4.957  -7.247
  547   HE21  GLN  71          1HE2      GLN  71  -3.284   7.015  -5.888
  548   HE22  GLN  71          2HE2      GLN  71  -4.327   6.919  -7.261
  549    H    ASN  72           H        ASN  72  -0.590   2.412  -7.389
  550    HA   ASN  72           HA       ASN  72  -3.075   0.944  -7.313
  551    HB2  ASN  72           2HB      ASN  72  -1.781   2.005  -9.374
  552    HB3  ASN  72           1HB      ASN  72  -1.024   0.415  -9.411
  553   HD21  ASN  72          1HD2      ASN  72  -2.681  -1.419  -9.170
  554   HD22  ASN  72          2HD2      ASN  72  -4.087  -1.283 -10.165
  555    H    VAL  73           H        VAL  73   0.388   0.164  -7.224
  556    HA   VAL  73           HA       VAL  73   0.395  -2.553  -7.341
  557    HB   VAL  73           HB       VAL  73   2.036  -0.641  -5.711
  558   HG11  VAL  73          1HG1      VAL  73   2.294  -3.644  -5.667
  559   HG12  VAL  73          2HG1      VAL  73   1.992  -2.576  -4.296
  560   HG13  VAL  73          3HG1      VAL  73   3.547  -2.527  -5.126
  561   HG21  VAL  73          3HG2      VAL  73   3.233  -2.522  -7.638
  562   HG22  VAL  73          1HG2      VAL  73   3.543  -0.805  -7.380
  563   HG23  VAL  73          2HG2      VAL  73   2.135  -1.316  -8.312
  564    H    VAL  74           H        VAL  74  -0.388  -0.574  -4.508
  565    HA   VAL  74           HA       VAL  74  -0.810  -2.807  -2.774
  566    HB   VAL  74           HB       VAL  74  -1.793   0.034  -2.502
  567   HG11  VAL  74          1HG1      VAL  74  -3.047  -1.710  -1.167
  568   HG12  VAL  74          2HG1      VAL  74  -2.306  -0.410  -0.237
  569   HG13  VAL  74          3HG1      VAL  74  -1.540  -1.996  -0.297
  570   HG21  VAL  74          3HG2      VAL  74   0.278   0.578  -1.923
  571   HG22  VAL  74          1HG2      VAL  74   0.810  -1.077  -2.226
  572   HG23  VAL  74          2HG2      VAL  74   0.234  -0.615  -0.627
  573    H    ALA  75           H        ALA  75  -3.030  -0.670  -4.602
  574    HA   ALA  75           HA       ALA  75  -5.463  -1.628  -3.772
  575    HB1  ALA  75           3HB      ALA  75  -4.641  -0.829  -6.563
  576    HB2  ALA  75           1HB      ALA  75  -5.328   0.215  -5.317
  577    HB3  ALA  75           2HB      ALA  75  -6.307  -1.062  -6.039
  578    H    ASP  76           H        ASP  76  -3.071  -3.154  -5.744
  579    HA   ASP  76           HA       ASP  76  -4.773  -5.251  -6.726
  580    HB2  ASP  76           2HB      ASP  76  -2.354  -4.284  -7.510
  581    HB3  ASP  76           1HB      ASP  76  -1.861  -5.735  -6.643
  582    H    HIS  77           H        HIS  77  -2.382  -4.936  -4.125
  583    HA   HIS  77           HA       HIS  77  -2.347  -7.604  -3.301
  584    HD1  HIS  77           1HD      HIS  77  -0.723  -6.478  -4.604
  585    HD2  HIS  77           2HD      HIS  77   0.920  -4.736  -1.209
  586    HE1  HIS  77           1HE      HIS  77   1.564  -5.691  -5.292
  587    HE2  HIS  77           2HE      HIS  77   2.509  -4.571  -3.242
  588    HB2  HIS  77           2HB      HIS  77  -2.015  -5.194  -1.505
  589    HB3  HIS  77           1HB      HIS  77  -1.408  -6.815  -1.219
  590    H    LEU  78           H        LEU  78  -4.516  -4.967  -2.346
  591    HA   LEU  78           HA       LEU  78  -5.913  -6.433  -0.373
  592    HG   LEU  78           HG       LEU  78  -5.057  -3.227  -0.600
  593    HB2  LEU  78           2HB      LEU  78  -6.727  -4.048  -2.042
  594    HB3  LEU  78           1HB      LEU  78  -7.685  -4.683  -0.722
  595   HD11  LEU  78          1HD1      LEU  78  -7.605  -2.853   0.953
  596   HD12  LEU  78          2HD1      LEU  78  -7.244  -2.022  -0.559
  597   HD13  LEU  78          3HD1      LEU  78  -6.225  -1.760   0.856
  598   HD21  LEU  78          3HD2      LEU  78  -5.361  -3.754   1.955
  599   HD22  LEU  78          1HD2      LEU  78  -4.494  -4.875   0.906
  600   HD23  LEU  78          2HD2      LEU  78  -6.169  -5.197   1.347
  601    H    GLN  79           H        GLN  79  -6.050  -6.346  -3.830
  602    HA   GLN  79           HA       GLN  79  -8.687  -7.413  -4.079
  603    HB2  GLN  79           2HB      GLN  79  -7.678  -6.109  -5.875
  604    HB3  GLN  79           1HB      GLN  79  -6.424  -7.321  -6.074
  605    HG2  GLN  79           2HG      GLN  79  -7.780  -8.754  -7.182
  606    HG3  GLN  79           1HG      GLN  79  -9.223  -8.242  -6.306
  607   HE21  GLN  79          1HE2      GLN  79  -8.626  -8.594  -9.207
  608   HE22  GLN  79          2HE2      GLN  79  -9.079  -7.095  -9.938
  609    H    ARG  80           H        ARG  80  -5.424  -8.889  -4.180
  610    HA   ARG  80           HA       ARG  80  -6.382 -11.461  -4.842
  611    HE   ARG  80           HE       ARG  80  -2.242 -13.949  -2.500
  612    HB2  ARG  80           2HB      ARG  80  -4.216 -12.120  -4.833
  613    HB3  ARG  80           1HB      ARG  80  -3.935 -10.389  -4.861
  614    HG2  ARG  80           2HG      ARG  80  -3.324 -10.337  -2.612
  615    HG3  ARG  80           1HG      ARG  80  -4.049 -11.907  -2.275
  616    HD2  ARG  80           2HD      ARG  80  -1.770 -11.626  -4.202
  617    HD3  ARG  80           1HD      ARG  80  -1.488 -11.742  -2.468
  618   HH11  ARG  80          1HH1      ARG  80  -2.454 -12.503  -5.677
  619   HH12  ARG  80          2HH1      ARG  80  -2.645 -14.021  -6.485
  620   HH21  ARG  80          1HH2      ARG  80  -2.496 -15.938  -3.570
  621   HH22  ARG  80          2HH2      ARG  80  -2.670 -15.967  -5.292
  622    H    MET  81           H        MET  81  -6.100  -9.734  -1.837
  623    HA   MET  81           HA       MET  81  -6.467 -12.117  -0.245
  624    HB2  MET  81           2HB      MET  81  -6.505 -10.595   1.672
  625    HB3  MET  81           1HB      MET  81  -5.113 -10.319   0.645
  626    HG2  MET  81           2HG      MET  81  -5.888  -8.203   1.311
  627    HG3  MET  81           1HG      MET  81  -6.356  -8.394  -0.374
  628    HE1  MET  81           3HE      MET  81  -7.676  -6.429   2.290
  629    HE2  MET  81           1HE      MET  81  -9.194  -6.240   1.411
  630    HE3  MET  81           2HE      MET  81  -7.660  -6.158   0.548
  631    H    ALA  82           H        ALA  82  -8.498  -9.970  -1.927
  632    HA   ALA  82           HA       ALA  82 -10.844 -11.197  -0.659
  633    HB1  ALA  82           3HB      ALA  82 -11.944  -8.869  -0.762
  634    HB2  ALA  82           1HB      ALA  82 -10.292  -8.250  -0.800
  635    HB3  ALA  82           2HB      ALA  82 -10.840  -9.216   0.570
  636    H    ASN  83           H        ASN  83 -11.739 -12.222  -2.332
  637    HA   ASN  83           HA       ASN  83 -11.640 -11.057  -5.000
  638    HB2  ASN  83           2HB      ASN  83 -12.866 -13.700  -4.212
  639    HB3  ASN  83           1HB      ASN  83 -12.330 -13.192  -5.811
  640   HD21  ASN  83          1HD2      ASN  83 -11.325 -14.252  -2.652
  641   HD22  ASN  83          2HD2      ASN  83  -9.706 -14.666  -3.087
  642    H    SER  84           H        SER  84 -13.922 -12.060  -6.142
  643    HA   SER  84           HA       SER  84 -16.204 -11.870  -6.324
  644    HG   SER  84           HG       SER  84 -16.659 -13.112  -3.724
  645    HB2  SER  84           2HB      SER  84 -16.384 -10.340  -3.743
  646    HB3  SER  84           1HB      SER  84 -17.598 -11.359  -4.514
  647    H    GLU  85           H        GLU  85 -13.997  -9.334  -5.822
  648    HA   GLU  85           HA       GLU  85 -15.258  -7.683  -7.746
  649    HB2  GLU  85           2HB      GLU  85 -15.812  -5.765  -6.365
  650    HB3  GLU  85           1HB      GLU  85 -16.717  -7.170  -5.819
  651    HG2  GLU  85           2HG      GLU  85 -15.100  -7.487  -4.001
  652    HG3  GLU  85           1HG      GLU  85 -14.235  -6.048  -4.537
  653    H    SER  86           H        SER  86 -13.912  -6.004  -8.459
  654    HA   SER  86           HA       SER  86 -11.136  -6.368  -7.867
  655    HG   SER  86           HG       SER  86 -11.855  -6.791 -10.191
  656    HB2  SER  86           2HB      SER  86 -12.350  -4.105  -9.461
  657    HB3  SER  86           1HB      SER  86 -10.719  -4.763  -9.590
  658    H    LEU  87           H        LEU  87 -11.492  -5.926  -5.537
  659    HA   LEU  87           HA       LEU  87 -11.707  -4.533  -3.693
  660    HG   LEU  87           HG       LEU  87  -8.248  -4.681  -3.004
  661    HB2  LEU  87           2HB      LEU  87  -9.191  -4.393  -5.031
  662    HB3  LEU  87           1HB      LEU  87  -9.544  -2.813  -4.352
  663   HD11  LEU  87          1HD1      LEU  87  -9.274  -3.566  -0.905
  664   HD12  LEU  87          2HD1      LEU  87 -10.169  -2.591  -2.069
  665   HD13  LEU  87          3HD1      LEU  87  -8.405  -2.567  -2.071
  666   HD21  LEU  87          3HD2      LEU  87 -10.170  -6.273  -3.103
  667   HD22  LEU  87          1HD2      LEU  87 -11.078  -5.148  -2.092
  668   HD23  LEU  87          2HD2      LEU  87  -9.611  -5.900  -1.474
  669    H    GLU  88           H        GLU  88 -13.321  -3.134  -3.413
  670    HA   GLU  88           HA       GLU  88 -13.671  -0.839  -5.100
  671    HB2  GLU  88           2HB      GLU  88 -15.553  -1.951  -3.885
  672    HB3  GLU  88           1HB      GLU  88 -14.851  -1.408  -2.366
  673    HG2  GLU  88           2HG      GLU  88 -15.623   0.682  -2.607
  674    HG3  GLU  88           1HG      GLU  88 -15.307   0.712  -4.341
  675    H    ILE  89           H        ILE  89 -11.879   0.466  -5.047
  676    HA   ILE  89           HA       ILE  89 -11.218   1.607  -2.427
  677    HB   ILE  89           HB       ILE  89  -8.895   1.531  -2.790
  678   HG12  ILE  89          2HG1      ILE  89  -9.212   2.115  -5.352
  679   HG13  ILE  89          1HG1      ILE  89  -7.762   1.306  -4.787
  680   HG21  ILE  89          1HG2      ILE  89  -8.435  -0.863  -3.382
  681   HG22  ILE  89          2HG2      ILE  89 -10.156  -1.016  -3.738
  682   HG23  ILE  89          3HG2      ILE  89  -9.626  -0.598  -2.109
  683   HD11  ILE  89          3HD1      ILE  89  -8.627   0.317  -6.838
  684   HD12  ILE  89          1HD1      ILE  89 -10.143  -0.057  -6.019
  685   HD13  ILE  89          2HD1      ILE  89  -8.645  -0.832  -5.500
  686    H    ALA  90           H        ALA  90 -11.258   3.833  -2.361
  687    HA   ALA  90           HA       ALA  90 -11.573   5.186  -4.942
  688    HB1  ALA  90           3HB      ALA  90 -12.503   7.025  -3.797
  689    HB2  ALA  90           1HB      ALA  90 -11.872   6.488  -2.241
  690    HB3  ALA  90           2HB      ALA  90 -13.192   5.604  -3.014
  691    H    TRP  91           H        TRP  91  -9.747   5.782  -5.841
  692    HA   TRP  91           HA       TRP  91  -7.470   6.502  -4.179
  693    HD1  TRP  91           HD       TRP  91  -9.688   6.948  -7.271
  694    HE1  TRP  91           1HE      TRP  91  -9.813   7.031  -9.837
  695    HE3  TRP  91           3HE      TRP  91  -5.006   5.215  -8.370
  696    HZ2  TRP  91           2HZ      TRP  91  -8.151   6.441 -12.039
  697    HZ3  TRP  91           3HZ      TRP  91  -4.353   5.003 -10.732
  698    HH2  TRP  91           HH       TRP  91  -5.894   5.603 -12.529
  699    HB2  TRP  91           2HB      TRP  91  -6.139   6.365  -6.199
  700    HB3  TRP  91           1HB      TRP  91  -7.133   4.923  -6.042
  701    H    GLN  92           H        GLN  92  -6.672   8.478  -3.939
  702    HA   GLN  92           HA       GLN  92  -8.172  10.696  -5.079
  703    HB2  GLN  92           2HB      GLN  92  -5.976  10.603  -3.004
  704    HB3  GLN  92           1HB      GLN  92  -6.763  12.080  -3.539
  705    HG2  GLN  92           2HG      GLN  92  -8.808  11.476  -2.579
  706    HG3  GLN  92           1HG      GLN  92  -8.325   9.790  -2.404
  707   HE21  GLN  92          1HE2      GLN  92  -9.215  10.398  -0.200
  708   HE22  GLN  92          2HE2      GLN  92  -8.065  10.961   0.961
  709    HA   PRO  93           HA       PRO  93  -5.520  11.913  -8.366
  710    HB2  PRO  93           2HB      PRO  93  -5.267  14.523  -6.957
  711    HB3  PRO  93           1HB      PRO  93  -5.684  14.195  -8.642
  712    HG2  PRO  93           2HG      PRO  93  -7.568  14.881  -6.886
  713    HG3  PRO  93           1HG      PRO  93  -7.883  13.664  -8.135
  714    HD2  PRO  93           2HD      PRO  93  -7.429  13.309  -5.219
  715    HD3  PRO  93           1HD      PRO  93  -8.416  12.347  -6.335
  716    H    ALA  94           H        ALA  94  -4.488  12.942  -5.131
  717    HA   ALA  94           HA       ALA  94  -2.465  12.371  -4.104
  718    HB1  ALA  94           3HB      ALA  94  -0.693  11.382  -5.168
  719    HB2  ALA  94           1HB      ALA  94  -0.942  12.298  -6.653
  720    HB3  ALA  94           2HB      ALA  94  -1.993  10.935  -6.275
  721    H    GLU  95           H        GLU  95  -3.564  14.876  -4.554
  722    HA   GLU  95           HA       GLU  95  -1.127  16.504  -4.792
  723    HB2  GLU  95           2HB      GLU  95  -3.009  16.560  -6.718
  724    HB3  GLU  95           1HB      GLU  95  -3.682  17.759  -5.622
  725    HG2  GLU  95           2HG      GLU  95  -1.806  19.153  -5.821
  726    HG3  GLU  95           1HG      GLU  95  -0.834  17.877  -6.551
  727    H    SER  96           H        SER  96  -0.849  18.026  -3.249
  728    HA   SER  96           HA       SER  96  -3.084  18.783  -1.539
  729    HG   SER  96           HG       SER  96  -1.233  18.056   1.506
  730    HB2  SER  96           2HB      SER  96  -2.190  16.850  -0.378
  731    HB3  SER  96           1HB      SER  96  -0.553  17.497  -0.490
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1   6.951  13.346  -5.102
    2    HB2  MET   1           2HB      MET   1   7.620  13.632  -2.812
    3    HB3  MET   1           1HB      MET   1   8.896  14.237  -3.861
    4    HG2  MET   1           2HG      MET   1   8.744  16.309  -3.044
    5    HG3  MET   1           1HG      MET   1   6.984  16.286  -3.041
    6    HE1  MET   1           3HE      MET   1   5.736  14.494  -0.966
    7    HE2  MET   1           1HE      MET   1   5.615  16.243  -1.156
    8    HE3  MET   1           2HE      MET   1   5.953  15.551   0.430
    9    H    PHE   2           H        PHE   2   4.859  13.356  -5.634
   10    HA   PHE   2           HA       PHE   2   3.017  15.132  -4.198
   11    HD1  PHE   2           1HD      PHE   2   3.471  16.548  -6.630
   12    HD2  PHE   2           2HD      PHE   2   3.023  12.572  -8.083
   13    HE1  PHE   2           1HE      PHE   2   4.781  17.134  -8.628
   14    HE2  PHE   2           2HE      PHE   2   4.325  13.153 -10.081
   15    HZ   PHE   2           HZ       PHE   2   5.212  15.434 -10.358
   16    HB2  PHE   2           2HB      PHE   2   1.934  13.185  -6.154
   17    HB3  PHE   2           1HB      PHE   2   1.541  14.885  -5.931
   18    H    ARG   3           H        ARG   3   0.874  13.930  -3.471
   19    HA   ARG   3           HA       ARG   3   1.444  11.206  -2.648
   20    HE   ARG   3           HE       ARG   3   4.720  10.771   1.459
   21    HB2  ARG   3           2HB      ARG   3   1.979  13.305  -0.858
   22    HB3  ARG   3           1HB      ARG   3   0.477  12.574  -0.301
   23    HG2  ARG   3           2HG      ARG   3   1.760  11.082   0.717
   24    HG3  ARG   3           1HG      ARG   3   2.044  10.400  -0.869
   25    HD2  ARG   3           2HD      ARG   3   4.198  10.928  -0.749
   26    HD3  ARG   3           1HD      ARG   3   3.796  12.623  -0.476
   27   HH11  ARG   3          1HH1      ARG   3   2.544  13.469   1.051
   28   HH12  ARG   3          2HH1      ARG   3   2.631  13.951   2.712
   29   HH21  ARG   3          1HH2      ARG   3   4.835  11.405   3.645
   30   HH22  ARG   3          2HH2      ARG   3   3.932  12.780   4.184
   31    H    SER   4           H        SER   4  -0.273   9.986  -2.822
   32    HA   SER   4           HA       SER   4  -2.966  11.169  -2.694
   33    HG   SER   4           HG       SER   4  -4.488   9.003  -4.243
   34    HB2  SER   4           2HB      SER   4  -2.981  10.382  -4.864
   35    HB3  SER   4           1HB      SER   4  -1.721   9.185  -4.544
   36    H    THR   5           H        THR   5  -4.657   9.541  -1.935
   37    HA   THR   5           HA       THR   5  -3.533   7.430  -0.292
   38    HB   THR   5           HB       THR   5  -4.561   8.128   1.765
   39    HG1  THR   5           1HG      THR   5  -6.366   9.167   1.364
   40   HG21  THR   5          3HG2      THR   5  -3.251   9.885   2.413
   41   HG22  THR   5          1HG2      THR   5  -3.426  10.736   0.881
   42   HG23  THR   5          2HG2      THR   5  -2.373   9.325   0.993
   43    H    SER   6           H        SER   6  -4.675   5.642  -0.383
   44    HA   SER   6           HA       SER   6  -7.485   5.825  -1.265
   45    HG   SER   6           HG       SER   6  -8.042   3.206  -1.496
   46    HB2  SER   6           2HB      SER   6  -5.916   4.571  -2.762
   47    HB3  SER   6           1HB      SER   6  -5.641   3.429  -1.447
   48    H    HIS   7           H        HIS   7  -9.045   5.225   0.113
   49    HA   HIS   7           HA       HIS   7  -8.255   3.743   2.544
   50    HD1  HIS   7           1HD      HIS   7  -9.853   6.856   5.066
   51    HD2  HIS   7           2HD      HIS   7 -10.142   2.767   4.386
   52    HE1  HIS   7           1HE      HIS   7 -10.167   5.816   7.333
   53    HE2  HIS   7           2HE      HIS   7 -10.426   3.351   6.886
   54    HB2  HIS   7           2HB      HIS   7  -9.173   6.163   2.700
   55    HB3  HIS   7           1HB      HIS   7 -10.734   5.434   2.347
   56    H    VAL   8           H        VAL   8  -9.181   1.809   2.949
   57    HA   VAL   8           HA       VAL   8 -11.702   1.115   1.616
   58    HB   VAL   8           HB       VAL   8  -9.484  -0.907   1.680
   59   HG11  VAL   8          1HG1      VAL   8 -10.735  -1.971  -0.069
   60   HG12  VAL   8          2HG1      VAL   8 -11.825  -0.590  -0.194
   61   HG13  VAL   8          3HG1      VAL   8 -11.835  -1.593   1.258
   62   HG21  VAL   8          3HG2      VAL   8  -9.994   0.907  -0.670
   63   HG22  VAL   8          1HG2      VAL   8  -8.735  -0.316  -0.499
   64   HG23  VAL   8          2HG2      VAL   8  -8.681   1.147   0.482
   65    H    ARG   9           H        ARG   9 -12.859  -0.644   2.644
   66    HA   ARG   9           HA       ARG   9 -12.077  -0.934   5.458
   67    HE   ARG   9           HE       ARG   9 -15.241   2.273   6.783
   68    HB2  ARG   9           2HB      ARG   9 -14.693  -0.987   4.054
   69    HB3  ARG   9           1HB      ARG   9 -14.515  -2.060   5.431
   70    HG2  ARG   9           2HG      ARG   9 -15.456  -0.030   6.217
   71    HG3  ARG   9           1HG      ARG   9 -13.785  -0.096   6.780
   72    HD2  ARG   9           2HD      ARG   9 -13.090   1.555   5.319
   73    HD3  ARG   9           1HD      ARG   9 -14.432   1.280   4.210
   74   HH11  ARG   9          1HH1      ARG   9 -14.139   3.156   3.591
   75   HH12  ARG   9          2HH1      ARG   9 -14.832   4.741   3.654
   76   HH21  ARG   9          1HH2      ARG   9 -16.153   4.359   6.867
   77   HH22  ARG   9          2HH2      ARG   9 -15.975   5.425   5.514
   78    H    THR  10           H        THR  10 -10.771  -2.631   5.745
   79    HA   THR  10           HA       THR  10 -11.611  -5.229   4.648
   80    HB   THR  10           HB       THR  10  -9.313  -3.794   3.916
   81    HG1  THR  10           1HG      THR  10 -10.063  -5.171   2.468
   82   HG21  THR  10          3HG2      THR  10  -7.461  -4.791   4.707
   83   HG22  THR  10          1HG2      THR  10  -8.278  -6.325   5.012
   84   HG23  THR  10          2HG2      THR  10  -8.475  -4.980   6.143
   85    H    GLU  11           H        GLU  11 -10.878  -7.110   5.893
   86    HA   GLU  11           HA       GLU  11 -10.554  -6.430   8.739
   87    HB2  GLU  11           2HB      GLU  11 -12.265  -8.244   7.373
   88    HB3  GLU  11           1HB      GLU  11 -11.183  -9.186   8.390
   89    HG2  GLU  11           2HG      GLU  11 -12.258  -8.587  10.231
   90    HG3  GLU  11           1HG      GLU  11 -12.192  -6.881   9.791
   91    H    SER  12           H        SER  12  -8.980  -7.436  10.025
   92    HA   SER  12           HA       SER  12  -6.949  -8.312  10.515
   93    HG   SER  12           HG       SER  12  -5.606 -10.359   8.411
   94    HB2  SER  12           2HB      SER  12  -7.879 -10.443  10.097
   95    HB3  SER  12           1HB      SER  12  -7.840 -10.210   8.349
   96    H    ALA  13           H        ALA  13  -7.207  -6.198   8.513
   97    HA   ALA  13           HA       ALA  13  -5.503  -6.356   6.342
   98    HB1  ALA  13           3HB      ALA  13  -5.299  -3.975   6.459
   99    HB2  ALA  13           1HB      ALA  13  -5.758  -3.999   8.152
  100    HB3  ALA  13           2HB      ALA  13  -6.939  -4.424   6.925
  101    H    ALA  14           H        ALA  14  -4.592  -5.308   9.602
  102    HA   ALA  14           HA       ALA  14  -2.003  -4.610   9.295
  103    HB1  ALA  14           3HB      ALA  14  -3.153  -6.221  11.557
  104    HB2  ALA  14           1HB      ALA  14  -3.108  -4.463  11.399
  105    HB3  ALA  14           2HB      ALA  14  -1.607  -5.370  11.604
  106    H    ARG  15           H        ARG  15  -3.107  -7.927   8.955
  107    HA   ARG  15           HA       ARG  15  -0.444  -8.999   9.221
  108    HE   ARG  15           HE       ARG  15  -0.028 -13.901   7.415
  109    HB2  ARG  15           2HB      ARG  15  -2.640 -10.200   9.772
  110    HB3  ARG  15           1HB      ARG  15  -2.799 -10.456   8.042
  111    HG2  ARG  15           2HG      ARG  15  -0.439 -11.323   9.692
  112    HG3  ARG  15           1HG      ARG  15  -1.796 -12.359   9.264
  113    HD2  ARG  15           2HD      ARG  15  -0.882 -11.224   6.858
  114    HD3  ARG  15           1HD      ARG  15   0.558 -11.713   7.740
  115   HH11  ARG  15          1HH1      ARG  15  -2.790 -11.891   6.714
  116   HH12  ARG  15          2HH1      ARG  15  -3.738 -13.198   6.091
  117   HH21  ARG  15          1HH2      ARG  15  -1.271 -15.619   6.592
  118   HH22  ARG  15          2HH2      ARG  15  -2.876 -15.313   6.018
  119    H    TYR  16           H        TYR  16  -2.641  -8.225   6.576
  120    HA   TYR  16           HA       TYR  16  -1.018  -9.317   4.524
  121    HD1  TYR  16           1HD      TYR  16  -2.682 -10.669   4.658
  122    HD2  TYR  16           2HD      TYR  16  -5.170  -7.471   3.349
  123    HE1  TYR  16           1HE      TYR  16  -4.614 -12.162   4.687
  124    HE2  TYR  16           2HE      TYR  16  -7.110  -8.968   3.388
  125    HH   TYR  16           HH       TYR  16  -7.671 -11.228   4.750
  126    HB2  TYR  16           2HB      TYR  16  -2.967  -7.008   4.333
  127    HB3  TYR  16           1HB      TYR  16  -2.271  -7.866   2.969
  128    H    VAL  17           H        VAL  17  -0.763  -6.456   6.441
  129    HA   VAL  17           HA       VAL  17   1.104  -5.159   4.643
  130    HB   VAL  17           HB       VAL  17  -0.033  -4.442   7.316
  131   HG11  VAL  17          1HG1      VAL  17   1.686  -2.391   6.929
  132   HG12  VAL  17          2HG1      VAL  17   2.686  -3.742   6.411
  133   HG13  VAL  17          3HG1      VAL  17   1.993  -3.726   8.034
  134   HG21  VAL  17          3HG2      VAL  17  -0.567  -2.386   6.231
  135   HG22  VAL  17          1HG2      VAL  17  -1.054  -3.718   5.178
  136   HG23  VAL  17          2HG2      VAL  17   0.423  -2.814   4.836
  137    H    ASN  18           H        ASN  18   1.168  -6.984   7.658
  138    HA   ASN  18           HA       ASN  18   3.937  -6.731   8.132
  139    HB2  ASN  18           2HB      ASN  18   1.799  -8.587   9.123
  140    HB3  ASN  18           1HB      ASN  18   3.483  -8.873   9.541
  141   HD21  ASN  18          1HD2      ASN  18   1.737  -5.809   9.200
  142   HD22  ASN  18          2HD2      ASN  18   1.984  -5.293  10.827
  143    H    ARG  19           H        ARG  19   2.041  -8.988   6.210
  144    HA   ARG  19           HA       ARG  19   4.221 -10.836   5.906
  145    HE   ARG  19           HE       ARG  19   2.461 -15.274   4.961
  146    HB2  ARG  19           2HB      ARG  19   1.542 -11.085   5.707
  147    HB3  ARG  19           1HB      ARG  19   1.968 -10.952   4.006
  148    HG2  ARG  19           2HG      ARG  19   2.592 -13.065   3.978
  149    HG3  ARG  19           1HG      ARG  19   3.779 -12.749   5.240
  150    HD2  ARG  19           2HD      ARG  19   2.130 -13.162   6.948
  151    HD3  ARG  19           1HD      ARG  19   0.873 -13.349   5.729
  152   HH11  ARG  19          1HH1      ARG  19   1.668 -14.383   8.248
  153   HH12  ARG  19          2HH1      ARG  19   1.868 -15.989   8.858
  154   HH21  ARG  19          1HH2      ARG  19   2.723 -17.380   5.770
  155   HH22  ARG  19          2HH2      ARG  19   2.467 -17.689   7.455
  156    H    LEU  20           H        LEU  20   3.278  -7.968   4.273
  157    HA   LEU  20           HA       LEU  20   4.234  -8.587   1.689
  158    HG   LEU  20           HG       LEU  20   1.787  -6.719   2.863
  159    HB2  LEU  20           2HB      LEU  20   3.977  -5.919   3.059
  160    HB3  LEU  20           1HB      LEU  20   4.312  -6.130   1.353
  161   HD11  LEU  20          1HD1      LEU  20   2.061  -5.299   0.241
  162   HD12  LEU  20          2HD1      LEU  20   2.431  -4.463   1.748
  163   HD13  LEU  20          3HD1      LEU  20   0.816  -5.121   1.478
  164   HD21  LEU  20          3HD2      LEU  20   0.926  -7.600   0.631
  165   HD22  LEU  20          1HD2      LEU  20   1.961  -8.682   1.557
  166   HD23  LEU  20          2HD2      LEU  20   2.614  -7.806   0.173
  167    H    CYS  21           H        CYS  21   5.828  -6.885   4.400
  168    HA   CYS  21           HA       CYS  21   8.213  -6.331   3.065
  169    HG   CYS  21           HG       CYS  21   7.171  -4.285   4.943
  170    HB2  CYS  21           2HB      CYS  21   8.116  -7.054   5.995
  171    HB3  CYS  21           1HB      CYS  21   9.204  -5.938   5.188
  172    H    LYS  22           H        LYS  22   7.050  -9.263   4.545
  173    HA   LYS  22           HA       LYS  22   9.588 -10.624   4.237
  174    HB2  LYS  22           2HB      LYS  22   6.878 -11.731   4.984
  175    HB3  LYS  22           1HB      LYS  22   8.418 -12.567   5.132
  176    HG2  LYS  22           2HG      LYS  22   8.894 -11.585   7.080
  177    HG3  LYS  22           1HG      LYS  22   8.367  -9.998   6.520
  178    HD2  LYS  22           2HD      LYS  22   6.924 -10.608   8.303
  179    HD3  LYS  22           1HD      LYS  22   5.999 -10.803   6.813
  180    HE2  LYS  22           2HE      LYS  22   5.520 -12.723   8.063
  181    HE3  LYS  22           1HE      LYS  22   6.723 -13.245   6.884
  182    HZ1  LYS  22           3HZ      LYS  22   8.378 -12.690   8.768
  183    HZ2  LYS  22           1HZ      LYS  22   7.512 -14.143   8.833
  184    HZ3  LYS  22           2HZ      LYS  22   7.030 -12.826   9.780
  185    H    HIS  23           H        HIS  23   6.747 -10.051   2.387
  186    HA   HIS  23           HA       HIS  23   7.065 -12.339   0.664
  187    HD1  HIS  23           1HD      HIS  23   6.239 -11.625  -2.197
  188    HD2  HIS  23           2HD      HIS  23   3.011 -12.778   0.153
  189    HE1  HIS  23           1HE      HIS  23   4.892 -13.196  -3.628
  190    HE2  HIS  23           2HE      HIS  23   2.900 -13.815  -2.216
  191    HB2  HIS  23           2HB      HIS  23   4.853 -11.191   1.322
  192    HB3  HIS  23           1HB      HIS  23   5.276  -9.989   0.108
  193    H    TRP  24           H        TRP  24   7.082  -8.785   0.055
  194    HA   TRP  24           HA       TRP  24   8.485  -9.288  -2.446
  195    HD1  TRP  24           HD       TRP  24   4.907  -6.494  -1.599
  196    HE1  TRP  24           1HE      TRP  24   3.166  -7.541  -3.180
  197    HE3  TRP  24           3HE      TRP  24   8.012  -9.449  -4.385
  198    HZ2  TRP  24           2HZ      TRP  24   3.116  -9.376  -5.324
  199    HZ3  TRP  24           3HZ      TRP  24   7.038 -10.820  -6.181
  200    HH2  TRP  24           HH       TRP  24   4.640 -10.784  -6.639
  201    HB2  TRP  24           2HB      TRP  24   7.413  -6.752  -1.206
  202    HB3  TRP  24           1HB      TRP  24   8.219  -6.827  -2.769
  203    H    GLY  25           H        GLY  25   9.397  -8.677   0.778
  204    HA2  GLY  25           2HA      GLY  25  11.638  -6.988   0.318
  205    HA3  GLY  25           1HA      GLY  25  11.369  -7.982   1.736
  206    H    HIS  26           H        HIS  26  12.163  -8.440  -1.708
  207    HA   HIS  26           HA       HIS  26  14.078 -10.514  -0.875
  208    HD1  HIS  26           1HD      HIS  26  14.242 -13.173  -3.644
  209    HD2  HIS  26           2HD      HIS  26  11.437 -12.206  -0.734
  210    HE1  HIS  26           1HE      HIS  26  13.584 -15.360  -2.593
  211    HE2  HIS  26           2HE      HIS  26  11.951 -14.742  -0.776
  212    HB2  HIS  26           2HB      HIS  26  12.127 -10.374  -3.032
  213    HB3  HIS  26           1HB      HIS  26  13.738 -10.760  -3.628
  214    H    LYS  27           H        LYS  27  13.634  -7.557  -2.675
  215    HA   LYS  27           HA       LYS  27  16.535  -7.230  -2.796
  216    HB2  LYS  27           2HB      LYS  27  16.095  -8.296  -4.916
  217    HB3  LYS  27           1HB      LYS  27  14.750  -7.217  -5.242
  218    HG2  LYS  27           2HG      LYS  27  17.279  -5.810  -4.832
  219    HG3  LYS  27           1HG      LYS  27  17.304  -6.936  -6.189
  220    HD2  LYS  27           2HD      LYS  27  14.972  -5.106  -5.884
  221    HD3  LYS  27           1HD      LYS  27  16.493  -4.452  -6.496
  222    HE2  LYS  27           2HE      LYS  27  15.893  -6.935  -7.805
  223    HE3  LYS  27           1HE      LYS  27  14.513  -5.844  -7.925
  224    HZ1  LYS  27           3HZ      LYS  27  17.181  -4.774  -8.491
  225    HZ2  LYS  27           1HZ      LYS  27  15.684  -4.348  -9.156
  226    HZ3  LYS  27           2HZ      LYS  27  16.458  -5.767  -9.656
  227    H    PHE  28           H        PHE  28  14.041  -6.004  -1.520
  228    HA   PHE  28           HA       PHE  28  14.767  -3.245  -2.139
  229    HD1  PHE  28           2HD      PHE  28  13.399  -1.275  -3.616
  230    HD2  PHE  28           1HD      PHE  28  12.193  -5.272  -4.442
  231    HE1  PHE  28           2HE      PHE  28  13.586  -0.829  -6.028
  232    HE2  PHE  28           1HE      PHE  28  12.378  -4.833  -6.856
  233    HZ   PHE  28           HZ       PHE  28  13.075  -2.610  -7.652
  234    HB2  PHE  28           2HB      PHE  28  11.999  -4.406  -2.258
  235    HB3  PHE  28           1HB      PHE  28  12.255  -2.696  -1.923
  236    H    GLU  29           H        GLU  29  14.222  -1.730  -0.483
  237    HA   GLU  29           HA       GLU  29  14.564  -2.858   2.141
  238    HB2  GLU  29           2HB      GLU  29  14.396  -0.402   2.833
  239    HB3  GLU  29           1HB      GLU  29  15.744  -0.854   1.798
  240    HG2  GLU  29           2HG      GLU  29  13.372  -0.016   0.327
  241    HG3  GLU  29           1HG      GLU  29  14.036   1.229   1.384
  242    H    VAL  30           H        VAL  30  12.850  -3.823   3.036
  243    HA   VAL  30           HA       VAL  30  10.286  -2.382   2.978
  244    HB   VAL  30           HB       VAL  30   9.509  -4.864   3.686
  245   HG11  VAL  30          1HG1      VAL  30   8.341  -3.852   1.973
  246   HG12  VAL  30          2HG1      VAL  30   9.102  -5.220   1.165
  247   HG13  VAL  30          3HG1      VAL  30   9.787  -3.606   0.992
  248   HG21  VAL  30          3HG2      VAL  30  10.664  -6.568   2.567
  249   HG22  VAL  30          1HG2      VAL  30  11.907  -5.634   3.397
  250   HG23  VAL  30          2HG2      VAL  30  11.656  -5.422   1.663
  251    H    GLU  31           H        GLU  31   9.716  -1.508   4.860
  252    HA   GLU  31           HA       GLU  31  10.879  -2.558   7.328
  253    HB2  GLU  31           2HB      GLU  31  10.334   0.047   6.382
  254    HB3  GLU  31           1HB      GLU  31   9.234  -0.228   7.725
  255    HG2  GLU  31           2HG      GLU  31  10.916  -0.370   9.258
  256    HG3  GLU  31           1HG      GLU  31  12.091  -0.953   8.080
  257    H    LEU  32           H        LEU  32   9.692  -3.496   8.895
  258    HA   LEU  32           HA       LEU  32   6.781  -3.697   8.434
  259    HG   LEU  32           HG       LEU  32   5.807  -6.296   8.477
  260    HB2  LEU  32           2HB      LEU  32   8.093  -5.825   8.091
  261    HB3  LEU  32           1HB      LEU  32   8.468  -5.805   9.803
  262   HD11  LEU  32          1HD1      LEU  32   7.837  -7.866   9.800
  263   HD12  LEU  32          2HD1      LEU  32   6.425  -8.392   8.885
  264   HD13  LEU  32          3HD1      LEU  32   6.278  -8.036  10.604
  265   HD21  LEU  32          3HD2      LEU  32   4.917  -6.368  10.860
  266   HD22  LEU  32          1HD2      LEU  32   5.184  -4.768  10.173
  267   HD23  LEU  32          2HD2      LEU  32   6.343  -5.445  11.318
  268    H    THR  33           H        THR  33   5.786  -2.430   9.801
  269    HA   THR  33           HA       THR  33   6.528  -2.596  12.669
  270    HB   THR  33           HB       THR  33   5.585  -0.161  12.706
  271    HG1  THR  33           1HG      THR  33   6.393  -0.384   9.998
  272   HG21  THR  33          3HG2      THR  33   7.760  -0.096  13.300
  273   HG22  THR  33          1HG2      THR  33   7.910   0.655  11.711
  274   HG23  THR  33          2HG2      THR  33   8.285  -1.057  11.916
  275    HA   PRO  34           HA       PRO  34   2.233  -3.463  13.193
  276    HB2  PRO  34           2HB      PRO  34   1.677  -2.427  15.614
  277    HB3  PRO  34           1HB      PRO  34   2.719  -3.833  15.398
  278    HG2  PRO  34           2HG      PRO  34   3.463  -0.991  15.918
  279    HG3  PRO  34           1HG      PRO  34   4.187  -2.475  16.561
  280    HD2  PRO  34           2HD      PRO  34   5.227  -1.006  14.471
  281    HD3  PRO  34           1HD      PRO  34   5.554  -2.729  14.748
  282    H    GLU  35           H        GLU  35   2.479  -1.426  11.472
  283    HA   GLU  35           HA       GLU  35   0.091   0.084  11.921
  284    HB2  GLU  35           2HB      GLU  35   2.757   1.505  11.797
  285    HB3  GLU  35           1HB      GLU  35   1.201   2.304  11.605
  286    HG2  GLU  35           2HG      GLU  35   0.630   1.329  13.897
  287    HG3  GLU  35           1HG      GLU  35   2.358   1.007  14.042
  288    H    ARG  36           H        ARG  36   2.980  -0.435   9.890
  289    HA   ARG  36           HA       ARG  36   1.390  -0.719   7.570
  290    HE   ARG  36           HE       ARG  36   4.224   5.070   7.478
  291    HB2  ARG  36           2HB      ARG  36   2.333   1.261   6.337
  292    HB3  ARG  36           1HB      ARG  36   1.165   1.654   7.590
  293    HG2  ARG  36           2HG      ARG  36   3.264   1.944   9.093
  294    HG3  ARG  36           1HG      ARG  36   4.119   2.081   7.556
  295    HD2  ARG  36           2HD      ARG  36   2.380   3.844   6.944
  296    HD3  ARG  36           1HD      ARG  36   1.943   3.837   8.651
  297   HH11  ARG  36          1HH1      ARG  36   3.094   3.471  10.368
  298   HH12  ARG  36          2HH1      ARG  36   4.236   4.262  11.402
  299   HH21  ARG  36          1HH2      ARG  36   5.726   6.112   8.838
  300   HH22  ARG  36          2HH2      ARG  36   5.730   5.762  10.534
  301    H    GLY  37           H        GLY  37   2.696  -0.773   5.551
  302    HA2  GLY  37           2HA      GLY  37   5.322  -2.002   6.112
  303    HA3  GLY  37           1HA      GLY  37   4.283  -2.433   4.762
  304    H    PHE  38           H        PHE  38   7.027  -0.669   5.520
  305    HA   PHE  38           HA       PHE  38   6.570   1.374   3.457
  306    HD1  PHE  38           1HD      PHE  38   7.185   3.865   3.668
  307    HD2  PHE  38           2HD      PHE  38  10.794   1.869   4.757
  308    HE1  PHE  38           1HE      PHE  38   8.495   5.694   2.693
  309    HE2  PHE  38           2HE      PHE  38  12.103   3.688   3.755
  310    HZ   PHE  38           HZ       PHE  38  10.955   5.605   2.718
  311    HB2  PHE  38           2HB      PHE  38   7.422   2.102   5.643
  312    HB3  PHE  38           1HB      PHE  38   8.787   1.011   5.490
  313    H    ILE  39           H        ILE  39   7.299   1.065   1.487
  314    HA   ILE  39           HA       ILE  39   9.700  -0.604   1.071
  315    HB   ILE  39           HB       ILE  39   7.472  -0.750  -0.930
  316   HG12  ILE  39          2HG1      ILE  39   7.608  -2.256   1.681
  317   HG13  ILE  39          1HG1      ILE  39   6.219  -1.481   0.928
  318   HG21  ILE  39          1HG2      ILE  39   8.887  -3.188  -0.581
  319   HG22  ILE  39          2HG2      ILE  39  10.064  -1.876  -0.607
  320   HG23  ILE  39          3HG2      ILE  39   8.933  -2.073  -1.945
  321   HD11  ILE  39          3HD1      ILE  39   6.119  -3.942   0.915
  322   HD12  ILE  39          1HD1      ILE  39   7.547  -3.967  -0.119
  323   HD13  ILE  39          2HD1      ILE  39   6.052  -3.232  -0.697
  324    H    ASP  40           H        ASP  40  11.101   1.002   0.411
  325    HA   ASP  40           HA       ASP  40  10.106   2.877  -1.618
  326    HB2  ASP  40           2HB      ASP  40  12.328   4.096  -1.005
  327    HB3  ASP  40           1HB      ASP  40  10.941   4.219   0.067
  328    H    PHE  41           H        PHE  41  10.915   2.957  -3.577
  329    HA   PHE  41           HA       PHE  41  12.965   0.978  -4.308
  330    HD1  PHE  41           1HD      PHE  41  11.079  -0.103  -3.718
  331    HD2  PHE  41           2HD      PHE  41  10.480   0.391  -7.906
  332    HE1  PHE  41           1HE      PHE  41   9.953  -2.281  -3.810
  333    HE2  PHE  41           2HE      PHE  41   9.355  -1.794  -8.001
  334    HZ   PHE  41           HZ       PHE  41   9.090  -3.132  -5.951
  335    HB2  PHE  41           2HB      PHE  41  10.775   2.398  -5.798
  336    HB3  PHE  41           1HB      PHE  41  12.137   1.730  -6.681
  337    H    GLY  42           H        GLY  42  13.139   3.935  -3.228
  338    HA2  GLY  42           2HA      GLY  42  15.239   5.128  -3.436
  339    HA3  GLY  42           1HA      GLY  42  15.217   4.759  -5.156
  340    H    ASP  43           H        ASP  43  14.068   6.060  -6.549
  341    HA   ASP  43           HA       ASP  43  13.193   8.618  -5.467
  342    HB2  ASP  43           2HB      ASP  43  14.510   7.947  -7.781
  343    HB3  ASP  43           1HB      ASP  43  12.857   8.143  -8.356
  344    H    SER  44           H        SER  44  11.576   6.858  -4.474
  345    HA   SER  44           HA       SER  44   9.002   7.546  -5.041
  346    HG   SER  44           HG       SER  44  10.751   4.766  -6.392
  347    HB2  SER  44           2HB      SER  44   8.427   5.178  -6.212
  348    HB3  SER  44           1HB      SER  44   8.761   6.640  -7.140
  349    H    ASN  45           H        ASN  45   7.409   6.112  -3.848
  350    HA   ASN  45           HA       ASN  45   8.603   3.979  -2.281
  351    HB2  ASN  45           2HB      ASN  45   7.296   6.230  -0.765
  352    HB3  ASN  45           1HB      ASN  45   8.316   4.938  -0.143
  353   HD21  ASN  45          1HD2      ASN  45   8.419   7.726  -2.330
  354   HD22  ASN  45          2HD2      ASN  45  10.034   8.191  -1.932
  355    H    CYS  46           H        CYS  46   6.921   2.947  -0.811
  356    HA   CYS  46           HA       CYS  46   4.172   3.478  -1.573
  357    HG   CYS  46           HG       CYS  46   6.228   1.142  -4.017
  358    HB2  CYS  46           2HB      CYS  46   4.300   0.701  -1.810
  359    HB3  CYS  46           1HB      CYS  46   4.079   1.861  -3.116
  360    H    GLU  47           H        GLU  47   3.463   3.814   0.454
  361    HA   GLU  47           HA       GLU  47   4.166   1.888   2.547
  362    HB2  GLU  47           2HB      GLU  47   4.294   4.556   2.644
  363    HB3  GLU  47           1HB      GLU  47   2.614   4.375   3.122
  364    HG2  GLU  47           2HG      GLU  47   3.148   3.496   5.151
  365    HG3  GLU  47           1HG      GLU  47   4.629   2.738   4.569
  366    H    LEU  48           H        LEU  48   2.474   1.030   3.928
  367    HA   LEU  48           HA       LEU  48  -0.249   1.254   2.885
  368    HG   LEU  48           HG       LEU  48  -0.932  -2.030   3.788
  369    HB2  LEU  48           2HB      LEU  48   0.674  -0.642   1.671
  370    HB3  LEU  48           1HB      LEU  48   1.219  -1.379   3.163
  371   HD11  LEU  48          1HD1      LEU  48  -2.939  -1.223   2.356
  372   HD12  LEU  48          2HD1      LEU  48  -1.875   0.121   1.944
  373   HD13  LEU  48          3HD1      LEU  48  -2.300  -0.185   3.629
  374   HD21  LEU  48          3HD2      LEU  48  -1.952  -2.843   1.482
  375   HD22  LEU  48          1HD2      LEU  48  -0.505  -3.571   2.179
  376   HD23  LEU  48          2HD2      LEU  48  -0.358  -2.367   0.900
  377    H    LEU  49           H        LEU  49  -1.536   1.687   4.528
  378    HA   LEU  49           HA       LEU  49  -0.725   0.926   7.245
  379    HG   LEU  49           HG       LEU  49  -1.980   1.832   9.028
  380    HB2  LEU  49           2HB      LEU  49  -1.606   3.273   6.536
  381    HB3  LEU  49           1HB      LEU  49  -3.181   2.507   6.586
  382   HD11  LEU  49          1HD1      LEU  49  -0.666   3.483   9.704
  383   HD12  LEU  49          2HD1      LEU  49  -1.861   4.697   9.248
  384   HD13  LEU  49          3HD1      LEU  49  -0.694   4.120   8.060
  385   HD21  LEU  49          3HD2      LEU  49  -4.327   2.229   8.755
  386   HD22  LEU  49          1HD2      LEU  49  -4.040   3.904   8.285
  387   HD23  LEU  49          2HD2      LEU  49  -3.706   3.383   9.936
  388    H    ALA  50           H        ALA  50  -1.703  -0.687   8.360
  389    HA   ALA  50           HA       ALA  50  -4.266  -1.671   7.356
  390    HB1  ALA  50           3HB      ALA  50  -3.482  -3.954   7.282
  391    HB2  ALA  50           1HB      ALA  50  -1.863  -3.433   7.735
  392    HB3  ALA  50           2HB      ALA  50  -2.558  -2.935   6.192
  393    H    HIS  51           H        HIS  51  -5.605  -1.647   8.979
  394    HA   HIS  51           HA       HIS  51  -4.683  -2.519  11.602
  395    HD1  HIS  51           1HD      HIS  51  -7.604   0.078  13.734
  396    HD2  HIS  51           2HD      HIS  51  -3.717  -1.316  13.252
  397    HE1  HIS  51           1HE      HIS  51  -6.516   0.327  15.985
  398    HE2  HIS  51           2HE      HIS  51  -4.192  -0.596  15.688
  399    HB2  HIS  51           2HB      HIS  51  -5.851  -0.103  10.980
  400    HB3  HIS  51           1HB      HIS  51  -7.236  -1.049  11.501
  401    HA   PRO  52           HA       PRO  52  -7.255  -6.059  11.836
  402    HB2  PRO  52           2HB      PRO  52  -8.950  -4.599  13.823
  403    HB3  PRO  52           1HB      PRO  52  -8.283  -6.236  13.896
  404    HG2  PRO  52           2HG      PRO  52  -7.118  -4.275  15.236
  405    HG3  PRO  52           1HG      PRO  52  -6.136  -5.480  14.385
  406    HD2  PRO  52           2HD      PRO  52  -6.720  -2.653  13.646
  407    HD3  PRO  52           1HD      PRO  52  -5.254  -3.606  13.367
  408    H    ASP  53           H        ASP  53  -8.880  -3.007  11.179
  409    HA   ASP  53           HA       ASP  53 -10.826  -4.543   9.638
  410    HB2  ASP  53           2HB      ASP  53 -11.768  -2.273  11.385
  411    HB3  ASP  53           1HB      ASP  53 -12.740  -3.462  10.524
  412    H    HIS  54           H        HIS  54  -8.638  -2.054   9.557
  413    HA   HIS  54           HA       HIS  54  -9.931  -1.121   7.131
  414    HD1  HIS  54           1HD      HIS  54 -10.179   0.495  11.170
  415    HD2  HIS  54           2HD      HIS  54  -7.001   1.877   8.875
  416    HE1  HIS  54           1HE      HIS  54  -8.536   1.463  12.810
  417    HE2  HIS  54           2HE      HIS  54  -6.576   2.198  11.407
  418    HB2  HIS  54           2HB      HIS  54  -9.477   1.266   7.625
  419    HB3  HIS  54           1HB      HIS  54 -10.681   0.546   8.676
  420    H    VAL  55           H        VAL  55  -8.488   0.001   5.625
  421    HA   VAL  55           HA       VAL  55  -5.648  -0.331   6.208
  422    HB   VAL  55           HB       VAL  55  -6.787  -2.297   4.877
  423   HG11  VAL  55          1HG1      VAL  55  -7.582  -0.480   3.154
  424   HG12  VAL  55          2HG1      VAL  55  -7.088  -2.085   2.623
  425   HG13  VAL  55          3HG1      VAL  55  -5.969  -0.730   2.488
  426   HG21  VAL  55          3HG2      VAL  55  -4.179  -1.115   3.954
  427   HG22  VAL  55          1HG2      VAL  55  -4.678  -2.804   3.839
  428   HG23  VAL  55          2HG2      VAL  55  -4.396  -2.074   5.420
  429    H    LEU  56           H        LEU  56  -4.372   1.196   5.320
  430    HA   LEU  56           HA       LEU  56  -5.655   3.176   3.549
  431    HG   LEU  56           HG       LEU  56  -6.393   4.747   5.535
  432    HB2  LEU  56           2HB      LEU  56  -4.341   3.528   6.100
  433    HB3  LEU  56           1HB      LEU  56  -3.463   4.400   4.864
  434   HD11  LEU  56          1HD1      LEU  56  -5.819   6.735   6.634
  435   HD12  LEU  56          2HD1      LEU  56  -4.176   6.718   5.992
  436   HD13  LEU  56          3HD1      LEU  56  -4.659   5.539   7.214
  437   HD21  LEU  56          3HD2      LEU  56  -4.661   5.831   3.373
  438   HD22  LEU  56          1HD2      LEU  56  -5.805   6.930   4.138
  439   HD23  LEU  56          2HD2      LEU  56  -6.386   5.460   3.362
  440    H    MET  57           H        MET  57  -4.450   3.971   1.840
  441    HA   MET  57           HA       MET  57  -1.852   2.664   1.408
  442    HB2  MET  57           2HB      MET  57  -3.750   3.249  -0.841
  443    HB3  MET  57           1HB      MET  57  -2.377   2.148  -0.816
  444    HG2  MET  57           2HG      MET  57  -3.568   0.671   0.724
  445    HG3  MET  57           1HG      MET  57  -4.942   1.780   0.714
  446    HE1  MET  57           3HE      MET  57  -6.841   0.184  -0.163
  447    HE2  MET  57           1HE      MET  57  -7.100   0.390  -1.895
  448    HE3  MET  57           2HE      MET  57  -6.778   1.794  -0.878
  449    H    ILE  58           H        ILE  58  -0.293   4.176   1.426
  450    HA   ILE  58           HA       ILE  58  -0.851   6.733   0.088
  451    HB   ILE  58           HB       ILE  58   0.954   6.338   2.481
  452   HG12  ILE  58          2HG1      ILE  58  -1.897   6.646   2.376
  453   HG13  ILE  58          1HG1      ILE  58  -0.866   6.497   3.785
  454   HG21  ILE  58          1HG2      ILE  58   1.618   8.118   0.928
  455   HG22  ILE  58          2HG2      ILE  58   1.131   8.747   2.501
  456   HG23  ILE  58          3HG2      ILE  58   0.031   8.862   1.125
  457   HD11  ILE  58          3HD1      ILE  58  -1.166   9.140   2.421
  458   HD12  ILE  58          1HD1      ILE  58  -0.732   8.781   4.092
  459   HD13  ILE  58          2HD1      ILE  58  -2.394   8.557   3.547
  460    H    LEU  59           H        LEU  59   0.665   7.423  -1.355
  461    HA   LEU  59           HA       LEU  59   3.122   5.814  -1.548
  462    HG   LEU  59           HG       LEU  59   1.382   6.890  -5.294
  463    HB2  LEU  59           2HB      LEU  59   3.018   5.758  -3.869
  464    HB3  LEU  59           1HB      LEU  59   1.371   5.452  -3.370
  465   HD11  LEU  59          1HD1      LEU  59   0.672   8.452  -2.834
  466   HD12  LEU  59          2HD1      LEU  59  -0.344   7.235  -3.605
  467   HD13  LEU  59          3HD1      LEU  59   0.057   8.726  -4.460
  468   HD21  LEU  59          3HD2      LEU  59   3.703   7.945  -4.383
  469   HD22  LEU  59          1HD2      LEU  59   2.564   9.228  -3.991
  470   HD23  LEU  59          2HD2      LEU  59   2.705   8.658  -5.647
  471    H    ASN  60           H        ASN  60   5.019   6.840  -2.059
  472    HA   ASN  60           HA       ASN  60   4.900   9.786  -2.141
  473    HB2  ASN  60           2HB      ASN  60   7.186   8.208  -0.949
  474    HB3  ASN  60           1HB      ASN  60   6.883   9.938  -0.819
  475   HD21  ASN  60          1HD2      ASN  60   7.356   8.806   1.466
  476   HD22  ASN  60          2HD2      ASN  60   5.921   8.538   2.390
  477    H    SER  61           H        SER  61   5.188  10.171  -4.264
  478    HA   SER  61           HA       SER  61   7.696   9.176  -5.445
  479    HG   SER  61           HG       SER  61   5.697   7.168  -5.173
  480    HB2  SER  61           2HB      SER  61   5.431   9.011  -7.312
  481    HB3  SER  61           1HB      SER  61   6.782   7.908  -7.077
  482    HA   PRO  62           HA       PRO  62   7.943  13.335  -6.977
  483    HB2  PRO  62           2HB      PRO  62   9.930  12.949  -8.760
  484    HB3  PRO  62           1HB      PRO  62  10.177  12.995  -7.014
  485    HG2  PRO  62           2HG      PRO  62   9.888  10.606  -8.802
  486    HG3  PRO  62           1HG      PRO  62  11.100  10.914  -7.540
  487    HD2  PRO  62           2HD      PRO  62   8.966   9.376  -7.077
  488    HD3  PRO  62           1HD      PRO  62   9.608  10.457  -5.828
  489    H    ASP  63           H        ASP  63   6.888  10.690  -8.899
  490    HA   ASP  63           HA       ASP  63   5.917  12.622 -10.869
  491    HB2  ASP  63           2HB      ASP  63   7.777  11.836 -12.055
  492    HB3  ASP  63           1HB      ASP  63   7.592  10.194 -11.454
  493    H    GLU  64           H        GLU  64   3.906  12.043 -11.845
  494    HA   GLU  64           HA       GLU  64   2.218  10.440 -10.223
  495    HB2  GLU  64           2HB      GLU  64   1.843  11.722 -12.901
  496    HB3  GLU  64           1HB      GLU  64   0.745  10.431 -12.444
  497    HG2  GLU  64           2HG      GLU  64  -0.397  12.177 -11.582
  498    HG3  GLU  64           1HG      GLU  64   0.620  11.794 -10.189
  499    H    ASP  65           H        ASP  65   3.889   9.585 -13.284
  500    HA   ASP  65           HA       ASP  65   2.781   7.108 -13.767
  501    HB2  ASP  65           2HB      ASP  65   4.631   8.265 -15.068
  502    HB3  ASP  65           1HB      ASP  65   5.750   7.652 -13.853
  503    H    SER  66           H        SER  66   5.558   7.852 -11.702
  504    HA   SER  66           HA       SER  66   5.822   5.311 -10.509
  505    HG   SER  66           HG       SER  66   8.662   7.364 -10.169
  506    HB2  SER  66           2HB      SER  66   6.613   8.081  -9.606
  507    HB3  SER  66           1HB      SER  66   6.994   6.635  -8.669
  508    H    LEU  67           H        LEU  67   4.434   8.297  -9.313
  509    HA   LEU  67           HA       LEU  67   3.307   7.680  -6.955
  510    HG   LEU  67           HG       LEU  67   1.073   9.385  -6.521
  511    HB2  LEU  67           2HB      LEU  67   3.162   9.881  -7.769
  512    HB3  LEU  67           1HB      LEU  67   2.359   9.382  -9.229
  513   HD11  LEU  67          1HD1      LEU  67   1.535  11.501  -8.444
  514   HD12  LEU  67          2HD1      LEU  67   1.050  11.586  -6.750
  515   HD13  LEU  67          3HD1      LEU  67  -0.159  11.306  -8.002
  516   HD21  LEU  67          3HD2      LEU  67  -0.992   9.463  -8.122
  517   HD22  LEU  67          1HD2      LEU  67  -0.239   7.924  -7.712
  518   HD23  LEU  67          2HD2      LEU  67   0.124   8.702  -9.254
  519    H    ALA  68           H        ALA  68   1.479   7.330 -10.017
  520    HA   ALA  68           HA       ALA  68  -0.648   5.921  -8.780
  521    HB1  ALA  68           3HB      ALA  68  -1.247   6.921 -10.787
  522    HB2  ALA  68           1HB      ALA  68  -1.099   5.225 -11.246
  523    HB3  ALA  68           2HB      ALA  68   0.199   6.358 -11.623
  524    H    HIS  69           H        HIS  69   2.321   4.910 -10.392
  525    HA   HIS  69           HA       HIS  69   1.823   2.187 -10.671
  526    HD1  HIS  69           1HD      HIS  69   2.939   0.279 -10.084
  527    HD2  HIS  69           2HD      HIS  69   6.416   1.864 -11.717
  528    HE1  HIS  69           1HE      HIS  69   4.375  -1.703 -10.660
  529    HE2  HIS  69           2HE      HIS  69   6.436  -0.722 -11.726
  530    HB2  HIS  69           2HB      HIS  69   3.834   3.410 -11.536
  531    HB3  HIS  69           1HB      HIS  69   4.471   3.425  -9.895
  532    H    MET  70           H        MET  70   2.828   4.069  -7.900
  533    HA   MET  70           HA       MET  70   3.204   1.771  -6.186
  534    HB2  MET  70           2HB      MET  70   2.902   4.583  -5.182
  535    HB3  MET  70           1HB      MET  70   3.916   3.301  -4.542
  536    HG2  MET  70           2HG      MET  70   4.641   4.103  -7.252
  537    HG3  MET  70           1HG      MET  70   4.759   5.403  -6.070
  538    HE1  MET  70           3HE      MET  70   6.853   2.742  -7.754
  539    HE2  MET  70           1HE      MET  70   5.649   1.767  -6.909
  540    HE3  MET  70           2HE      MET  70   7.347   1.675  -6.441
  541    H    GLN  71           H        GLN  71   0.843   4.509  -6.114
  542    HA   GLN  71           HA       GLN  71  -0.750   3.455  -4.114
  543    HB2  GLN  71           2HB      GLN  71  -2.653   4.774  -5.324
  544    HB3  GLN  71           1HB      GLN  71  -1.348   5.629  -4.527
  545    HG2  GLN  71           2HG      GLN  71  -0.784   6.618  -6.422
  546    HG3  GLN  71           1HG      GLN  71  -0.717   5.084  -7.282
  547   HE21  GLN  71          1HE2      GLN  71  -3.153   4.166  -7.409
  548   HE22  GLN  71          2HE2      GLN  71  -4.241   5.278  -8.162
  549    H    ASN  72           H        ASN  72  -0.601   2.544  -7.469
  550    HA   ASN  72           HA       ASN  72  -3.100   1.099  -7.381
  551    HB2  ASN  72           2HB      ASN  72  -1.840   2.183  -9.447
  552    HB3  ASN  72           1HB      ASN  72  -1.087   0.592  -9.521
  553   HD21  ASN  72          1HD2      ASN  72  -2.636  -1.263  -9.448
  554   HD22  ASN  72          2HD2      ASN  72  -4.099  -1.102 -10.351
  555    H    VAL  73           H        VAL  73   0.358   0.277  -7.378
  556    HA   VAL  73           HA       VAL  73   0.325  -2.438  -7.532
  557    HB   VAL  73           HB       VAL  73   2.026  -0.569  -5.916
  558   HG11  VAL  73          1HG1      VAL  73   2.223  -3.576  -5.879
  559   HG12  VAL  73          2HG1      VAL  73   1.978  -2.501  -4.502
  560   HG13  VAL  73          3HG1      VAL  73   3.514  -2.489  -5.368
  561   HG21  VAL  73          3HG2      VAL  73   2.070  -1.241  -8.520
  562   HG22  VAL  73          1HG2      VAL  73   3.159  -2.465  -7.868
  563   HG23  VAL  73          2HG2      VAL  73   3.501  -0.753  -7.612
  564    H    VAL  74           H        VAL  74  -0.426  -0.477  -4.688
  565    HA   VAL  74           HA       VAL  74  -0.816  -2.695  -2.935
  566    HB   VAL  74           HB       VAL  74  -1.841   0.137  -2.712
  567   HG11  VAL  74          1HG1      VAL  74  -2.311  -0.298  -0.406
  568   HG12  VAL  74          2HG1      VAL  74  -1.644  -1.923  -0.522
  569   HG13  VAL  74          3HG1      VAL  74  -3.137  -1.521  -1.369
  570   HG21  VAL  74          3HG2      VAL  74   0.752  -1.058  -2.256
  571   HG22  VAL  74          1HG2      VAL  74   0.119  -0.315  -0.789
  572   HG23  VAL  74          2HG2      VAL  74   0.282   0.642  -2.260
  573    H    ALA  75           H        ALA  75  -3.072  -0.634  -4.802
  574    HA   ALA  75           HA       ALA  75  -5.484  -1.655  -3.965
  575    HB1  ALA  75           3HB      ALA  75  -5.382   0.193  -5.522
  576    HB2  ALA  75           1HB      ALA  75  -6.352  -1.105  -6.218
  577    HB3  ALA  75           2HB      ALA  75  -4.695  -0.852  -6.767
  578    H    ASP  76           H        ASP  76  -3.031  -3.110  -5.911
  579    HA   ASP  76           HA       ASP  76  -4.643  -5.264  -6.912
  580    HB2  ASP  76           2HB      ASP  76  -2.339  -4.259  -7.770
  581    HB3  ASP  76           1HB      ASP  76  -1.674  -5.502  -6.714
  582    H    HIS  77           H        HIS  77  -2.343  -4.845  -4.249
  583    HA   HIS  77           HA       HIS  77  -2.243  -7.509  -3.403
  584    HD1  HIS  77           1HD      HIS  77  -0.643  -6.283  -4.711
  585    HD2  HIS  77           2HD      HIS  77   0.940  -4.603  -1.256
  586    HE1  HIS  77           1HE      HIS  77   1.640  -5.450  -5.354
  587    HE2  HIS  77           2HE      HIS  77   2.545  -4.363  -3.269
  588    HB2  HIS  77           2HB      HIS  77  -2.002  -5.075  -1.627
  589    HB3  HIS  77           1HB      HIS  77  -1.359  -6.677  -1.316
  590    H    LEU  78           H        LEU  78  -4.498  -4.914  -2.507
  591    HA   LEU  78           HA       LEU  78  -5.865  -6.394  -0.519
  592    HG   LEU  78           HG       LEU  78  -5.066  -3.166  -0.747
  593    HB2  LEU  78           2HB      LEU  78  -6.721  -4.024  -2.183
  594    HB3  LEU  78           1HB      LEU  78  -7.664  -4.676  -0.861
  595   HD11  LEU  78          1HD1      LEU  78  -7.298  -2.028  -0.669
  596   HD12  LEU  78          2HD1      LEU  78  -6.250  -1.729   0.717
  597   HD13  LEU  78          3HD1      LEU  78  -7.594  -2.865   0.855
  598   HD21  LEU  78          3HD2      LEU  78  -6.123  -5.168   1.202
  599   HD22  LEU  78          1HD2      LEU  78  -5.320  -3.718   1.802
  600   HD23  LEU  78          2HD2      LEU  78  -4.457  -4.825   0.736
  601    H    GLN  79           H        GLN  79  -5.947  -6.468  -3.954
  602    HA   GLN  79           HA       GLN  79  -8.614  -7.401  -4.273
  603    HB2  GLN  79           2HB      GLN  79  -6.232  -7.693  -6.109
  604    HB3  GLN  79           1HB      GLN  79  -7.905  -8.001  -6.554
  605    HG2  GLN  79           2HG      GLN  79  -7.619  -5.374  -5.418
  606    HG3  GLN  79           1HG      GLN  79  -6.507  -5.604  -6.764
  607   HE21  GLN  79          1HE2      GLN  79  -8.400  -3.755  -7.064
  608   HE22  GLN  79          2HE2      GLN  79  -9.628  -4.289  -8.154
  609    H    ARG  80           H        ARG  80  -5.528  -9.159  -4.667
  610    HA   ARG  80           HA       ARG  80  -6.644 -11.690  -4.888
  611    HE   ARG  80           HE       ARG  80  -2.254 -12.608  -4.487
  612    HB2  ARG  80           2HB      ARG  80  -4.341 -12.457  -3.986
  613    HB3  ARG  80           1HB      ARG  80  -4.426 -11.606  -5.521
  614    HG2  ARG  80           2HG      ARG  80  -3.086 -10.020  -4.781
  615    HG3  ARG  80           1HG      ARG  80  -4.115  -9.726  -3.378
  616    HD2  ARG  80           2HD      ARG  80  -1.806 -10.353  -2.762
  617    HD3  ARG  80           1HD      ARG  80  -3.010 -11.485  -2.150
  618   HH11  ARG  80          1HH1      ARG  80  -0.468 -11.422  -1.733
  619   HH12  ARG  80          2HH1      ARG  80   0.833 -12.546  -1.936
  620   HH21  ARG  80          1HH2      ARG  80  -0.542 -14.086  -4.755
  621   HH22  ARG  80          2HH2      ARG  80   0.792 -14.058  -3.652
  622    H    MET  81           H        MET  81  -6.021  -9.810  -2.004
  623    HA   MET  81           HA       MET  81  -6.301 -12.080  -0.257
  624    HB2  MET  81           2HB      MET  81  -6.168 -10.460   1.569
  625    HB3  MET  81           1HB      MET  81  -4.867 -10.260   0.415
  626    HG2  MET  81           2HG      MET  81  -5.582  -8.103   1.058
  627    HG3  MET  81           1HG      MET  81  -6.142  -8.366  -0.590
  628    HE1  MET  81           3HE      MET  81  -6.574  -6.778   2.206
  629    HE2  MET  81           1HE      MET  81  -8.072  -7.149   3.058
  630    HE3  MET  81           2HE      MET  81  -8.083  -6.014   1.710
  631    H    ALA  82           H        ALA  82  -8.484  -9.981  -1.816
  632    HA   ALA  82           HA       ALA  82 -10.623 -10.768   0.070
  633    HB1  ALA  82           3HB      ALA  82 -11.887  -8.818  -0.938
  634    HB2  ALA  82           1HB      ALA  82 -10.365  -8.335  -1.683
  635    HB3  ALA  82           2HB      ALA  82 -10.502  -8.410   0.074
  636    H    ASN  83           H        ASN  83 -10.006 -10.150  -3.386
  637    HA   ASN  83           HA       ASN  83 -10.756 -11.196  -5.262
  638    HB2  ASN  83           2HB      ASN  83 -10.885 -13.229  -3.236
  639    HB3  ASN  83           1HB      ASN  83 -12.265 -13.400  -4.318
  640   HD21  ASN  83          1HD2      ASN  83  -9.599 -14.840  -3.852
  641   HD22  ASN  83          2HD2      ASN  83  -8.984 -15.063  -5.451
  642    H    SER  84           H        SER  84 -13.092 -12.499  -5.880
  643    HA   SER  84           HA       SER  84 -15.323 -12.235  -6.257
  644    HG   SER  84           HG       SER  84 -16.448 -12.942  -3.836
  645    HB2  SER  84           2HB      SER  84 -15.017 -11.382  -3.561
  646    HB3  SER  84           1HB      SER  84 -16.090 -10.232  -4.358
  647    H    GLU  85           H        GLU  85 -14.644  -8.997  -4.963
  648    HA   GLU  85           HA       GLU  85 -15.335  -7.897  -7.602
  649    HB2  GLU  85           2HB      GLU  85 -15.959  -5.859  -6.462
  650    HB3  GLU  85           1HB      GLU  85 -16.764  -7.216  -5.689
  651    HG2  GLU  85           2HG      GLU  85 -14.663  -7.132  -4.108
  652    HG3  GLU  85           1HG      GLU  85 -14.597  -5.461  -4.668
  653    H    SER  86           H        SER  86 -14.142  -6.034  -8.374
  654    HA   SER  86           HA       SER  86 -11.321  -6.341  -7.972
  655    HG   SER  86           HG       SER  86 -10.198  -4.872 -10.032
  656    HB2  SER  86           2HB      SER  86 -12.133  -5.802 -10.191
  657    HB3  SER  86           1HB      SER  86 -12.908  -4.335  -9.591
  658    H    LEU  87           H        LEU  87 -11.545  -5.897  -5.628
  659    HA   LEU  87           HA       LEU  87 -11.722  -4.477  -3.785
  660    HG   LEU  87           HG       LEU  87  -8.227  -4.646  -3.214
  661    HB2  LEU  87           2HB      LEU  87  -9.246  -4.354  -5.214
  662    HB3  LEU  87           1HB      LEU  87  -9.568  -2.783  -4.503
  663   HD11  LEU  87          1HD1      LEU  87  -8.402  -2.573  -2.211
  664   HD12  LEU  87          2HD1      LEU  87  -9.267  -3.602  -1.069
  665   HD13  LEU  87          3HD1      LEU  87 -10.166  -2.605  -2.212
  666   HD21  LEU  87          3HD2      LEU  87 -11.062  -5.226  -2.360
  667   HD22  LEU  87          1HD2      LEU  87  -9.594  -5.860  -1.622
  668   HD23  LEU  87          2HD2      LEU  87 -10.021  -6.324  -3.267
  669    H    GLU  88           H        GLU  88 -13.320  -3.066  -3.479
  670    HA   GLU  88           HA       GLU  88 -13.695  -0.782  -5.172
  671    HB2  GLU  88           2HB      GLU  88 -15.536  -1.889  -3.862
  672    HB3  GLU  88           1HB      GLU  88 -14.793  -1.274  -2.392
  673    HG2  GLU  88           2HG      GLU  88 -15.244   0.810  -4.359
  674    HG3  GLU  88           1HG      GLU  88 -16.728  -0.023  -3.902
  675    H    ILE  89           H        ILE  89 -11.884   0.501  -5.184
  676    HA   ILE  89           HA       ILE  89 -11.159   1.683  -2.604
  677    HB   ILE  89           HB       ILE  89  -8.840   1.535  -2.969
  678   HG12  ILE  89          2HG1      ILE  89  -9.108   2.068  -5.525
  679   HG13  ILE  89          1HG1      ILE  89  -7.719   1.156  -4.965
  680   HG21  ILE  89          1HG2      ILE  89 -10.174  -1.006  -3.829
  681   HG22  ILE  89          2HG2      ILE  89  -9.624  -0.550  -2.217
  682   HG23  ILE  89          3HG2      ILE  89  -8.450  -0.889  -3.486
  683   HD11  ILE  89          3HD1      ILE  89 -10.207  -0.026  -6.169
  684   HD12  ILE  89          1HD1      ILE  89  -8.781  -0.918  -5.636
  685   HD13  ILE  89          2HD1      ILE  89  -8.666   0.206  -6.992
  686    H    ALA  90           H        ALA  90 -11.143   3.906  -2.607
  687    HA   ALA  90           HA       ALA  90 -11.354   5.187  -5.241
  688    HB1  ALA  90           3HB      ALA  90 -12.383   7.031  -4.215
  689    HB2  ALA  90           1HB      ALA  90 -11.806   6.578  -2.611
  690    HB3  ALA  90           2HB      ALA  90 -13.078   5.634  -3.395
  691    H    TRP  91           H        TRP  91  -9.477   5.773  -6.039
  692    HA   TRP  91           HA       TRP  91  -7.295   6.520  -4.265
  693    HD1  TRP  91           HD       TRP  91  -8.047   7.825  -8.261
  694    HE1  TRP  91           1HE      TRP  91  -9.102   6.640 -10.285
  695    HE3  TRP  91           3HE      TRP  91  -7.063   2.973  -6.968
  696    HZ2  TRP  91           2HZ      TRP  91  -9.469   4.002 -11.213
  697    HZ3  TRP  91           3HZ      TRP  91  -7.800   1.181  -8.483
  698    HH2  TRP  91           HH       TRP  91  -8.977   1.685 -10.560
  699    HB2  TRP  91           2HB      TRP  91  -6.023   6.676  -6.500
  700    HB3  TRP  91           1HB      TRP  91  -6.524   5.084  -5.945
  701    H    GLN  92           H        GLN  92  -6.525   8.517  -3.993
  702    HA   GLN  92           HA       GLN  92  -8.042  10.709  -5.156
  703    HB2  GLN  92           2HB      GLN  92  -5.898  10.646  -3.027
  704    HB3  GLN  92           1HB      GLN  92  -6.701  12.111  -3.572
  705    HG2  GLN  92           2HG      GLN  92  -8.834  11.265  -2.799
  706    HG3  GLN  92           1HG      GLN  92  -8.078   9.746  -2.320
  707   HE21  GLN  92          1HE2      GLN  92  -9.108  10.368  -0.251
  708   HE22  GLN  92          2HE2      GLN  92  -8.209  11.371   0.832
  709    HA   PRO  93           HA       PRO  93  -5.354  12.023  -8.371
  710    HB2  PRO  93           2HB      PRO  93  -5.171  14.608  -6.905
  711    HB3  PRO  93           1HB      PRO  93  -5.536  14.310  -8.608
  712    HG2  PRO  93           2HG      PRO  93  -7.476  14.929  -6.886
  713    HG3  PRO  93           1HG      PRO  93  -7.740  13.742  -8.175
  714    HD2  PRO  93           2HD      PRO  93  -7.380  13.318  -5.257
  715    HD3  PRO  93           1HD      PRO  93  -8.297  12.360  -6.435
  716    H    ALA  94           H        ALA  94  -4.394  13.010  -5.100
  717    HA   ALA  94           HA       ALA  94  -2.383  12.447  -4.045
  718    HB1  ALA  94           3HB      ALA  94  -0.593  11.473  -5.093
  719    HB2  ALA  94           1HB      ALA  94  -0.829  12.395  -6.575
  720    HB3  ALA  94           2HB      ALA  94  -1.878  11.027  -6.216
  721    H    GLU  95           H        GLU  95  -3.538  14.991  -4.889
  722    HA   GLU  95           HA       GLU  95  -1.378  16.684  -4.164
  723    HB2  GLU  95           2HB      GLU  95  -1.316  16.114  -6.818
  724    HB3  GLU  95           1HB      GLU  95  -2.349  17.537  -6.820
  725    HG2  GLU  95           2HG      GLU  95  -0.354  18.374  -5.205
  726    HG3  GLU  95           1HG      GLU  95   0.523  17.282  -6.277
  727    H    SER  96           H        SER  96  -2.104  19.101  -4.569
  728    HA   SER  96           HA       SER  96  -4.981  19.450  -4.464
  729    HG   SER  96           HG       SER  96  -2.898  20.343  -1.114
  730    HB2  SER  96           2HB      SER  96  -4.624  20.826  -2.271
  731    HB3  SER  96           1HB      SER  96  -4.788  19.073  -2.171
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1   6.903  13.300  -5.167
    2    HB2  MET   1           2HB      MET   1   7.568  13.556  -2.876
    3    HB3  MET   1           1HB      MET   1   8.844  14.183  -3.913
    4    HG2  MET   1           2HG      MET   1   8.695  16.229  -3.043
    5    HG3  MET   1           1HG      MET   1   6.936  16.224  -3.090
    6    HE1  MET   1           3HE      MET   1  10.010  16.071  -1.461
    7    HE2  MET   1           1HE      MET   1   9.902  15.028  -0.043
    8    HE3  MET   1           2HE      MET   1   9.442  16.727   0.075
    9    H    PHE   2           H        PHE   2   4.814  13.343  -5.736
   10    HA   PHE   2           HA       PHE   2   2.964  15.089  -4.279
   11    HD1  PHE   2           1HD      PHE   2   3.460  16.491  -6.680
   12    HD2  PHE   2           2HD      PHE   2   2.910  12.552  -8.198
   13    HE1  PHE   2           1HE      PHE   2   4.743  17.090  -8.692
   14    HE2  PHE   2           2HE      PHE   2   4.181  13.149 -10.211
   15    HZ   PHE   2           HZ       PHE   2   5.107  15.416 -10.461
   16    HB2  PHE   2           2HB      PHE   2   1.888  13.138  -6.233
   17    HB3  PHE   2           1HB      PHE   2   1.485  14.834  -6.006
   18    H    ARG   3           H        ARG   3   0.823  13.883  -3.554
   19    HA   ARG   3           HA       ARG   3   1.394  11.158  -2.734
   20    HE   ARG   3           HE       ARG   3   4.490  10.682   1.461
   21    HB2  ARG   3           2HB      ARG   3   1.932  13.250  -0.943
   22    HB3  ARG   3           1HB      ARG   3   0.427  12.526  -0.387
   23    HG2  ARG   3           2HG      ARG   3   1.705  11.027   0.630
   24    HG3  ARG   3           1HG      ARG   3   1.980  10.343  -0.958
   25    HD2  ARG   3           2HD      ARG   3   4.138  10.827  -0.803
   26    HD3  ARG   3           1HD      ARG   3   3.755  12.535  -0.616
   27   HH11  ARG   3          1HH1      ARG   3   2.916  13.711   0.734
   28   HH12  ARG   3          2HH1      ARG   3   3.135  14.350   2.327
   29   HH21  ARG   3          1HH2      ARG   3   4.778  11.520   3.557
   30   HH22  ARG   3          2HH2      ARG   3   4.192  13.107   3.930
   31    H    SER   4           H        SER   4  -0.319   9.942  -2.919
   32    HA   SER   4           HA       SER   4  -3.014  11.118  -2.787
   33    HG   SER   4           HG       SER   4  -4.136   8.523  -5.023
   34    HB2  SER   4           2HB      SER   4  -2.995  10.346  -4.970
   35    HB3  SER   4           1HB      SER   4  -1.769   9.121  -4.633
   36    H    THR   5           H        THR   5  -4.699   9.514  -1.999
   37    HA   THR   5           HA       THR   5  -3.568   7.382  -0.381
   38    HB   THR   5           HB       THR   5  -4.570   8.088   1.690
   39    HG1  THR   5           1HG      THR   5  -5.604  10.259   0.198
   40   HG21  THR   5          3HG2      THR   5  -3.224   9.821   2.330
   41   HG22  THR   5          1HG2      THR   5  -3.397  10.677   0.801
   42   HG23  THR   5          2HG2      THR   5  -2.367   9.248   0.902
   43    H    SER   6           H        SER   6  -4.738   5.612  -0.405
   44    HA   SER   6           HA       SER   6  -7.548   5.808  -1.279
   45    HG   SER   6           HG       SER   6  -7.674   2.565  -1.725
   46    HB2  SER   6           2HB      SER   6  -5.990   4.506  -2.754
   47    HB3  SER   6           1HB      SER   6  -5.740   3.384  -1.416
   48    H    HIS   7           H        HIS   7  -9.129   5.159   0.063
   49    HA   HIS   7           HA       HIS   7  -8.344   3.760   2.545
   50    HD1  HIS   7           1HD      HIS   7 -11.347   3.033   3.657
   51    HD2  HIS   7           2HD      HIS   7  -9.693   6.384   5.469
   52    HE1  HIS   7           1HE      HIS   7 -11.880   2.809   6.100
   53    HE2  HIS   7           2HE      HIS   7 -10.792   4.800   7.188
   54    HB2  HIS   7           2HB      HIS   7  -9.215   6.092   2.834
   55    HB3  HIS   7           1HB      HIS   7 -10.742   5.561   2.151
   56    H    VAL   8           H        VAL   8  -9.227   1.809   2.959
   57    HA   VAL   8           HA       VAL   8 -11.709   1.040   1.595
   58    HB   VAL   8           HB       VAL   8  -9.462  -0.943   1.724
   59   HG11  VAL   8          1HG1      VAL   8 -11.794  -1.651   1.233
   60   HG12  VAL   8          2HG1      VAL   8 -10.647  -2.031  -0.050
   61   HG13  VAL   8          3HG1      VAL   8 -11.743  -0.661  -0.225
   62   HG21  VAL   8          3HG2      VAL   8  -8.654   1.125   0.540
   63   HG22  VAL   8          1HG2      VAL   8  -9.919   0.844  -0.656
   64   HG23  VAL   8          2HG2      VAL   8  -8.642  -0.350  -0.424
   65    H    ARG   9           H        ARG   9 -12.847  -0.730   2.624
   66    HA   ARG   9           HA       ARG   9 -12.091  -0.991   5.451
   67    HE   ARG   9           HE       ARG   9 -15.453   2.160   6.598
   68    HB2  ARG   9           2HB      ARG   9 -14.697  -1.060   4.026
   69    HB3  ARG   9           1HB      ARG   9 -14.525  -2.123   5.414
   70    HG2  ARG   9           2HG      ARG   9 -15.482  -0.082   6.164
   71    HG3  ARG   9           1HG      ARG   9 -13.820  -0.155   6.759
   72    HD2  ARG   9           2HD      ARG   9 -13.082   1.466   5.272
   73    HD3  ARG   9           1HD      ARG   9 -14.440   1.219   4.174
   74   HH11  ARG   9          1HH1      ARG   9 -13.435   3.281   3.980
   75   HH12  ARG   9          2HH1      ARG   9 -13.876   4.942   4.186
   76   HH21  ARG   9          1HH2      ARG   9 -16.036   4.346   6.868
   77   HH22  ARG   9          2HH2      ARG   9 -15.352   5.547   5.826
   78    H    THR  10           H        THR  10 -10.782  -2.684   5.750
   79    HA   THR  10           HA       THR  10 -11.620  -5.286   4.666
   80    HB   THR  10           HB       THR  10  -9.309  -3.853   3.939
   81    HG1  THR  10           1HG      THR  10 -10.155  -6.520   3.539
   82   HG21  THR  10          3HG2      THR  10  -8.500  -5.102   6.157
   83   HG22  THR  10          1HG2      THR  10  -7.475  -4.862   4.737
   84   HG23  THR  10          2HG2      THR  10  -8.292  -6.408   4.981
   85    H    GLU  11           H        GLU  11 -10.883  -7.160   5.914
   86    HA   GLU  11           HA       GLU  11 -10.557  -6.473   8.759
   87    HB2  GLU  11           2HB      GLU  11 -12.270  -8.290   7.402
   88    HB3  GLU  11           1HB      GLU  11 -11.182  -9.232   8.413
   89    HG2  GLU  11           2HG      GLU  11 -12.247  -8.637  10.260
   90    HG3  GLU  11           1HG      GLU  11 -12.187  -6.930   9.821
   91    H    SER  12           H        SER  12  -8.974  -7.470  10.041
   92    HA   SER  12           HA       SER  12  -6.941  -8.344  10.526
   93    HG   SER  12           HG       SER  12  -5.587 -10.492  10.087
   94    HB2  SER  12           2HB      SER  12  -7.877 -10.477  10.115
   95    HB3  SER  12           1HB      SER  12  -7.834 -10.250   8.366
   96    H    ALA  13           H        ALA  13  -7.209  -6.240   8.509
   97    HA   ALA  13           HA       ALA  13  -5.504  -6.417   6.339
   98    HB1  ALA  13           3HB      ALA  13  -5.317  -4.036   6.419
   99    HB2  ALA  13           1HB      ALA  13  -5.786  -4.037   8.110
  100    HB3  ALA  13           2HB      ALA  13  -6.955  -4.490   6.883
  101    H    ALA  14           H        ALA  14  -4.610  -5.331   9.589
  102    HA   ALA  14           HA       ALA  14  -2.031  -4.600   9.283
  103    HB1  ALA  14           3HB      ALA  14  -1.626  -5.346  11.595
  104    HB2  ALA  14           1HB      ALA  14  -3.158  -6.221  11.549
  105    HB3  ALA  14           2HB      ALA  14  -3.141  -4.463  11.387
  106    H    ARG  15           H        ARG  15  -3.088  -7.938   8.977
  107    HA   ARG  15           HA       ARG  15  -0.405  -8.968   9.237
  108    HE   ARG  15           HE       ARG  15  -1.225 -13.359   6.459
  109    HB2  ARG  15           2HB      ARG  15  -2.590 -10.191   9.809
  110    HB3  ARG  15           1HB      ARG  15  -2.746 -10.471   8.082
  111    HG2  ARG  15           2HG      ARG  15  -0.379 -11.290   9.744
  112    HG3  ARG  15           1HG      ARG  15  -1.723 -12.347   9.321
  113    HD2  ARG  15           2HD      ARG  15  -0.783 -11.183   6.921
  114    HD3  ARG  15           1HD      ARG  15   0.629 -11.727   7.814
  115   HH11  ARG  15          1HH1      ARG  15   0.613 -13.240   9.423
  116   HH12  ARG  15          2HH1      ARG  15   0.683 -14.961   9.595
  117   HH21  ARG  15          1HH2      ARG  15  -1.136 -15.623   6.685
  118   HH22  ARG  15          2HH2      ARG  15  -0.309 -16.315   8.041
  119    H    TYR  16           H        TYR  16  -2.628  -8.254   6.596
  120    HA   TYR  16           HA       TYR  16  -1.007  -9.352   4.544
  121    HD1  TYR  16           1HD      TYR  16  -2.652 -10.714   4.734
  122    HD2  TYR  16           2HD      TYR  16  -5.168  -7.580   3.314
  123    HE1  TYR  16           1HE      TYR  16  -4.558 -12.238   4.754
  124    HE2  TYR  16           2HE      TYR  16  -7.082  -9.111   3.342
  125    HH   TYR  16           HH       TYR  16  -7.032 -12.119   3.238
  126    HB2  TYR  16           2HB      TYR  16  -2.985  -7.070   4.358
  127    HB3  TYR  16           1HB      TYR  16  -2.278  -7.910   2.989
  128    H    VAL  17           H        VAL  17  -0.765  -6.469   6.427
  129    HA   VAL  17           HA       VAL  17   1.054  -5.162   4.599
  130    HB   VAL  17           HB       VAL  17  -0.020  -4.465   7.304
  131   HG11  VAL  17          1HG1      VAL  17   1.677  -2.393   6.843
  132   HG12  VAL  17          2HG1      VAL  17   2.675  -3.757   6.360
  133   HG13  VAL  17          3HG1      VAL  17   1.990  -3.694   7.986
  134   HG21  VAL  17          3HG2      VAL  17  -0.618  -2.424   6.240
  135   HG22  VAL  17          1HG2      VAL  17  -1.092  -3.754   5.180
  136   HG23  VAL  17          2HG2      VAL  17   0.362  -2.815   4.829
  137    H    ASN  18           H        ASN  18   1.247  -6.971   7.640
  138    HA   ASN  18           HA       ASN  18   4.056  -6.691   7.900
  139    HB2  ASN  18           2HB      ASN  18   2.376  -8.900   9.081
  140    HB3  ASN  18           1HB      ASN  18   3.904  -8.269   9.687
  141   HD21  ASN  18          1HD2      ASN  18   3.255  -5.505   9.291
  142   HD22  ASN  18          2HD2      ASN  18   2.077  -5.086  10.483
  143    H    ARG  19           H        ARG  19   2.022  -8.973   6.176
  144    HA   ARG  19           HA       ARG  19   4.109 -10.899   5.818
  145    HE   ARG  19           HE       ARG  19   1.498 -15.505   5.278
  146    HB2  ARG  19           2HB      ARG  19   1.439 -11.054   5.664
  147    HB3  ARG  19           1HB      ARG  19   1.808 -10.850   3.956
  148    HG2  ARG  19           2HG      ARG  19   2.327 -12.986   3.806
  149    HG3  ARG  19           1HG      ARG  19   3.598 -12.771   5.007
  150    HD2  ARG  19           2HD      ARG  19   1.940 -13.113   6.789
  151    HD3  ARG  19           1HD      ARG  19   0.703 -13.382   5.562
  152   HH11  ARG  19          1HH1      ARG  19   3.909 -13.623   6.957
  153   HH12  ARG  19          2HH1      ARG  19   4.934 -14.984   7.271
  154   HH21  ARG  19          1HH2      ARG  19   2.843 -17.296   5.689
  155   HH22  ARG  19          2HH2      ARG  19   4.328 -17.070   6.550
  156    H    LEU  20           H        LEU  20   3.276  -7.973   4.231
  157    HA   LEU  20           HA       LEU  20   4.226  -8.615   1.638
  158    HG   LEU  20           HG       LEU  20   1.788  -6.724   2.828
  159    HB2  LEU  20           2HB      LEU  20   3.988  -5.939   3.000
  160    HB3  LEU  20           1HB      LEU  20   4.305  -6.165   1.293
  161   HD11  LEU  20          1HD1      LEU  20   0.805  -5.161   1.377
  162   HD12  LEU  20          2HD1      LEU  20   2.125  -5.288   0.212
  163   HD13  LEU  20          3HD1      LEU  20   2.386  -4.472   1.753
  164   HD21  LEU  20          3HD2      LEU  20   1.962  -8.698   1.520
  165   HD22  LEU  20          1HD2      LEU  20   2.569  -7.811   0.121
  166   HD23  LEU  20          2HD2      LEU  20   0.892  -7.621   0.626
  167    H    CYS  21           H        CYS  21   5.791  -6.951   4.383
  168    HA   CYS  21           HA       CYS  21   8.197  -6.385   3.094
  169    HG   CYS  21           HG       CYS  21   6.839  -4.566   4.839
  170    HB2  CYS  21           2HB      CYS  21   8.034  -7.152   6.012
  171    HB3  CYS  21           1HB      CYS  21   9.161  -6.045   5.245
  172    H    LYS  22           H        LYS  22   7.001  -9.336   4.505
  173    HA   LYS  22           HA       LYS  22   9.536 -10.704   4.216
  174    HB2  LYS  22           2HB      LYS  22   6.811 -11.812   4.901
  175    HB3  LYS  22           1HB      LYS  22   8.348 -12.653   5.065
  176    HG2  LYS  22           2HG      LYS  22   8.774 -11.711   7.041
  177    HG3  LYS  22           1HG      LYS  22   8.303 -10.106   6.480
  178    HD2  LYS  22           2HD      LYS  22   6.788 -10.676   8.209
  179    HD3  LYS  22           1HD      LYS  22   5.904 -10.873   6.694
  180    HE2  LYS  22           2HE      LYS  22   5.374 -12.769   7.973
  181    HE3  LYS  22           1HE      LYS  22   6.568 -13.315   6.794
  182    HZ1  LYS  22           3HZ      LYS  22   7.493 -14.196   8.638
  183    HZ2  LYS  22           1HZ      LYS  22   6.791 -13.067   9.686
  184    HZ3  LYS  22           2HZ      LYS  22   8.166 -12.652   8.791
  185    H    HIS  23           H        HIS  23   6.732 -10.086   2.328
  186    HA   HIS  23           HA       HIS  23   7.068 -12.348   0.574
  187    HD1  HIS  23           1HD      HIS  23   6.173 -11.513  -2.343
  188    HD2  HIS  23           2HD      HIS  23   3.123 -12.910   0.108
  189    HE1  HIS  23           1HE      HIS  23   4.862 -13.127  -3.757
  190    HE2  HIS  23           2HE      HIS  23   3.078 -14.031  -2.223
  191    HB2  HIS  23           2HB      HIS  23   4.853 -11.175   1.219
  192    HB3  HIS  23           1HB      HIS  23   5.303  -9.990  -0.003
  193    H    TRP  24           H        TRP  24   7.107  -8.785   0.020
  194    HA   TRP  24           HA       TRP  24   8.558  -9.261  -2.461
  195    HD1  TRP  24           HD       TRP  24   5.105  -8.215  -1.086
  196    HE1  TRP  24           1HE      TRP  24   3.332  -8.574  -2.917
  197    HE3  TRP  24           3HE      TRP  24   7.911  -7.002  -5.184
  198    HZ2  TRP  24           2HZ      TRP  24   3.147  -8.370  -5.726
  199    HZ3  TRP  24           3HZ      TRP  24   6.861  -7.110  -7.407
  200    HH2  TRP  24           HH       TRP  24   4.527  -7.781  -7.670
  201    HB2  TRP  24           2HB      TRP  24   7.462  -6.737  -1.217
  202    HB3  TRP  24           1HB      TRP  24   8.291  -6.800  -2.769
  203    H    GLY  25           H        GLY  25   9.405  -8.687   0.787
  204    HA2  GLY  25           2HA      GLY  25  11.651  -6.988   0.389
  205    HA3  GLY  25           1HA      GLY  25  11.355  -7.995   1.790
  206    H    HIS  26           H        HIS  26  12.210  -8.433  -1.643
  207    HA   HIS  26           HA       HIS  26  14.115 -10.508  -0.789
  208    HD1  HIS  26           1HD      HIS  26  12.621 -11.951  -0.214
  209    HD2  HIS  26           2HD      HIS  26  13.174 -13.404  -4.069
  210    HE1  HIS  26           1HE      HIS  26  12.369 -14.447  -0.035
  211    HE2  HIS  26           2HE      HIS  26  12.793 -15.311  -2.364
  212    HB2  HIS  26           2HB      HIS  26  12.206 -10.354  -2.985
  213    HB3  HIS  26           1HB      HIS  26  13.830 -10.742  -3.545
  214    H    LYS  27           H        LYS  27  13.695  -7.545  -2.587
  215    HA   LYS  27           HA       LYS  27  16.598  -7.207  -2.648
  216    HB2  LYS  27           2HB      LYS  27  16.205  -8.266  -4.781
  217    HB3  LYS  27           1HB      LYS  27  14.862  -7.190  -5.128
  218    HG2  LYS  27           2HG      LYS  27  17.377  -5.775  -4.662
  219    HG3  LYS  27           1HG      LYS  27  17.431  -6.893  -6.025
  220    HD2  LYS  27           2HD      LYS  27  15.084  -5.078  -5.755
  221    HD3  LYS  27           1HD      LYS  27  16.613  -4.408  -6.329
  222    HE2  LYS  27           2HE      LYS  27  16.065  -6.885  -7.671
  223    HE3  LYS  27           1HE      LYS  27  14.675  -5.809  -7.809
  224    HZ1  LYS  27           3HZ      LYS  27  16.641  -4.116  -8.350
  225    HZ2  LYS  27           1HZ      LYS  27  15.857  -5.026  -9.541
  226    HZ3  LYS  27           2HZ      LYS  27  17.346  -5.543  -8.926
  227    H    PHE  28           H        PHE  28  14.073  -5.997  -1.418
  228    HA   PHE  28           HA       PHE  28  14.805  -3.232  -2.005
  229    HD1  PHE  28           1HD      PHE  28  13.463  -1.255  -3.496
  230    HD2  PHE  28           2HD      PHE  28  12.288  -5.250  -4.375
  231    HE1  PHE  28           1HE      PHE  28  13.700  -0.791  -5.900
  232    HE2  PHE  28           2HE      PHE  28  12.521  -4.793  -6.782
  233    HZ   PHE  28           HZ       PHE  28  13.229  -2.561  -7.548
  234    HB2  PHE  28           2HB      PHE  28  12.042  -4.400  -2.190
  235    HB3  PHE  28           1HB      PHE  28  12.288  -2.691  -1.838
  236    H    GLU  29           H        GLU  29  14.237  -1.730  -0.348
  237    HA   GLU  29           HA       GLU  29  14.527  -2.872   2.272
  238    HB2  GLU  29           2HB      GLU  29  14.334  -0.420   2.979
  239    HB3  GLU  29           1HB      GLU  29  15.702  -0.861   1.965
  240    HG2  GLU  29           2HG      GLU  29  13.357  -0.027   0.452
  241    HG3  GLU  29           1HG      GLU  29  13.984   1.216   1.533
  242    H    VAL  30           H        VAL  30  12.813  -3.836   3.162
  243    HA   VAL  30           HA       VAL  30  10.239  -2.413   3.068
  244    HB   VAL  30           HB       VAL  30   9.472  -4.910   3.755
  245   HG11  VAL  30          1HG1      VAL  30   9.746  -3.623   1.072
  246   HG12  VAL  30          2HG1      VAL  30   8.301  -3.878   2.054
  247   HG13  VAL  30          3HG1      VAL  30   9.061  -5.239   1.234
  248   HG21  VAL  30          3HG2      VAL  30  11.609  -5.440   1.715
  249   HG22  VAL  30          1HG2      VAL  30  10.643  -6.595   2.635
  250   HG23  VAL  30          2HG2      VAL  30  11.888  -5.645   3.447
  251    H    GLU  31           H        GLU  31   9.766  -1.479   4.951
  252    HA   GLU  31           HA       GLU  31  10.860  -2.577   7.423
  253    HB2  GLU  31           2HB      GLU  31  10.112   0.052   6.486
  254    HB3  GLU  31           1HB      GLU  31   9.310  -0.306   8.009
  255    HG2  GLU  31           2HG      GLU  31  11.176   0.028   9.149
  256    HG3  GLU  31           1HG      GLU  31  12.071  -1.090   8.120
  257    H    LEU  32           H        LEU  32   9.630  -3.400   9.059
  258    HA   LEU  32           HA       LEU  32   6.734  -3.649   8.530
  259    HG   LEU  32           HG       LEU  32   5.866  -6.340   8.436
  260    HB2  LEU  32           2HB      LEU  32   8.110  -5.754   8.200
  261    HB3  LEU  32           1HB      LEU  32   8.398  -5.750   9.928
  262   HD11  LEU  32          1HD1      LEU  32   7.786  -7.746  10.083
  263   HD12  LEU  32          2HD1      LEU  32   6.542  -8.378   9.005
  264   HD13  LEU  32          3HD1      LEU  32   6.136  -7.958  10.667
  265   HD21  LEU  32          3HD2      LEU  32   6.065  -5.364  11.283
  266   HD22  LEU  32          1HD2      LEU  32   4.700  -6.293  10.670
  267   HD23  LEU  32          2HD2      LEU  32   5.067  -4.713   9.984
  268    H    THR  33           H        THR  33   5.733  -2.371   9.901
  269    HA   THR  33           HA       THR  33   6.443  -2.574  12.774
  270    HB   THR  33           HB       THR  33   5.364  -0.097  12.647
  271    HG1  THR  33           1HG      THR  33   5.256  -0.145  10.363
  272   HG21  THR  33          3HG2      THR  33   7.565  -0.733  13.635
  273   HG22  THR  33          1HG2      THR  33   7.529   0.844  12.847
  274   HG23  THR  33          2HG2      THR  33   8.271  -0.533  12.032
  275    HA   PRO  34           HA       PRO  34   2.128  -3.344  13.263
  276    HB2  PRO  34           2HB      PRO  34   1.523  -2.251  15.637
  277    HB3  PRO  34           1HB      PRO  34   2.603  -3.636  15.484
  278    HG2  PRO  34           2HG      PRO  34   3.271  -0.762  15.918
  279    HG3  PRO  34           1HG      PRO  34   4.015  -2.205  16.627
  280    HD2  PRO  34           2HD      PRO  34   5.049  -0.784  14.491
  281    HD3  PRO  34           1HD      PRO  34   5.429  -2.478  14.858
  282    H    GLU  35           H        GLU  35   2.415  -1.336  11.487
  283    HA   GLU  35           HA       GLU  35   0.004   0.166  11.866
  284    HB2  GLU  35           2HB      GLU  35   2.651   1.621  11.686
  285    HB3  GLU  35           1HB      GLU  35   1.073   2.384  11.528
  286    HG2  GLU  35           2HG      GLU  35   0.568   1.471  13.836
  287    HG3  GLU  35           1HG      GLU  35   2.288   1.098  13.948
  288    H    ARG  36           H        ARG  36   2.911  -0.368   9.852
  289    HA   ARG  36           HA       ARG  36   1.331  -0.757   7.544
  290    HE   ARG  36           HE       ARG  36   4.633   4.231   7.558
  291    HB2  ARG  36           2HB      ARG  36   2.179   1.201   6.245
  292    HB3  ARG  36           1HB      ARG  36   1.060   1.626   7.531
  293    HG2  ARG  36           2HG      ARG  36   3.220   1.986   8.932
  294    HG3  ARG  36           1HG      ARG  36   4.004   2.083   7.353
  295    HD2  ARG  36           2HD      ARG  36   2.098   3.771   6.815
  296    HD3  ARG  36           1HD      ARG  36   1.954   3.885   8.569
  297   HH11  ARG  36          1HH1      ARG  36   1.639   5.814   8.407
  298   HH12  ARG  36          2HH1      ARG  36   2.383   7.357   8.658
  299   HH21  ARG  36          1HH2      ARG  36   5.610   6.261   7.887
  300   HH22  ARG  36          2HH2      ARG  36   4.634   7.613   8.361
  301    H    GLY  37           H        GLY  37   2.643  -0.845   5.529
  302    HA2  GLY  37           2HA      GLY  37   5.288  -2.009   6.134
  303    HA3  GLY  37           1HA      GLY  37   4.272  -2.468   4.773
  304    H    PHE  38           H        PHE  38   6.977  -0.652   5.555
  305    HA   PHE  38           HA       PHE  38   6.515   1.366   3.469
  306    HD1  PHE  38           1HD      PHE  38   7.107   3.859   3.640
  307    HD2  PHE  38           2HD      PHE  38  10.713   1.933   4.850
  308    HE1  PHE  38           1HE      PHE  38   8.414   5.690   2.664
  309    HE2  PHE  38           2HE      PHE  38  12.021   3.754   3.851
  310    HZ   PHE  38           HZ       PHE  38  10.875   5.636   2.754
  311    HB2  PHE  38           2HB      PHE  38   7.323   2.132   5.654
  312    HB3  PHE  38           1HB      PHE  38   8.703   1.054   5.541
  313    H    ILE  39           H        ILE  39   7.284   1.067   1.516
  314    HA   ILE  39           HA       ILE  39   9.702  -0.585   1.140
  315    HB   ILE  39           HB       ILE  39   7.510  -0.752  -0.896
  316   HG12  ILE  39          2HG1      ILE  39   7.612  -2.250   1.721
  317   HG13  ILE  39          1HG1      ILE  39   6.231  -1.482   0.946
  318   HG21  ILE  39          1HG2      ILE  39  10.101  -1.872  -0.510
  319   HG22  ILE  39          2HG2      ILE  39   9.009  -2.053  -1.882
  320   HG23  ILE  39          3HG2      ILE  39   8.920  -3.182  -0.531
  321   HD11  ILE  39          3HD1      ILE  39   6.080  -3.236  -0.668
  322   HD12  ILE  39          1HD1      ILE  39   6.156  -3.952   0.941
  323   HD13  ILE  39          2HD1      ILE  39   7.583  -3.959  -0.093
  324    H    ASP  40           H        ASP  40  11.105   1.024   0.496
  325    HA   ASP  40           HA       ASP  40  10.135   2.893  -1.551
  326    HB2  ASP  40           2HB      ASP  40  12.359   4.104  -0.918
  327    HB3  ASP  40           1HB      ASP  40  10.960   4.237   0.137
  328    H    PHE  41           H        PHE  41  10.943   2.932  -3.511
  329    HA   PHE  41           HA       PHE  41  13.021   0.966  -4.196
  330    HD1  PHE  41           1HD      PHE  41  11.154  -0.123  -3.588
  331    HD2  PHE  41           2HD      PHE  41  10.468   0.321  -7.770
  332    HE1  PHE  41           1HE      PHE  41   9.991  -2.282  -3.624
  333    HE2  PHE  41           2HE      PHE  41   9.305  -1.846  -7.806
  334    HZ   PHE  41           HZ       PHE  41   9.065  -3.149  -5.733
  335    HB2  PHE  41           2HB      PHE  41  10.846   2.354  -5.746
  336    HB3  PHE  41           1HB      PHE  41  12.209   1.633  -6.584
  337    H    GLY  42           H        GLY  42  13.131   3.956  -3.179
  338    HA2  GLY  42           2HA      GLY  42  15.237   5.156  -3.394
  339    HA3  GLY  42           1HA      GLY  42  15.207   4.777  -5.111
  340    H    ASP  43           H        ASP  43  14.092   6.090  -6.504
  341    HA   ASP  43           HA       ASP  43  13.161   8.625  -5.418
  342    HB2  ASP  43           2HB      ASP  43  14.519   7.997  -7.713
  343    HB3  ASP  43           1HB      ASP  43  12.871   8.148  -8.316
  344    H    SER  44           H        SER  44  11.553   6.839  -4.454
  345    HA   SER  44           HA       SER  44   8.978   7.496  -5.056
  346    HG   SER  44           HG       SER  44  10.361   5.437  -7.969
  347    HB2  SER  44           2HB      SER  44   8.443   5.137  -6.247
  348    HB3  SER  44           1HB      SER  44   8.808   6.595  -7.170
  349    H    ASN  45           H        ASN  45   7.384   6.023  -3.886
  350    HA   ASN  45           HA       ASN  45   8.587   3.905  -2.311
  351    HB2  ASN  45           2HB      ASN  45   7.259   6.133  -0.779
  352    HB3  ASN  45           1HB      ASN  45   8.308   4.859  -0.172
  353   HD21  ASN  45          1HD2      ASN  45   8.351   7.656  -2.353
  354   HD22  ASN  45          2HD2      ASN  45   9.955   8.155  -1.952
  355    H    CYS  46           H        CYS  46   6.893   2.892  -0.821
  356    HA   CYS  46           HA       CYS  46   4.150   3.400  -1.621
  357    HG   CYS  46           HG       CYS  46   6.278   0.965  -3.956
  358    HB2  CYS  46           2HB      CYS  46   4.260   0.633  -1.823
  359    HB3  CYS  46           1HB      CYS  46   4.119   1.769  -3.159
  360    H    GLU  47           H        GLU  47   3.414   3.758   0.397
  361    HA   GLU  47           HA       GLU  47   4.107   1.863   2.522
  362    HB2  GLU  47           2HB      GLU  47   4.218   4.528   2.597
  363    HB3  GLU  47           1HB      GLU  47   2.529   4.347   3.040
  364    HG2  GLU  47           2HG      GLU  47   3.021   3.452   5.081
  365    HG3  GLU  47           1HG      GLU  47   4.550   2.755   4.542
  366    H    LEU  48           H        LEU  48   2.409   1.000   3.886
  367    HA   LEU  48           HA       LEU  48  -0.306   1.197   2.822
  368    HG   LEU  48           HG       LEU  48  -0.950  -2.086   3.756
  369    HB2  LEU  48           2HB      LEU  48   0.613  -0.689   1.610
  370    HB3  LEU  48           1HB      LEU  48   1.193  -1.419   3.092
  371   HD11  LEU  48          1HD1      LEU  48  -2.965  -1.331   2.283
  372   HD12  LEU  48          2HD1      LEU  48  -1.920   0.037   1.901
  373   HD13  LEU  48          3HD1      LEU  48  -2.367  -0.293   3.576
  374   HD21  LEU  48          3HD2      LEU  48  -0.375  -2.464   0.874
  375   HD22  LEU  48          1HD2      LEU  48  -1.962  -2.954   1.466
  376   HD23  LEU  48          2HD2      LEU  48  -0.504  -3.648   2.174
  377    H    LEU  49           H        LEU  49  -1.577   1.666   4.468
  378    HA   LEU  49           HA       LEU  49  -0.778   0.904   7.186
  379    HG   LEU  49           HG       LEU  49  -2.089   1.783   8.961
  380    HB2  LEU  49           2HB      LEU  49  -1.677   3.243   6.474
  381    HB3  LEU  49           1HB      LEU  49  -3.246   2.463   6.519
  382   HD11  LEU  49          1HD1      LEU  49  -1.866   4.589   9.312
  383   HD12  LEU  49          2HD1      LEU  49  -0.796   4.117   7.993
  384   HD13  LEU  49          3HD1      LEU  49  -0.645   3.344   9.570
  385   HD21  LEU  49          3HD2      LEU  49  -4.413   2.256   8.692
  386   HD22  LEU  49          1HD2      LEU  49  -4.078   3.913   8.192
  387   HD23  LEU  49          2HD2      LEU  49  -3.763   3.413   9.853
  388    H    ALA  50           H        ALA  50  -1.761  -0.688   8.326
  389    HA   ALA  50           HA       ALA  50  -4.307  -1.712   7.326
  390    HB1  ALA  50           3HB      ALA  50  -3.496  -3.991   7.268
  391    HB2  ALA  50           1HB      ALA  50  -1.877  -3.441   7.692
  392    HB3  ALA  50           2HB      ALA  50  -2.603  -2.967   6.155
  393    H    HIS  51           H        HIS  51  -5.634  -1.694   8.959
  394    HA   HIS  51           HA       HIS  51  -4.686  -2.549  11.579
  395    HD1  HIS  51           1HD      HIS  51  -7.624  -0.042  13.747
  396    HD2  HIS  51           2HD      HIS  51  -3.685  -1.254  13.195
  397    HE1  HIS  51           1HE      HIS  51  -6.512   0.240  15.983
  398    HE2  HIS  51           2HE      HIS  51  -4.153  -0.570  15.642
  399    HB2  HIS  51           2HB      HIS  51  -5.868  -0.138  10.956
  400    HB3  HIS  51           1HB      HIS  51  -7.246  -1.089  11.492
  401    HA   PRO  52           HA       PRO  52  -7.248  -6.094  11.844
  402    HB2  PRO  52           2HB      PRO  52  -8.939  -4.633  13.834
  403    HB3  PRO  52           1HB      PRO  52  -8.264  -6.266  13.909
  404    HG2  PRO  52           2HG      PRO  52  -7.101  -4.297  15.237
  405    HG3  PRO  52           1HG      PRO  52  -6.118  -5.499  14.384
  406    HD2  PRO  52           2HD      PRO  52  -6.724  -2.677  13.639
  407    HD3  PRO  52           1HD      PRO  52  -5.251  -3.621  13.358
  408    H    ASP  53           H        ASP  53  -8.881  -3.049  11.181
  409    HA   ASP  53           HA       ASP  53 -10.830  -4.591   9.652
  410    HB2  ASP  53           2HB      ASP  53 -11.770  -2.325  11.405
  411    HB3  ASP  53           1HB      ASP  53 -12.744  -3.511  10.542
  412    H    HIS  54           H        HIS  54  -8.641  -2.112   9.545
  413    HA   HIS  54           HA       HIS  54  -9.957  -1.175   7.133
  414    HD1  HIS  54           1HD      HIS  54 -10.110   0.352  11.179
  415    HD2  HIS  54           2HD      HIS  54  -7.061   1.925   8.835
  416    HE1  HIS  54           1HE      HIS  54  -8.469   1.356  12.796
  417    HE2  HIS  54           2HE      HIS  54  -6.580   2.207  11.361
  418    HB2  HIS  54           2HB      HIS  54  -9.495   1.212   7.620
  419    HB3  HIS  54           1HB      HIS  54 -10.690   0.494   8.685
  420    H    VAL  55           H        VAL  55  -8.524  -0.055   5.611
  421    HA   VAL  55           HA       VAL  55  -5.678  -0.387   6.165
  422    HB   VAL  55           HB       VAL  55  -6.830  -2.366   4.864
  423   HG11  VAL  55          1HG1      VAL  55  -7.161  -2.174   2.616
  424   HG12  VAL  55          2HG1      VAL  55  -6.037  -0.826   2.452
  425   HG13  VAL  55          3HG1      VAL  55  -7.640  -0.559   3.134
  426   HG21  VAL  55          3HG2      VAL  55  -4.433  -2.133   5.380
  427   HG22  VAL  55          1HG2      VAL  55  -4.233  -1.193   3.901
  428   HG23  VAL  55          2HG2      VAL  55  -4.731  -2.883   3.812
  429    H    LEU  56           H        LEU  56  -4.410   1.129   5.249
  430    HA   LEU  56           HA       LEU  56  -5.703   3.087   3.463
  431    HG   LEU  56           HG       LEU  56  -6.452   4.689   5.401
  432    HB2  LEU  56           2HB      LEU  56  -4.400   3.472   6.010
  433    HB3  LEU  56           1HB      LEU  56  -3.513   4.327   4.771
  434   HD11  LEU  56          1HD1      LEU  56  -5.883   6.678   6.509
  435   HD12  LEU  56          2HD1      LEU  56  -4.223   6.638   5.913
  436   HD13  LEU  56          3HD1      LEU  56  -4.757   5.467   7.121
  437   HD21  LEU  56          3HD2      LEU  56  -5.872   6.859   4.018
  438   HD22  LEU  56          1HD2      LEU  56  -6.355   5.371   3.207
  439   HD23  LEU  56          2HD2      LEU  56  -4.649   5.812   3.303
  440    H    MET  57           H        MET  57  -4.474   3.912   1.773
  441    HA   MET  57           HA       MET  57  -1.888   2.589   1.334
  442    HB2  MET  57           2HB      MET  57  -3.784   3.175  -0.914
  443    HB3  MET  57           1HB      MET  57  -2.416   2.068  -0.885
  444    HG2  MET  57           2HG      MET  57  -3.616   0.607   0.669
  445    HG3  MET  57           1HG      MET  57  -4.984   1.720   0.646
  446    HE1  MET  57           3HE      MET  57  -4.690   2.398  -2.740
  447    HE2  MET  57           1HE      MET  57  -4.437   0.922  -3.670
  448    HE3  MET  57           2HE      MET  57  -3.152   1.543  -2.635
  449    H    ILE  58           H        ILE  58  -0.321   4.096   1.349
  450    HA   ILE  58           HA       ILE  58  -0.870   6.654   0.007
  451    HB   ILE  58           HB       ILE  58   0.932   6.260   2.402
  452   HG12  ILE  58          2HG1      ILE  58  -1.921   6.579   2.286
  453   HG13  ILE  58          1HG1      ILE  58  -0.893   6.403   3.696
  454   HG21  ILE  58          1HG2      ILE  58   0.021   8.775   1.015
  455   HG22  ILE  58          2HG2      ILE  58   1.622   8.043   0.881
  456   HG23  ILE  58          3HG2      ILE  58   1.074   8.686   2.427
  457   HD11  ILE  58          3HD1      ILE  58  -2.403   8.476   3.491
  458   HD12  ILE  58          1HD1      ILE  58  -1.178   9.066   2.367
  459   HD13  ILE  58          2HD1      ILE  58  -0.738   8.683   4.031
  460    H    LEU  59           H        LEU  59   0.666   7.365  -1.401
  461    HA   LEU  59           HA       LEU  59   3.110   5.743  -1.623
  462    HG   LEU  59           HG       LEU  59   1.349   6.889  -5.339
  463    HB2  LEU  59           2HB      LEU  59   2.998   5.717  -3.944
  464    HB3  LEU  59           1HB      LEU  59   1.348   5.420  -3.445
  465   HD11  LEU  59          1HD1      LEU  59  -0.324   7.251  -3.585
  466   HD12  LEU  59          2HD1      LEU  59   0.067   8.727  -4.469
  467   HD13  LEU  59          3HD1      LEU  59   0.733   8.462  -2.860
  468   HD21  LEU  59          3HD2      LEU  59   2.616   9.179  -4.024
  469   HD22  LEU  59          1HD2      LEU  59   2.708   8.632  -5.692
  470   HD23  LEU  59          2HD2      LEU  59   3.711   7.872  -4.462
  471    H    ASN  60           H        ASN  60   5.013   6.773  -2.140
  472    HA   ASN  60           HA       ASN  60   4.893   9.720  -2.194
  473    HB2  ASN  60           2HB      ASN  60   7.122   8.081  -0.964
  474    HB3  ASN  60           1HB      ASN  60   6.949   9.833  -0.925
  475   HD21  ASN  60          1HD2      ASN  60   7.279   9.193   1.420
  476   HD22  ASN  60          2HD2      ASN  60   5.847   8.925   2.347
  477    H    SER  61           H        SER  61   5.183  10.128  -4.315
  478    HA   SER  61           HA       SER  61   7.696   9.148  -5.502
  479    HG   SER  61           HG       SER  61   4.942   6.856  -6.517
  480    HB2  SER  61           2HB      SER  61   5.416   8.992  -7.357
  481    HB3  SER  61           1HB      SER  61   6.796   7.915  -7.168
  482    HA   PRO  62           HA       PRO  62   7.941  13.321  -7.007
  483    HB2  PRO  62           2HB      PRO  62   9.916  12.926  -8.810
  484    HB3  PRO  62           1HB      PRO  62  10.173  12.994  -7.067
  485    HG2  PRO  62           2HG      PRO  62   9.884  10.581  -8.822
  486    HG3  PRO  62           1HG      PRO  62  11.099  10.909  -7.568
  487    HD2  PRO  62           2HD      PRO  62   8.980   9.368  -7.072
  488    HD3  PRO  62           1HD      PRO  62   9.610  10.479  -5.845
  489    H    ASP  63           H        ASP  63   6.875  10.676  -8.925
  490    HA   ASP  63           HA       ASP  63   5.910  12.608 -10.899
  491    HB2  ASP  63           2HB      ASP  63   7.732  11.772 -12.101
  492    HB3  ASP  63           1HB      ASP  63   7.539  10.147 -11.462
  493    H    GLU  64           H        GLU  64   3.912  12.014 -11.911
  494    HA   GLU  64           HA       GLU  64   2.199  10.498 -10.218
  495    HB2  GLU  64           2HB      GLU  64   1.601  12.329 -12.058
  496    HB3  GLU  64           1HB      GLU  64   1.385  10.902 -13.068
  497    HG2  GLU  64           2HG      GLU  64   0.074  10.158 -10.844
  498    HG3  GLU  64           1HG      GLU  64  -0.200  11.896 -10.808
  499    H    ASP  65           H        ASP  65   3.813   9.587 -13.304
  500    HA   ASP  65           HA       ASP  65   2.619   7.134 -13.743
  501    HB2  ASP  65           2HB      ASP  65   4.461   8.263 -15.109
  502    HB3  ASP  65           1HB      ASP  65   5.597   7.589 -13.942
  503    H    SER  66           H        SER  66   5.487   7.836 -11.789
  504    HA   SER  66           HA       SER  66   5.779   5.307 -10.597
  505    HG   SER  66           HG       SER  66   8.246   7.639 -10.884
  506    HB2  SER  66           2HB      SER  66   6.574   8.080  -9.711
  507    HB3  SER  66           1HB      SER  66   6.975   6.642  -8.773
  508    H    LEU  67           H        LEU  67   4.386   8.277  -9.380
  509    HA   LEU  67           HA       LEU  67   3.308   7.649  -6.998
  510    HG   LEU  67           HG       LEU  67   1.066   9.338  -6.527
  511    HB2  LEU  67           2HB      LEU  67   3.132   9.849  -7.791
  512    HB3  LEU  67           1HB      LEU  67   2.324   9.357  -9.249
  513   HD11  LEU  67          1HD1      LEU  67   1.460  11.446  -8.485
  514   HD12  LEU  67          2HD1      LEU  67   1.033  11.545  -6.777
  515   HD13  LEU  67          3HD1      LEU  67  -0.216  11.239  -7.983
  516   HD21  LEU  67          3HD2      LEU  67   0.085   8.640  -9.247
  517   HD22  LEU  67          1HD2      LEU  67  -1.023   9.385  -8.097
  518   HD23  LEU  67          2HD2      LEU  67  -0.244   7.856  -7.701
  519    H    ALA  68           H        ALA  68   1.427   7.284 -10.022
  520    HA   ALA  68           HA       ALA  68  -0.663   5.859  -8.752
  521    HB1  ALA  68           3HB      ALA  68  -1.371   5.281 -11.060
  522    HB2  ALA  68           1HB      ALA  68   0.128   5.982 -11.668
  523    HB3  ALA  68           2HB      ALA  68  -1.053   7.003 -10.847
  524    H    HIS  69           H        HIS  69   2.311   4.875 -10.358
  525    HA   HIS  69           HA       HIS  69   1.852   2.151 -10.657
  526    HD1  HIS  69           1HD      HIS  69   6.334   2.122 -11.642
  527    HD2  HIS  69           2HD      HIS  69   2.973   0.028 -10.385
  528    HE1  HIS  69           1HE      HIS  69   6.861  -0.303 -12.051
  529    HE2  HIS  69           2HE      HIS  69   4.849  -1.556 -11.197
  530    HB2  HIS  69           2HB      HIS  69   3.874   3.484 -11.432
  531    HB3  HIS  69           1HB      HIS  69   4.494   3.330  -9.792
  532    H    MET  70           H        MET  70   2.824   4.013  -7.851
  533    HA   MET  70           HA       MET  70   3.191   1.698  -6.165
  534    HB2  MET  70           2HB      MET  70   2.866   4.509  -5.166
  535    HB3  MET  70           1HB      MET  70   3.828   3.221  -4.467
  536    HG2  MET  70           2HG      MET  70   4.609   4.112  -7.163
  537    HG3  MET  70           1HG      MET  70   4.849   5.253  -5.846
  538    HE1  MET  70           3HE      MET  70   7.195   1.666  -7.018
  539    HE2  MET  70           1HE      MET  70   5.622   2.196  -7.611
  540    HE3  MET  70           2HE      MET  70   5.722   1.101  -6.232
  541    H    GLN  71           H        GLN  71   0.815   4.421  -6.082
  542    HA   GLN  71           HA       GLN  71  -0.797   3.346  -4.110
  543    HB2  GLN  71           2HB      GLN  71  -2.690   4.668  -5.323
  544    HB3  GLN  71           1HB      GLN  71  -1.388   5.524  -4.525
  545    HG2  GLN  71           2HG      GLN  71  -0.830   6.518  -6.415
  546    HG3  GLN  71           1HG      GLN  71  -0.738   4.984  -7.272
  547   HE21  GLN  71          1HE2      GLN  71  -2.238   7.892  -7.198
  548   HE22  GLN  71          2HE2      GLN  71  -3.690   7.498  -8.047
  549    H    ASN  72           H        ASN  72  -0.601   2.447  -7.464
  550    HA   ASN  72           HA       ASN  72  -3.097   0.994  -7.417
  551    HB2  ASN  72           2HB      ASN  72  -1.814   2.087  -9.461
  552    HB3  ASN  72           1HB      ASN  72  -1.045   0.504  -9.526
  553   HD21  ASN  72          1HD2      ASN  72  -4.201   2.081  -9.420
  554   HD22  ASN  72          2HD2      ASN  72  -5.023   0.896 -10.370
  555    H    VAL  73           H        VAL  73   0.364   0.186  -7.376
  556    HA   VAL  73           HA       VAL  73   0.342  -2.531  -7.523
  557    HB   VAL  73           HB       VAL  73   2.022  -0.655  -5.889
  558   HG11  VAL  73          1HG1      VAL  73   1.978  -2.621  -4.511
  559   HG12  VAL  73          2HG1      VAL  73   3.526  -2.558  -5.353
  560   HG13  VAL  73          3HG1      VAL  73   2.265  -3.661  -5.907
  561   HG21  VAL  73          3HG2      VAL  73   3.505  -0.803  -7.582
  562   HG22  VAL  73          1HG2      VAL  73   2.078  -1.281  -8.502
  563   HG23  VAL  73          2HG2      VAL  73   3.172  -2.511  -7.870
  564    H    VAL  74           H        VAL  74  -0.421  -0.564  -4.684
  565    HA   VAL  74           HA       VAL  74  -0.811  -2.771  -2.925
  566    HB   VAL  74           HB       VAL  74  -1.846   0.057  -2.731
  567   HG11  VAL  74          1HG1      VAL  74  -1.682  -1.991  -0.526
  568   HG12  VAL  74          2HG1      VAL  74  -3.162  -1.584  -1.391
  569   HG13  VAL  74          3HG1      VAL  74  -2.341  -0.361  -0.425
  570   HG21  VAL  74          3HG2      VAL  74   0.266   0.572  -2.244
  571   HG22  VAL  74          1HG2      VAL  74   0.742  -1.128  -2.245
  572   HG23  VAL  74          2HG2      VAL  74   0.093  -0.394  -0.780
  573    H    ALA  75           H        ALA  75  -3.064  -0.741  -4.822
  574    HA   ALA  75           HA       ALA  75  -5.474  -1.777  -3.985
  575    HB1  ALA  75           3HB      ALA  75  -4.683  -0.971  -6.787
  576    HB2  ALA  75           1HB      ALA  75  -5.379   0.072  -5.545
  577    HB3  ALA  75           2HB      ALA  75  -6.339  -1.232  -6.241
  578    H    ASP  76           H        ASP  76  -2.999  -3.216  -5.916
  579    HA   ASP  76           HA       ASP  76  -4.590  -5.383  -6.921
  580    HB2  ASP  76           2HB      ASP  76  -2.334  -4.383  -7.826
  581    HB3  ASP  76           1HB      ASP  76  -1.607  -5.529  -6.704
  582    H    HIS  77           H        HIS  77  -2.321  -4.929  -4.241
  583    HA   HIS  77           HA       HIS  77  -2.193  -7.590  -3.389
  584    HD1  HIS  77           1HD      HIS  77  -0.598  -6.361  -4.690
  585    HD2  HIS  77           2HD      HIS  77   0.941  -4.635  -1.237
  586    HE1  HIS  77           1HE      HIS  77   1.676  -5.498  -5.325
  587    HE2  HIS  77           2HE      HIS  77   2.551  -4.380  -3.245
  588    HB2  HIS  77           2HB      HIS  77  -1.991  -5.152  -1.616
  589    HB3  HIS  77           1HB      HIS  77  -1.330  -6.748  -1.301
  590    H    LEU  78           H        LEU  78  -4.485  -5.020  -2.518
  591    HA   LEU  78           HA       LEU  78  -5.846  -6.517  -0.535
  592    HG   LEU  78           HG       LEU  78  -5.072  -3.276  -0.750
  593    HB2  LEU  78           2HB      LEU  78  -6.717  -4.147  -2.191
  594    HB3  LEU  78           1HB      LEU  78  -7.655  -4.812  -0.873
  595   HD11  LEU  78          1HD1      LEU  78  -7.598  -3.011   0.858
  596   HD12  LEU  78          2HD1      LEU  78  -7.321  -2.167  -0.665
  597   HD13  LEU  78          3HD1      LEU  78  -6.270  -1.860   0.717
  598   HD21  LEU  78          3HD2      LEU  78  -5.320  -3.846   1.796
  599   HD22  LEU  78          1HD2      LEU  78  -4.445  -4.938   0.724
  600   HD23  LEU  78          2HD2      LEU  78  -6.107  -5.301   1.188
  601    H    GLN  79           H        GLN  79  -5.918  -6.576  -3.972
  602    HA   GLN  79           HA       GLN  79  -8.574  -7.526  -4.304
  603    HB2  GLN  79           2HB      GLN  79  -6.179  -7.813  -6.122
  604    HB3  GLN  79           1HB      GLN  79  -7.845  -8.139  -6.578
  605    HG2  GLN  79           2HG      GLN  79  -7.593  -5.504  -5.453
  606    HG3  GLN  79           1HG      GLN  79  -6.469  -5.729  -6.789
  607   HE21  GLN  79          1HE2      GLN  79  -8.320  -3.899  -7.176
  608   HE22  GLN  79          2HE2      GLN  79  -9.556  -4.448  -8.250
  609    H    ARG  80           H        ARG  80  -5.482  -9.288  -4.669
  610    HA   ARG  80           HA       ARG  80  -6.564 -11.819  -4.910
  611    HE   ARG  80           HE       ARG  80  -4.151 -11.702  -1.604
  612    HB2  ARG  80           2HB      ARG  80  -4.308 -12.561  -3.835
  613    HB3  ARG  80           1HB      ARG  80  -4.318 -11.771  -5.405
  614    HG2  ARG  80           2HG      ARG  80  -3.029 -10.144  -4.660
  615    HG3  ARG  80           1HG      ARG  80  -4.126  -9.810  -3.318
  616    HD2  ARG  80           2HD      ARG  80  -1.917 -11.862  -3.387
  617    HD3  ARG  80           1HD      ARG  80  -1.941 -10.369  -2.453
  618   HH11  ARG  80          1HH1      ARG  80  -0.766 -12.520  -1.838
  619   HH12  ARG  80          2HH1      ARG  80  -0.805 -13.602  -0.486
  620   HH21  ARG  80          1HH2      ARG  80  -4.205 -13.125   0.175
  621   HH22  ARG  80          2HH2      ARG  80  -2.758 -13.947   0.656
  622    H    MET  81           H        MET  81  -6.008  -9.954  -1.986
  623    HA   MET  81           HA       MET  81  -6.489 -12.214  -0.268
  624    HB2  MET  81           2HB      MET  81  -6.383 -10.614   1.573
  625    HB3  MET  81           1HB      MET  81  -5.018 -10.451   0.489
  626    HG2  MET  81           2HG      MET  81  -5.657  -8.273   1.086
  627    HG3  MET  81           1HG      MET  81  -6.209  -8.510  -0.567
  628    HE1  MET  81           3HE      MET  81  -8.091  -7.256   3.080
  629    HE2  MET  81           1HE      MET  81  -8.113  -6.100   1.748
  630    HE3  MET  81           2HE      MET  81  -6.605  -6.894   2.203
  631    H    ALA  82           H        ALA  82  -8.473 -10.058  -1.977
  632    HA   ALA  82           HA       ALA  82 -10.795 -10.927  -0.372
  633    HB1  ALA  82           3HB      ALA  82 -11.767  -8.642  -1.279
  634    HB2  ALA  82           1HB      ALA  82 -10.061  -8.196  -1.298
  635    HB3  ALA  82           2HB      ALA  82 -10.819  -8.716   0.208
  636    H    ASN  83           H        ASN  83 -10.790 -12.667  -1.996
  637    HA   ASN  83           HA       ASN  83 -11.238 -12.157  -4.741
  638    HB2  ASN  83           2HB      ASN  83 -10.510 -14.350  -3.538
  639    HB3  ASN  83           1HB      ASN  83 -12.240 -14.631  -3.364
  640   HD21  ASN  83          1HD2      ASN  83 -10.045 -15.925  -4.969
  641   HD22  ASN  83          2HD2      ASN  83 -10.677 -15.995  -6.575
  642    H    SER  84           H        SER  84 -12.931 -11.083  -5.504
  643    HA   SER  84           HA       SER  84 -15.540 -11.995  -5.418
  644    HG   SER  84           HG       SER  84 -15.187  -9.285  -2.408
  645    HB2  SER  84           2HB      SER  84 -16.522 -10.087  -3.971
  646    HB3  SER  84           1HB      SER  84 -15.826 -11.478  -3.142
  647    H    GLU  85           H        GLU  85 -14.330  -8.685  -4.930
  648    HA   GLU  85           HA       GLU  85 -15.145  -8.061  -7.693
  649    HB2  GLU  85           2HB      GLU  85 -15.944  -5.906  -6.980
  650    HB3  GLU  85           1HB      GLU  85 -16.715  -7.134  -5.985
  651    HG2  GLU  85           2HG      GLU  85 -14.281  -6.251  -4.743
  652    HG3  GLU  85           1HG      GLU  85 -15.302  -4.869  -5.138
  653    H    SER  86           H        SER  86 -14.060  -6.027  -8.524
  654    HA   SER  86           HA       SER  86 -11.238  -6.279  -8.146
  655    HG   SER  86           HG       SER  86 -10.736  -3.432  -9.589
  656    HB2  SER  86           2HB      SER  86 -12.255  -5.661 -10.328
  657    HB3  SER  86           1HB      SER  86 -12.773  -4.128  -9.630
  658    H    LEU  87           H        LEU  87 -11.465  -5.919  -5.794
  659    HA   LEU  87           HA       LEU  87 -11.682  -4.561  -3.903
  660    HG   LEU  87           HG       LEU  87  -8.209  -4.765  -3.276
  661    HB2  LEU  87           2HB      LEU  87  -9.182  -4.399  -5.281
  662    HB3  LEU  87           1HB      LEU  87  -9.518  -2.843  -4.541
  663   HD11  LEU  87          1HD1      LEU  87 -10.104  -2.690  -2.256
  664   HD12  LEU  87          2HD1      LEU  87  -8.339  -2.687  -2.267
  665   HD13  LEU  87          3HD1      LEU  87  -9.213  -3.713  -1.128
  666   HD21  LEU  87          3HD2      LEU  87 -11.049  -5.256  -2.390
  667   HD22  LEU  87          1HD2      LEU  87  -9.588  -5.992  -1.737
  668   HD23  LEU  87          2HD2      LEU  87 -10.100  -6.365  -3.381
  669    H    GLU  88           H        GLU  88 -13.287  -3.161  -3.578
  670    HA   GLU  88           HA       GLU  88 -13.651  -0.835  -5.209
  671    HB2  GLU  88           2HB      GLU  88 -15.513  -1.946  -3.965
  672    HB3  GLU  88           1HB      GLU  88 -14.766  -1.436  -2.455
  673    HG2  GLU  88           2HG      GLU  88 -15.289   0.790  -2.796
  674    HG3  GLU  88           1HG      GLU  88 -15.479   0.584  -4.537
  675    H    ILE  89           H        ILE  89 -11.849   0.455  -5.184
  676    HA   ILE  89           HA       ILE  89 -11.138   1.583  -2.577
  677    HB   ILE  89           HB       ILE  89  -8.813   1.481  -2.960
  678   HG12  ILE  89          2HG1      ILE  89  -9.106   2.010  -5.513
  679   HG13  ILE  89          1HG1      ILE  89  -7.702   1.115  -4.962
  680   HG21  ILE  89          1HG2      ILE  89 -10.193  -1.054  -3.728
  681   HG22  ILE  89          2HG2      ILE  89  -9.472  -0.602  -2.183
  682   HG23  ILE  89          3HG2      ILE  89  -8.441  -0.967  -3.564
  683   HD11  ILE  89          3HD1      ILE  89  -8.791  -0.978  -5.608
  684   HD12  ILE  89          1HD1      ILE  89  -8.607   0.130  -6.969
  685   HD13  ILE  89          2HD1      ILE  89 -10.181  -0.061  -6.195
  686    H    ALA  90           H        ALA  90 -11.158   3.807  -2.532
  687    HA   ALA  90           HA       ALA  90 -11.406   5.139  -5.133
  688    HB1  ALA  90           3HB      ALA  90 -13.091   5.560  -3.265
  689    HB2  ALA  90           1HB      ALA  90 -12.384   6.979  -4.035
  690    HB3  ALA  90           2HB      ALA  90 -11.804   6.458  -2.455
  691    H    TRP  91           H        TRP  91  -9.556   5.733  -5.975
  692    HA   TRP  91           HA       TRP  91  -7.323   6.478  -4.258
  693    HD1  TRP  91           HD       TRP  91  -8.563   4.139  -7.874
  694    HE1  TRP  91           1HE      TRP  91  -9.271   5.052 -10.175
  695    HE3  TRP  91           3HE      TRP  91  -6.354   8.744  -7.635
  696    HZ2  TRP  91           2HZ      TRP  91  -8.936   7.413 -11.686
  697    HZ3  TRP  91           3HZ      TRP  91  -6.596  10.269  -9.550
  698    HH2  TRP  91           HH       TRP  91  -7.861   9.616 -11.534
  699    HB2  TRP  91           2HB      TRP  91  -5.998   6.438  -6.346
  700    HB3  TRP  91           1HB      TRP  91  -6.846   4.921  -6.065
  701    H    GLN  92           H        GLN  92  -6.584   8.487  -4.002
  702    HA   GLN  92           HA       GLN  92  -8.102  10.656  -5.209
  703    HB2  GLN  92           2HB      GLN  92  -5.970  10.625  -3.066
  704    HB3  GLN  92           1HB      GLN  92  -6.759  12.086  -3.645
  705    HG2  GLN  92           2HG      GLN  92  -8.922  11.195  -2.910
  706    HG3  GLN  92           1HG      GLN  92  -8.106   9.758  -2.295
  707   HE21  GLN  92          1HE2      GLN  92  -8.308   9.905  -0.161
  708   HE22  GLN  92          2HE2      GLN  92  -7.832  11.261   0.799
  709    HA   PRO  93           HA       PRO  93  -5.411  11.917  -8.445
  710    HB2  PRO  93           2HB      PRO  93  -5.251  14.526  -7.019
  711    HB3  PRO  93           1HB      PRO  93  -5.601  14.199  -8.719
  712    HG2  PRO  93           2HG      PRO  93  -7.558  14.833  -7.024
  713    HG3  PRO  93           1HG      PRO  93  -7.804  13.621  -8.295
  714    HD2  PRO  93           2HD      PRO  93  -7.467  13.253  -5.368
  715    HD3  PRO  93           1HD      PRO  93  -8.365  12.265  -6.537
  716    H    ALA  94           H        ALA  94  -4.473  12.952  -5.184
  717    HA   ALA  94           HA       ALA  94  -2.462  12.397  -4.118
  718    HB1  ALA  94           3HB      ALA  94  -0.626  11.497  -5.168
  719    HB2  ALA  94           1HB      ALA  94  -0.907  12.405  -6.653
  720    HB3  ALA  94           2HB      ALA  94  -1.904  11.002  -6.281
  721    H    GLU  95           H        GLU  95  -3.660  14.911  -4.814
  722    HA   GLU  95           HA       GLU  95  -1.277  16.591  -4.565
  723    HB2  GLU  95           2HB      GLU  95  -2.460  16.452  -6.973
  724    HB3  GLU  95           1HB      GLU  95  -3.464  17.696  -6.239
  725    HG2  GLU  95           2HG      GLU  95  -1.779  18.865  -7.343
  726    HG3  GLU  95           1HG      GLU  95  -1.291  18.876  -5.650
  727    H    SER  96           H        SER  96  -1.477  18.137  -3.055
  728    HA   SER  96           HA       SER  96  -4.103  19.092  -2.258
  729    HG   SER  96           HG       SER  96  -4.154  16.319  -0.301
  730    HB2  SER  96           2HB      SER  96  -2.348  17.388  -0.533
  731    HB3  SER  96           1HB      SER  96  -3.295  18.671   0.219
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1   6.860  13.294  -5.033
    2    HB2  MET   1           2HB      MET   1   7.491  13.538  -2.713
    3    HB3  MET   1           1HB      MET   1   8.800  14.088  -3.752
    4    HG2  MET   1           2HG      MET   1   6.999  16.238  -2.996
    5    HG3  MET   1           1HG      MET   1   7.727  15.439  -1.606
    6    HE1  MET   1           3HE      MET   1   9.181  18.104  -1.139
    7    HE2  MET   1           1HE      MET   1   7.887  18.321  -2.318
    8    HE3  MET   1           2HE      MET   1   9.510  18.914  -2.670
    9    H    PHE   2           H        PHE   2   4.769  13.368  -5.597
   10    HA   PHE   2           HA       PHE   2   2.940  15.131  -4.136
   11    HD1  PHE   2           2HD      PHE   2   3.474  16.527  -6.533
   12    HD2  PHE   2           1HD      PHE   2   2.860  12.602  -8.058
   13    HE1  PHE   2           2HE      PHE   2   4.792  17.100  -8.530
   14    HE2  PHE   2           1HE      PHE   2   4.166  13.171 -10.058
   15    HZ   PHE   2           HZ       PHE   2   5.139  15.421 -10.298
   16    HB2  PHE   2           2HB      PHE   2   1.840  13.202  -6.097
   17    HB3  PHE   2           1HB      PHE   2   1.466  14.905  -5.870
   18    H    ARG   3           H        ARG   3   0.781  13.937  -3.418
   19    HA   ARG   3           HA       ARG   3   1.347  11.209  -2.606
   20    HE   ARG   3           HE       ARG   3   4.522  10.688   1.498
   21    HB2  ARG   3           2HB      ARG   3   1.891  13.296  -0.809
   22    HB3  ARG   3           1HB      ARG   3   0.393  12.561  -0.248
   23    HG2  ARG   3           2HG      ARG   3   1.696  11.072   0.757
   24    HG3  ARG   3           1HG      ARG   3   1.939  10.387  -0.837
   25    HD2  ARG   3           2HD      ARG   3   4.097  10.882  -0.747
   26    HD3  ARG   3           1HD      ARG   3   3.721  12.586  -0.508
   27   HH11  ARG   3          1HH1      ARG   3   2.878  13.709   0.901
   28   HH12  ARG   3          2HH1      ARG   3   3.124  14.304   2.509
   29   HH21  ARG   3          1HH2      ARG   3   4.847  11.470   3.613
   30   HH22  ARG   3          2HH2      ARG   3   4.242  13.034   4.047
   31    H    SER   4           H        SER   4  -0.363   9.992  -2.776
   32    HA   SER   4           HA       SER   4  -3.058  11.164  -2.624
   33    HG   SER   4           HG       SER   4  -3.221   7.776  -3.739
   34    HB2  SER   4           2HB      SER   4  -3.131  10.379  -4.784
   35    HB3  SER   4           1HB      SER   4  -1.810   9.235  -4.517
   36    H    THR   5           H        THR   5  -4.732   9.564  -1.819
   37    HA   THR   5           HA       THR   5  -3.596   7.419  -0.221
   38    HB   THR   5           HB       THR   5  -4.562   8.125   1.864
   39    HG1  THR   5           1HG      THR   5  -5.689  10.198   0.320
   40   HG21  THR   5          3HG2      THR   5  -3.386  10.710   0.963
   41   HG22  THR   5          1HG2      THR   5  -2.365   9.274   1.053
   42   HG23  THR   5          2HG2      THR   5  -3.200   9.854   2.490
   43    H    SER   6           H        SER   6  -4.766   5.646  -0.352
   44    HA   SER   6           HA       SER   6  -7.602   5.905  -1.124
   45    HG   SER   6           HG       SER   6  -7.746   3.389  -3.121
   46    HB2  SER   6           2HB      SER   6  -6.124   4.658  -2.703
   47    HB3  SER   6           1HB      SER   6  -5.806   3.486  -1.424
   48    H    HIS   7           H        HIS   7  -9.185   5.069   0.145
   49    HA   HIS   7           HA       HIS   7  -8.345   3.660   2.606
   50    HD1  HIS   7           1HD      HIS   7 -11.409   2.903   3.708
   51    HD2  HIS   7           2HD      HIS   7  -9.643   6.147   5.606
   52    HE1  HIS   7           1HE      HIS   7 -11.897   2.599   6.153
   53    HE2  HIS   7           2HE      HIS   7 -10.750   4.530   7.290
   54    HB2  HIS   7           2HB      HIS   7  -9.255   5.966   2.951
   55    HB3  HIS   7           1HB      HIS   7 -10.778   5.426   2.266
   56    H    VAL   8           H        VAL   8  -9.268   1.729   3.084
   57    HA   VAL   8           HA       VAL   8 -11.700   0.910   1.655
   58    HB   VAL   8           HB       VAL   8  -9.382  -0.993   1.908
   59   HG11  VAL   8          1HG1      VAL   8 -11.651  -1.896   1.537
   60   HG12  VAL   8          2HG1      VAL   8 -10.543  -2.253   0.214
   61   HG13  VAL   8          3HG1      VAL   8 -11.745  -0.977   0.035
   62   HG21  VAL   8          3HG2      VAL   8  -9.999   0.615  -0.559
   63   HG22  VAL   8          1HG2      VAL   8  -8.670  -0.515  -0.315
   64   HG23  VAL   8          2HG2      VAL   8  -8.705   1.010   0.570
   65    H    ARG   9           H        ARG   9 -12.870  -0.837   2.692
   66    HA   ARG   9           HA       ARG   9 -12.166  -1.074   5.538
   67    HE   ARG   9           HE       ARG   9 -14.257   2.914   6.478
   68    HB2  ARG   9           2HB      ARG   9 -14.755  -1.120   4.079
   69    HB3  ARG   9           1HB      ARG   9 -14.613  -2.157   5.489
   70    HG2  ARG   9           2HG      ARG   9 -15.548  -0.088   6.189
   71    HG3  ARG   9           1HG      ARG   9 -13.894  -0.171   6.801
   72    HD2  ARG   9           2HD      ARG   9 -13.112   1.372   5.227
   73    HD3  ARG   9           1HD      ARG   9 -14.532   1.179   4.200
   74   HH11  ARG   9          1HH1      ARG   9 -16.513   1.195   4.443
   75   HH12  ARG   9          2HH1      ARG   9 -17.839   2.245   4.812
   76   HH21  ARG   9          1HH2      ARG   9 -16.000   4.295   6.966
   77   HH22  ARG   9          2HH2      ARG   9 -17.548   4.005   6.244
   78    H    THR  10           H        THR  10 -10.866  -2.784   5.822
   79    HA   THR  10           HA       THR  10 -11.751  -5.370   4.737
   80    HB   THR  10           HB       THR  10  -9.509  -4.003   3.872
   81    HG1  THR  10           1HG      THR  10 -10.165  -6.755   3.786
   82   HG21  THR  10          3HG2      THR  10  -8.344  -6.375   5.169
   83   HG22  THR  10          1HG2      THR  10  -8.578  -4.944   6.180
   84   HG23  THR  10          2HG2      THR  10  -7.600  -4.842   4.707
   85    H    GLU  11           H        GLU  11 -11.008  -7.268   5.933
   86    HA   GLU  11           HA       GLU  11 -10.612  -6.641   8.780
   87    HB2  GLU  11           2HB      GLU  11 -12.360  -8.427   7.427
   88    HB3  GLU  11           1HB      GLU  11 -11.251  -9.390   8.393
   89    HG2  GLU  11           2HG      GLU  11 -12.290  -8.842  10.269
   90    HG3  GLU  11           1HG      GLU  11 -12.209  -7.123   9.882
   91    H    SER  12           H        SER  12  -8.999  -7.716  10.009
   92    HA   SER  12           HA       SER  12  -6.965  -8.637  10.406
   93    HG   SER  12           HG       SER  12  -5.990 -11.498   9.691
   94    HB2  SER  12           2HB      SER  12  -7.928 -10.736   9.839
   95    HB3  SER  12           1HB      SER  12  -7.859 -10.384   8.111
   96    H    ALA  13           H        ALA  13  -7.255  -6.391   8.568
   97    HA   ALA  13           HA       ALA  13  -5.602  -6.410   6.349
   98    HB1  ALA  13           3HB      ALA  13  -5.401  -4.025   6.628
   99    HB2  ALA  13           1HB      ALA  13  -5.902  -4.169   8.308
  100    HB3  ALA  13           2HB      ALA  13  -7.041  -4.536   7.020
  101    H    ALA  14           H        ALA  14  -4.619  -5.516   9.643
  102    HA   ALA  14           HA       ALA  14  -2.053  -4.744   9.282
  103    HB1  ALA  14           3HB      ALA  14  -1.570  -5.691  11.543
  104    HB2  ALA  14           1HB      ALA  14  -3.176  -6.420  11.497
  105    HB3  ALA  14           2HB      ALA  14  -3.001  -4.665  11.420
  106    H    ARG  15           H        ARG  15  -3.098  -8.045   8.802
  107    HA   ARG  15           HA       ARG  15  -0.425  -9.110   8.958
  108    HE   ARG  15           HE       ARG  15  -1.171 -13.908   7.432
  109    HB2  ARG  15           2HB      ARG  15  -2.634 -10.316   9.476
  110    HB3  ARG  15           1HB      ARG  15  -2.793 -10.502   7.737
  111    HG2  ARG  15           2HG      ARG  15  -0.440 -11.452   9.348
  112    HG3  ARG  15           1HG      ARG  15  -1.808 -12.459   8.887
  113    HD2  ARG  15           2HD      ARG  15  -0.836 -11.184   6.549
  114    HD3  ARG  15           1HD      ARG  15   0.546 -11.854   7.403
  115   HH11  ARG  15          1HH1      ARG  15  -0.135 -11.806   4.842
  116   HH12  ARG  15          2HH1      ARG  15  -0.341 -13.012   3.617
  117   HH21  ARG  15          1HH2      ARG  15  -1.438 -15.492   5.818
  118   HH22  ARG  15          2HH2      ARG  15  -1.080 -15.103   4.170
  119    H    TYR  16           H        TYR  16  -2.648  -8.190   6.391
  120    HA   TYR  16           HA       TYR  16  -1.112  -9.258   4.258
  121    HD1  TYR  16           1HD      TYR  16  -2.747 -10.629   4.442
  122    HD2  TYR  16           2HD      TYR  16  -5.332  -7.433   3.329
  123    HE1  TYR  16           1HE      TYR  16  -4.658 -12.143   4.552
  124    HE2  TYR  16           2HE      TYR  16  -7.253  -8.953   3.449
  125    HH   TYR  16           HH       TYR  16  -7.830 -11.109   4.622
  126    HB2  TYR  16           2HB      TYR  16  -3.081  -6.964   4.181
  127    HB3  TYR  16           1HB      TYR  16  -2.444  -7.808   2.780
  128    H    VAL  17           H        VAL  17  -0.759  -6.414   6.175
  129    HA   VAL  17           HA       VAL  17   0.986  -5.116   4.249
  130    HB   VAL  17           HB       VAL  17   0.103  -4.413   7.036
  131   HG11  VAL  17          1HG1      VAL  17   1.576  -2.251   6.268
  132   HG12  VAL  17          2HG1      VAL  17   2.588  -3.585   5.717
  133   HG13  VAL  17          3HG1      VAL  17   2.115  -3.476   7.414
  134   HG21  VAL  17          3HG2      VAL  17  -0.009  -2.872   4.457
  135   HG22  VAL  17          1HG2      VAL  17  -0.721  -2.403   6.000
  136   HG23  VAL  17          2HG2      VAL  17  -1.336  -3.816   5.134
  137    H    ASN  18           H        ASN  18   1.281  -6.788   7.364
  138    HA   ASN  18           HA       ASN  18   4.086  -6.488   7.567
  139    HB2  ASN  18           2HB      ASN  18   2.343  -8.566   8.895
  140    HB3  ASN  18           1HB      ASN  18   3.941  -8.042   9.418
  141   HD21  ASN  18          1HD2      ASN  18   2.657  -7.724  11.428
  142   HD22  ASN  18          2HD2      ASN  18   1.900  -6.187  11.656
  143    H    ARG  19           H        ARG  19   2.075  -8.927   6.020
  144    HA   ARG  19           HA       ARG  19   4.193 -10.830   5.814
  145    HE   ARG  19           HE       ARG  19   2.729 -11.295   7.300
  146    HB2  ARG  19           2HB      ARG  19   1.501 -10.999   5.639
  147    HB3  ARG  19           1HB      ARG  19   1.935 -11.036   3.934
  148    HG2  ARG  19           2HG      ARG  19   2.020 -13.250   4.389
  149    HG3  ARG  19           1HG      ARG  19   3.680 -12.810   4.778
  150    HD2  ARG  19           2HD      ARG  19   1.414 -13.456   6.616
  151    HD3  ARG  19           1HD      ARG  19   3.048 -14.106   6.590
  152   HH11  ARG  19          1HH1      ARG  19   3.284 -14.578   8.362
  153   HH12  ARG  19          2HH1      ARG  19   3.936 -14.100   9.892
  154   HH21  ARG  19          1HH2      ARG  19   3.583 -10.673   9.311
  155   HH22  ARG  19          2HH2      ARG  19   4.104 -11.886  10.431
  156    H    LEU  20           H        LEU  20   3.338  -8.056   3.993
  157    HA   LEU  20           HA       LEU  20   4.340  -8.918   1.470
  158    HG   LEU  20           HG       LEU  20   1.846  -7.017   2.527
  159    HB2  LEU  20           2HB      LEU  20   4.024  -6.121   2.536
  160    HB3  LEU  20           1HB      LEU  20   4.299  -6.544   0.859
  161   HD11  LEU  20          1HD1      LEU  20   2.213  -4.831   1.377
  162   HD12  LEU  20          2HD1      LEU  20   0.757  -5.687   0.865
  163   HD13  LEU  20          3HD1      LEU  20   2.195  -5.700  -0.157
  164   HD21  LEU  20          3HD2      LEU  20   2.504  -8.227  -0.164
  165   HD22  LEU  20          1HD2      LEU  20   0.886  -8.158   0.528
  166   HD23  LEU  20          2HD2      LEU  20   2.146  -9.086   1.334
  167    H    CYS  21           H        CYS  21   5.778  -6.959   4.081
  168    HA   CYS  21           HA       CYS  21   8.171  -6.313   2.850
  169    HG   CYS  21           HG       CYS  21   7.706  -8.308   6.123
  170    HB2  CYS  21           2HB      CYS  21   9.145  -6.140   5.100
  171    HB3  CYS  21           1HB      CYS  21   7.534  -5.430   5.052
  172    H    LYS  22           H        LYS  22   7.266  -9.278   4.507
  173    HA   LYS  22           HA       LYS  22   9.851 -10.492   4.184
  174    HB2  LYS  22           2HB      LYS  22   7.193 -11.731   4.910
  175    HB3  LYS  22           1HB      LYS  22   8.760 -12.516   5.046
  176    HG2  LYS  22           2HG      LYS  22   9.195 -11.549   7.009
  177    HG3  LYS  22           1HG      LYS  22   8.645  -9.967   6.458
  178    HD2  LYS  22           2HD      LYS  22   7.202 -10.614   8.229
  179    HD3  LYS  22           1HD      LYS  22   6.288 -10.814   6.733
  180    HE2  LYS  22           2HE      LYS  22   5.834 -12.752   7.959
  181    HE3  LYS  22           1HE      LYS  22   7.061 -13.245   6.792
  182    HZ1  LYS  22           3HZ      LYS  22   7.605 -14.122   8.939
  183    HZ2  LYS  22           1HZ      LYS  22   7.502 -12.593   9.656
  184    HZ3  LYS  22           2HZ      LYS  22   8.737 -12.929   8.550
  185    H    HIS  23           H        HIS  23   7.039 -10.111   2.279
  186    HA   HIS  23           HA       HIS  23   7.509 -12.405   0.593
  187    HD1  HIS  23           1HD      HIS  23   3.476 -12.741   0.194
  188    HD2  HIS  23           2HD      HIS  23   6.703 -12.206  -2.369
  189    HE1  HIS  23           1HE      HIS  23   3.029 -14.243  -1.774
  190    HE2  HIS  23           2HE      HIS  23   5.038 -13.969  -3.268
  191    HB2  HIS  23           2HB      HIS  23   5.234 -11.299   1.192
  192    HB3  HIS  23           1HB      HIS  23   5.635 -10.168  -0.096
  193    H    TRP  24           H        TRP  24   7.309  -8.884  -0.130
  194    HA   TRP  24           HA       TRP  24   8.793  -9.331  -2.579
  195    HD1  TRP  24           HD       TRP  24   5.118  -6.842  -1.586
  196    HE1  TRP  24           1HE      TRP  24   3.426  -7.835  -3.251
  197    HE3  TRP  24           3HE      TRP  24   8.375  -9.188  -4.753
  198    HZ2  TRP  24           2HZ      TRP  24   3.466  -9.405  -5.597
  199    HZ3  TRP  24           3HZ      TRP  24   7.467 -10.414  -6.683
  200    HH2  TRP  24           HH       TRP  24   5.062 -10.520  -7.095
  201    HB2  TRP  24           2HB      TRP  24   7.653  -6.825  -1.338
  202    HB3  TRP  24           1HB      TRP  24   8.473  -6.876  -2.894
  203    H    GLY  25           H        GLY  25   9.645  -8.704   0.658
  204    HA2  GLY  25           2HA      GLY  25  11.854  -6.967   0.239
  205    HA3  GLY  25           1HA      GLY  25  11.586  -7.974   1.648
  206    H    HIS  26           H        HIS  26  12.477  -8.352  -1.779
  207    HA   HIS  26           HA       HIS  26  14.411 -10.406  -0.938
  208    HD1  HIS  26           1HD      HIS  26  11.931 -11.506  -0.674
  209    HD2  HIS  26           2HD      HIS  26  13.870 -13.454  -3.791
  210    HE1  HIS  26           1HE      HIS  26  11.480 -13.955  -0.321
  211    HE2  HIS  26           2HE      HIS  26  12.736 -15.119  -2.168
  212    HB2  HIS  26           2HB      HIS  26  12.622 -10.155  -3.284
  213    HB3  HIS  26           1HB      HIS  26  14.237 -10.777  -3.611
  214    H    LYS  27           H        LYS  27  13.945  -7.425  -2.695
  215    HA   LYS  27           HA       LYS  27  16.835  -7.022  -2.739
  216    HB2  LYS  27           2HB      LYS  27  16.530  -8.066  -4.869
  217    HB3  LYS  27           1HB      LYS  27  15.108  -7.098  -5.217
  218    HG2  LYS  27           2HG      LYS  27  17.509  -5.499  -4.765
  219    HG3  LYS  27           1HG      LYS  27  17.644  -6.614  -6.125
  220    HD2  LYS  27           2HD      LYS  27  16.213  -5.434  -7.375
  221    HD3  LYS  27           1HD      LYS  27  15.078  -5.243  -6.039
  222    HE2  LYS  27           2HE      LYS  27  15.886  -3.220  -5.470
  223    HE3  LYS  27           1HE      LYS  27  17.553  -3.666  -5.826
  224    HZ1  LYS  27           3HZ      LYS  27  16.721  -1.960  -7.335
  225    HZ2  LYS  27           1HZ      LYS  27  15.490  -2.998  -7.855
  226    HZ3  LYS  27           2HZ      LYS  27  17.108  -3.378  -8.172
  227    H    PHE  28           H        PHE  28  14.287  -5.898  -1.501
  228    HA   PHE  28           HA       PHE  28  14.927  -3.109  -2.063
  229    HD1  PHE  28           1HD      PHE  28  13.526  -1.174  -3.551
  230    HD2  PHE  28           2HD      PHE  28  12.452  -5.196  -4.430
  231    HE1  PHE  28           1HE      PHE  28  13.732  -0.698  -5.957
  232    HE2  PHE  28           2HE      PHE  28  12.654  -4.730  -6.837
  233    HZ   PHE  28           HZ       PHE  28  13.296  -2.478  -7.603
  234    HB2  PHE  28           2HB      PHE  28  12.201  -4.356  -2.243
  235    HB3  PHE  28           1HB      PHE  28  12.399  -2.642  -1.889
  236    H    GLU  29           H        GLU  29  14.323  -1.633  -0.402
  237    HA   GLU  29           HA       GLU  29  14.652  -2.775   2.214
  238    HB2  GLU  29           2HB      GLU  29  14.350  -0.337   2.933
  239    HB3  GLU  29           1HB      GLU  29  15.739  -0.711   1.921
  240    HG2  GLU  29           2HG      GLU  29  13.359   0.029   0.410
  241    HG3  GLU  29           1HG      GLU  29  13.941   1.292   1.492
  242    H    VAL  30           H        VAL  30  13.004  -3.767   3.159
  243    HA   VAL  30           HA       VAL  30  10.348  -2.512   2.993
  244    HB   VAL  30           HB       VAL  30   9.658  -5.018   3.593
  245   HG11  VAL  30          1HG1      VAL  30  10.179  -3.782   0.915
  246   HG12  VAL  30          2HG1      VAL  30   8.643  -4.046   1.744
  247   HG13  VAL  30          3HG1      VAL  30   9.515  -5.409   1.052
  248   HG21  VAL  30          3HG2      VAL  30  12.205  -5.558   3.465
  249   HG22  VAL  30          1HG2      VAL  30  11.918  -5.585   1.723
  250   HG23  VAL  30          2HG2      VAL  30  11.028  -6.679   2.786
  251    H    GLU  31           H        GLU  31   9.760  -1.635   4.873
  252    HA   GLU  31           HA       GLU  31  10.849  -2.682   7.370
  253    HB2  GLU  31           2HB      GLU  31  10.297  -0.108   6.471
  254    HB3  GLU  31           1HB      GLU  31   9.003  -0.440   7.614
  255    HG2  GLU  31           2HG      GLU  31  10.707  -1.055   9.297
  256    HG3  GLU  31           1HG      GLU  31  11.960  -0.588   8.147
  257    H    LEU  32           H        LEU  32   9.405  -3.098   9.199
  258    HA   LEU  32           HA       LEU  32   6.640  -3.710   8.448
  259    HG   LEU  32           HG       LEU  32   5.914  -6.306   8.239
  260    HB2  LEU  32           2HB      LEU  32   8.213  -5.694   8.181
  261    HB3  LEU  32           1HB      LEU  32   8.341  -5.700   9.926
  262   HD11  LEU  32          1HD1      LEU  32   7.797  -7.980   8.992
  263   HD12  LEU  32          2HD1      LEU  32   6.095  -8.441   9.019
  264   HD13  LEU  32          3HD1      LEU  32   6.899  -7.950  10.510
  265   HD21  LEU  32          3HD2      LEU  32   6.063  -5.621  11.167
  266   HD22  LEU  32          1HD2      LEU  32   4.768  -6.610  10.493
  267   HD23  LEU  32          2HD2      LEU  32   4.990  -4.952   9.938
  268    H    THR  33           H        THR  33   5.478  -2.541   9.809
  269    HA   THR  33           HA       THR  33   6.093  -2.758  12.704
  270    HB   THR  33           HB       THR  33   4.957  -0.382  12.735
  271    HG1  THR  33           1HG      THR  33   6.064  -0.457  10.127
  272   HG21  THR  33          3HG2      THR  33   7.266   0.657  12.109
  273   HG22  THR  33          1HG2      THR  33   7.789  -1.027  12.102
  274   HG23  THR  33          2HG2      THR  33   7.087  -0.328  13.561
  275    HA   PRO  34           HA       PRO  34   1.866  -4.023  12.945
  276    HB2  PRO  34           2HB      PRO  34   1.175  -3.219  15.436
  277    HB3  PRO  34           1HB      PRO  34   2.255  -4.579  15.126
  278    HG2  PRO  34           2HG      PRO  34   2.915  -1.786  15.941
  279    HG3  PRO  34           1HG      PRO  34   3.655  -3.310  16.461
  280    HD2  PRO  34           2HD      PRO  34   4.745  -1.630  14.581
  281    HD3  PRO  34           1HD      PRO  34   5.069  -3.373  14.661
  282    H    GLU  35           H        GLU  35   2.029  -1.855  11.420
  283    HA   GLU  35           HA       GLU  35  -0.447  -0.507  11.877
  284    HB2  GLU  35           2HB      GLU  35   2.145   1.047  12.027
  285    HB3  GLU  35           1HB      GLU  35   0.559   1.785  11.830
  286    HG2  GLU  35           2HG      GLU  35  -0.068   0.592  13.994
  287    HG3  GLU  35           1HG      GLU  35   1.662   0.313  14.194
  288    H    ARG  36           H        ARG  36   2.560  -0.762  10.014
  289    HA   ARG  36           HA       ARG  36   1.163  -0.849   7.560
  290    HE   ARG  36           HE       ARG  36   4.568   3.690   7.684
  291    HB2  ARG  36           2HB      ARG  36   2.292   1.236   6.618
  292    HB3  ARG  36           1HB      ARG  36   0.918   1.496   7.678
  293    HG2  ARG  36           2HG      ARG  36   2.557   1.833   9.553
  294    HG3  ARG  36           1HG      ARG  36   3.833   1.811   8.334
  295    HD2  ARG  36           2HD      ARG  36   1.891   3.599   7.387
  296    HD3  ARG  36           1HD      ARG  36   2.081   3.953   9.104
  297   HH11  ARG  36          1HH1      ARG  36   2.009   5.879   8.604
  298   HH12  ARG  36          2HH1      ARG  36   2.998   7.293   8.459
  299   HH21  ARG  36          1HH2      ARG  36   5.869   5.550   7.493
  300   HH22  ARG  36          2HH2      ARG  36   5.187   7.107   7.827
  301    H    GLY  37           H        GLY  37   2.664  -0.725   5.672
  302    HA2  GLY  37           2HA      GLY  37   5.271  -1.904   6.395
  303    HA3  GLY  37           1HA      GLY  37   4.354  -2.345   4.953
  304    H    PHE  38           H        PHE  38   7.106  -1.187   5.167
  305    HA   PHE  38           HA       PHE  38   6.613   1.210   3.513
  306    HD1  PHE  38           1HD      PHE  38   7.250   3.627   3.724
  307    HD2  PHE  38           2HD      PHE  38  10.814   1.674   5.000
  308    HE1  PHE  38           1HE      PHE  38   8.587   5.473   2.812
  309    HE2  PHE  38           2HE      PHE  38  12.156   3.509   4.069
  310    HZ   PHE  38           HZ       PHE  38  11.044   5.412   2.971
  311    HB2  PHE  38           2HB      PHE  38   7.414   1.863   5.719
  312    HB3  PHE  38           1HB      PHE  38   8.777   0.765   5.580
  313    H    ILE  39           H        ILE  39   7.260   0.876   1.519
  314    HA   ILE  39           HA       ILE  39   9.731  -0.688   1.075
  315    HB   ILE  39           HB       ILE  39   7.494  -0.874  -0.916
  316   HG12  ILE  39          2HG1      ILE  39   7.727  -2.436   1.655
  317   HG13  ILE  39          1HG1      ILE  39   6.297  -1.704   0.939
  318   HG21  ILE  39          1HG2      ILE  39   9.090  -3.239  -0.549
  319   HG22  ILE  39          2HG2      ILE  39  10.126  -1.827  -0.748
  320   HG23  ILE  39          3HG2      ILE  39   8.919  -2.212  -1.971
  321   HD11  ILE  39          3HD1      ILE  39   7.718  -4.107  -0.177
  322   HD12  ILE  39          1HD1      ILE  39   6.194  -3.417  -0.737
  323   HD13  ILE  39          2HD1      ILE  39   6.291  -4.160   0.857
  324    H    ASP  40           H        ASP  40  11.076   0.970   0.453
  325    HA   ASP  40           HA       ASP  40  10.039   2.838  -1.556
  326    HB2  ASP  40           2HB      ASP  40  12.207   4.130  -0.895
  327    HB3  ASP  40           1HB      ASP  40  10.798   4.190   0.155
  328    H    PHE  41           H        PHE  41  10.821   2.915  -3.503
  329    HA   PHE  41           HA       PHE  41  12.951   1.033  -4.237
  330    HD1  PHE  41           2HD      PHE  41  11.092  -0.136  -3.743
  331    HD2  PHE  41           1HD      PHE  41  10.645   0.481  -7.934
  332    HE1  PHE  41           2HE      PHE  41  10.103  -2.371  -3.963
  333    HE2  PHE  41           1HE      PHE  41   9.652  -1.759  -8.157
  334    HZ   PHE  41           HZ       PHE  41   9.380  -3.187  -6.170
  335    HB2  PHE  41           2HB      PHE  41  10.733   2.417  -5.708
  336    HB3  PHE  41           1HB      PHE  41  12.139   1.877  -6.609
  337    H    GLY  42           H        GLY  42  13.057   3.948  -3.064
  338    HA2  GLY  42           2HA      GLY  42  15.107   5.202  -3.181
  339    HA3  GLY  42           1HA      GLY  42  15.174   4.856  -4.904
  340    H    ASP  43           H        ASP  43  14.005   6.116  -6.336
  341    HA   ASP  43           HA       ASP  43  13.074   8.664  -5.278
  342    HB2  ASP  43           2HB      ASP  43  14.429   8.001  -7.573
  343    HB3  ASP  43           1HB      ASP  43  12.780   8.167  -8.168
  344    H    SER  44           H        SER  44  11.480   6.841  -4.313
  345    HA   SER  44           HA       SER  44   8.902   7.500  -4.893
  346    HG   SER  44           HG       SER  44  10.148   4.321  -6.826
  347    HB2  SER  44           2HB      SER  44   8.368   5.149  -6.103
  348    HB3  SER  44           1HB      SER  44   8.704   6.624  -7.010
  349    H    ASN  45           H        ASN  45   7.327   6.060  -3.721
  350    HA   ASN  45           HA       ASN  45   8.489   3.880  -2.205
  351    HB2  ASN  45           2HB      ASN  45   7.170   5.942  -0.502
  352    HB3  ASN  45           1HB      ASN  45   8.430   4.790  -0.086
  353   HD21  ASN  45          1HD2      ASN  45  10.110   5.887   0.611
  354   HD22  ASN  45          2HD2      ASN  45  10.803   7.278  -0.142
  355    H    CYS  46           H        CYS  46   6.806   2.902  -0.696
  356    HA   CYS  46           HA       CYS  46   4.054   3.498  -1.408
  357    HG   CYS  46           HG       CYS  46   2.907   0.110  -2.804
  358    HB2  CYS  46           2HB      CYS  46   4.710   1.960  -3.184
  359    HB3  CYS  46           1HB      CYS  46   5.299   0.801  -1.996
  360    H    GLU  47           H        GLU  47   3.403   3.822   0.643
  361    HA   GLU  47           HA       GLU  47   4.070   1.812   2.674
  362    HB2  GLU  47           2HB      GLU  47   4.400   4.451   2.845
  363    HB3  GLU  47           1HB      GLU  47   2.721   4.391   3.351
  364    HG2  GLU  47           2HG      GLU  47   3.209   3.307   5.316
  365    HG3  GLU  47           1HG      GLU  47   4.703   2.607   4.693
  366    H    LEU  48           H        LEU  48   2.382   0.960   4.038
  367    HA   LEU  48           HA       LEU  48  -0.341   1.484   3.112
  368    HG   LEU  48           HG       LEU  48   1.597  -1.755   3.907
  369    HB2  LEU  48           2HB      LEU  48  -0.702  -1.090   3.332
  370    HB3  LEU  48           1HB      LEU  48  -0.135  -0.390   1.830
  371   HD11  LEU  48          1HD1      LEU  48   1.395  -3.675   2.772
  372   HD12  LEU  48          2HD1      LEU  48   1.377  -2.871   1.203
  373   HD13  LEU  48          3HD1      LEU  48  -0.099  -2.966   2.162
  374   HD21  LEU  48          3HD2      LEU  48   3.190  -0.482   2.937
  375   HD22  LEU  48          1HD2      LEU  48   2.201  -0.131   1.521
  376   HD23  LEU  48          2HD2      LEU  48   3.068  -1.663   1.634
  377    H    LEU  49           H        LEU  49  -1.680   1.799   4.714
  378    HA   LEU  49           HA       LEU  49  -0.854   1.017   7.424
  379    HG   LEU  49           HG       LEU  49  -2.238   1.809   9.211
  380    HB2  LEU  49           2HB      LEU  49  -1.866   3.334   6.727
  381    HB3  LEU  49           1HB      LEU  49  -3.394   2.477   6.814
  382   HD11  LEU  49          1HD1      LEU  49  -1.771   4.414   9.858
  383   HD12  LEU  49          2HD1      LEU  49  -1.040   4.305   8.257
  384   HD13  LEU  49          3HD1      LEU  49  -0.523   3.209   9.538
  385   HD21  LEU  49          3HD2      LEU  49  -4.525   2.426   9.009
  386   HD22  LEU  49          1HD2      LEU  49  -4.106   4.054   8.476
  387   HD23  LEU  49          2HD2      LEU  49  -3.784   3.561  10.138
  388    H    ALA  50           H        ALA  50  -1.719  -0.689   8.471
  389    HA   ALA  50           HA       ALA  50  -4.176  -1.821   7.351
  390    HB1  ALA  50           3HB      ALA  50  -1.543  -3.139   7.667
  391    HB2  ALA  50           1HB      ALA  50  -2.699  -3.212   6.339
  392    HB3  ALA  50           2HB      ALA  50  -3.015  -4.085   7.825
  393    H    HIS  51           H        HIS  51  -5.621  -1.647   8.848
  394    HA   HIS  51           HA       HIS  51  -4.977  -2.490  11.575
  395    HD1  HIS  51           1HD      HIS  51  -6.385   0.601  13.689
  396    HD2  HIS  51           2HD      HIS  51  -8.435  -2.847  12.589
  397    HE1  HIS  51           1HE      HIS  51  -7.800  -0.009  15.671
  398    HE2  HIS  51           2HE      HIS  51  -9.086  -2.048  14.952
  399    HB2  HIS  51           2HB      HIS  51  -5.704  -0.156  11.457
  400    HB3  HIS  51           1HB      HIS  51  -7.161  -0.621  10.599
  401    HA   PRO  52           HA       PRO  52  -7.162  -6.288  11.310
  402    HB2  PRO  52           2HB      PRO  52  -8.701  -5.086  13.586
  403    HB3  PRO  52           1HB      PRO  52  -8.042  -6.716  13.410
  404    HG2  PRO  52           2HG      PRO  52  -6.771  -4.820  14.828
  405    HG3  PRO  52           1HG      PRO  52  -5.897  -6.056  13.911
  406    HD2  PRO  52           2HD      PRO  52  -6.138  -3.175  13.385
  407    HD3  PRO  52           1HD      PRO  52  -4.968  -4.336  12.741
  408    H    ASP  53           H        ASP  53  -8.930  -3.252  11.135
  409    HA   ASP  53           HA       ASP  53 -11.007  -4.699   9.673
  410    HB2  ASP  53           2HB      ASP  53 -11.802  -4.166  11.988
  411    HB3  ASP  53           1HB      ASP  53 -11.605  -2.456  11.612
  412    H    HIS  54           H        HIS  54  -8.745  -2.223   9.613
  413    HA   HIS  54           HA       HIS  54 -10.041  -1.249   7.195
  414    HD1  HIS  54           1HD      HIS  54  -7.367   1.841   8.751
  415    HD2  HIS  54           2HD      HIS  54 -10.047   0.216  11.480
  416    HE1  HIS  54           1HE      HIS  54  -6.449   2.416  11.021
  417    HE2  HIS  54           2HE      HIS  54  -8.159   1.541  12.649
  418    HB2  HIS  54           2HB      HIS  54  -9.626   1.128   7.729
  419    HB3  HIS  54           1HB      HIS  54 -10.802   0.375   8.787
  420    H    VAL  55           H        VAL  55  -8.589  -0.060   5.719
  421    HA   VAL  55           HA       VAL  55  -5.751  -0.392   6.306
  422    HB   VAL  55           HB       VAL  55  -6.830  -2.382   4.999
  423   HG11  VAL  55          1HG1      VAL  55  -7.927  -0.995   3.291
  424   HG12  VAL  55          2HG1      VAL  55  -6.804  -2.160   2.594
  425   HG13  VAL  55          3HG1      VAL  55  -6.342  -0.465   2.731
  426   HG21  VAL  55          3HG2      VAL  55  -4.733  -2.822   3.902
  427   HG22  VAL  55          1HG2      VAL  55  -4.434  -2.075   5.469
  428   HG23  VAL  55          2HG2      VAL  55  -4.291  -1.117   3.996
  429    H    LEU  56           H        LEU  56  -4.487   1.152   5.448
  430    HA   LEU  56           HA       LEU  56  -5.748   3.111   3.644
  431    HG   LEU  56           HG       LEU  56  -6.480   4.755   5.536
  432    HB2  LEU  56           2HB      LEU  56  -4.473   3.483   6.198
  433    HB3  LEU  56           1HB      LEU  56  -3.538   4.309   4.976
  434   HD11  LEU  56          1HD1      LEU  56  -5.877   6.740   6.649
  435   HD12  LEU  56          2HD1      LEU  56  -4.198   6.620   6.127
  436   HD13  LEU  56          3HD1      LEU  56  -4.836   5.481   7.312
  437   HD21  LEU  56          3HD2      LEU  56  -5.860   6.899   4.176
  438   HD22  LEU  56          1HD2      LEU  56  -6.265   5.408   3.327
  439   HD23  LEU  56          2HD2      LEU  56  -4.577   5.885   3.521
  440    H    MET  57           H        MET  57  -4.488   3.962   1.968
  441    HA   MET  57           HA       MET  57  -1.920   2.610   1.509
  442    HB2  MET  57           2HB      MET  57  -3.856   3.182  -0.712
  443    HB3  MET  57           1HB      MET  57  -2.466   2.103  -0.717
  444    HG2  MET  57           2HG      MET  57  -3.608   0.631   0.883
  445    HG3  MET  57           1HG      MET  57  -5.010   1.702   0.837
  446    HE1  MET  57           3HE      MET  57  -6.852   0.430   0.063
  447    HE2  MET  57           1HE      MET  57  -7.116   0.038  -1.636
  448    HE3  MET  57           2HE      MET  57  -6.825   1.708  -1.152
  449    H    ILE  58           H        ILE  58  -0.345   4.114   1.495
  450    HA   ILE  58           HA       ILE  58  -0.908   6.662   0.138
  451    HB   ILE  58           HB       ILE  58   0.935   6.291   2.504
  452   HG12  ILE  58          2HG1      ILE  58  -1.925   6.608   2.435
  453   HG13  ILE  58          1HG1      ILE  58  -0.873   6.415   3.823
  454   HG21  ILE  58          1HG2      ILE  58  -0.023   8.793   1.129
  455   HG22  ILE  58          2HG2      ILE  58   1.575   8.065   0.948
  456   HG23  ILE  58          3HG2      ILE  58   1.073   8.712   2.509
  457   HD11  ILE  58          3HD1      ILE  58  -0.703   8.691   4.178
  458   HD12  ILE  58          1HD1      ILE  58  -2.377   8.498   3.662
  459   HD13  ILE  58          2HD1      ILE  58  -1.166   9.092   2.524
  460    H    LEU  59           H        LEU  59   0.592   7.347  -1.316
  461    HA   LEU  59           HA       LEU  59   3.033   5.717  -1.572
  462    HG   LEU  59           HG       LEU  59   1.248   6.947  -5.252
  463    HB2  LEU  59           2HB      LEU  59   2.892   5.734  -3.891
  464    HB3  LEU  59           1HB      LEU  59   1.244   5.449  -3.380
  465   HD11  LEU  59          1HD1      LEU  59  -0.014   8.779  -4.343
  466   HD12  LEU  59          2HD1      LEU  59   0.657   8.481  -2.742
  467   HD13  LEU  59          3HD1      LEU  59  -0.412   7.291  -3.484
  468   HD21  LEU  59          3HD2      LEU  59   2.531   9.212  -3.916
  469   HD22  LEU  59          1HD2      LEU  59   2.626   8.675  -5.587
  470   HD23  LEU  59          2HD2      LEU  59   3.622   7.903  -4.358
  471    H    ASN  60           H        ASN  60   4.942   6.749  -2.065
  472    HA   ASN  60           HA       ASN  60   4.851   9.696  -2.067
  473    HB2  ASN  60           2HB      ASN  60   7.157   8.094  -0.959
  474    HB3  ASN  60           1HB      ASN  60   6.818   9.808  -0.739
  475   HD21  ASN  60          1HD2      ASN  60   5.366   6.629  -0.112
  476   HD22  ASN  60          2HD2      ASN  60   4.723   7.041   1.437
  477    H    SER  61           H        SER  61   5.129  10.126  -4.196
  478    HA   SER  61           HA       SER  61   7.634   9.152  -5.394
  479    HG   SER  61           HG       SER  61   5.653   7.114  -5.143
  480    HB2  SER  61           2HB      SER  61   5.376   8.975  -7.265
  481    HB3  SER  61           1HB      SER  61   6.735   7.883  -7.028
  482    HA   PRO  62           HA       PRO  62   7.880  13.328  -6.878
  483    HB2  PRO  62           2HB      PRO  62   9.841  12.934  -8.698
  484    HB3  PRO  62           1HB      PRO  62  10.109  12.995  -6.955
  485    HG2  PRO  62           2HG      PRO  62   9.793  10.587  -8.715
  486    HG3  PRO  62           1HG      PRO  62  11.023  10.907  -7.474
  487    HD2  PRO  62           2HD      PRO  62   8.909   9.374  -6.953
  488    HD3  PRO  62           1HD      PRO  62   9.544  10.493  -5.734
  489    H    ASP  63           H        ASP  63   6.805  10.701  -8.824
  490    HA   ASP  63           HA       ASP  63   5.780  12.659 -10.737
  491    HB2  ASP  63           2HB      ASP  63   7.694  11.932 -11.913
  492    HB3  ASP  63           1HB      ASP  63   7.453  10.255 -11.447
  493    H    GLU  64           H        GLU  64   3.815  12.019 -11.786
  494    HA   GLU  64           HA       GLU  64   2.138  10.389 -10.178
  495    HB2  GLU  64           2HB      GLU  64   1.765  11.662 -12.861
  496    HB3  GLU  64           1HB      GLU  64   0.678  10.363 -12.400
  497    HG2  GLU  64           2HG      GLU  64  -0.485  12.101 -11.554
  498    HG3  GLU  64           1HG      GLU  64   0.530  11.739 -10.154
  499    H    ASP  65           H        ASP  65   3.890   9.546 -13.192
  500    HA   ASP  65           HA       ASP  65   2.786   7.061 -13.691
  501    HB2  ASP  65           2HB      ASP  65   4.662   8.241 -14.960
  502    HB3  ASP  65           1HB      ASP  65   5.757   7.585 -13.746
  503    H    SER  66           H        SER  66   5.534   7.832 -11.605
  504    HA   SER  66           HA       SER  66   5.808   5.302 -10.395
  505    HG   SER  66           HG       SER  66   8.365   6.041 -10.099
  506    HB2  SER  66           2HB      SER  66   6.552   8.081  -9.475
  507    HB3  SER  66           1HB      SER  66   6.969   6.629  -8.564
  508    H    LEU  67           H        LEU  67   4.385   8.284  -9.229
  509    HA   LEU  67           HA       LEU  67   3.241   7.669  -6.877
  510    HG   LEU  67           HG       LEU  67   1.006   9.380  -6.460
  511    HB2  LEU  67           2HB      LEU  67   3.091   9.864  -7.715
  512    HB3  LEU  67           1HB      LEU  67   2.292   9.346  -9.170
  513   HD11  LEU  67          1HD1      LEU  67   1.450  11.459  -8.426
  514   HD12  LEU  67          2HD1      LEU  67   0.962  11.577  -6.736
  515   HD13  LEU  67          3HD1      LEU  67  -0.243  11.259  -7.983
  516   HD21  LEU  67          3HD2      LEU  67  -1.063   9.403  -8.053
  517   HD22  LEU  67          1HD2      LEU  67  -0.290   7.880  -7.620
  518   HD23  LEU  67          2HD2      LEU  67   0.058   8.635  -9.177
  519    H    ALA  68           H        ALA  68   1.446   7.289  -9.953
  520    HA   ALA  68           HA       ALA  68  -0.680   5.867  -8.732
  521    HB1  ALA  68           3HB      ALA  68   0.193   6.278 -11.577
  522    HB2  ALA  68           1HB      ALA  68  -1.247   6.880 -10.754
  523    HB3  ALA  68           2HB      ALA  68  -1.128   5.174 -11.189
  524    H    HIS  69           H        HIS  69   2.301   4.874 -10.342
  525    HA   HIS  69           HA       HIS  69   1.831   2.150 -10.619
  526    HD1  HIS  69           1HD      HIS  69   6.411   2.081 -11.347
  527    HD2  HIS  69           2HD      HIS  69   2.977   0.020 -10.240
  528    HE1  HIS  69           1HE      HIS  69   7.000  -0.357 -11.537
  529    HE2  HIS  69           2HE      HIS  69   4.881  -1.584 -10.941
  530    HB2  HIS  69           2HB      HIS  69   3.839   3.374 -11.470
  531    HB3  HIS  69           1HB      HIS  69   4.458   3.417  -9.823
  532    H    MET  70           H        MET  70   2.789   4.033  -7.833
  533    HA   MET  70           HA       MET  70   3.180   1.737  -6.122
  534    HB2  MET  70           2HB      MET  70   2.817   4.546  -5.128
  535    HB3  MET  70           1HB      MET  70   3.830   3.279  -4.459
  536    HG2  MET  70           2HG      MET  70   4.594   4.091  -7.159
  537    HG3  MET  70           1HG      MET  70   4.693   5.380  -5.964
  538    HE1  MET  70           3HE      MET  70   5.994   2.010  -7.234
  539    HE2  MET  70           1HE      MET  70   7.668   2.140  -6.698
  540    HE3  MET  70           2HE      MET  70   6.985   3.372  -7.759
  541    H    GLN  71           H        GLN  71   0.773   4.436  -6.068
  542    HA   GLN  71           HA       GLN  71  -0.831   3.347  -4.095
  543    HB2  GLN  71           2HB      GLN  71  -2.740   4.637  -5.331
  544    HB3  GLN  71           1HB      GLN  71  -1.465   5.509  -4.506
  545    HG2  GLN  71           2HG      GLN  71  -0.889   6.522  -6.384
  546    HG3  GLN  71           1HG      GLN  71  -0.767   4.995  -7.249
  547   HE21  GLN  71          1HE2      GLN  71  -2.683   7.764  -6.607
  548   HE22  GLN  71          2HE2      GLN  71  -3.970   7.402  -7.701
  549    H    ASN  72           H        ASN  72  -0.625   2.456  -7.454
  550    HA   ASN  72           HA       ASN  72  -3.100   0.966  -7.403
  551    HB2  ASN  72           2HB      ASN  72  -1.789   2.084  -9.442
  552    HB3  ASN  72           1HB      ASN  72  -1.084   0.472  -9.532
  553   HD21  ASN  72          1HD2      ASN  72  -2.117  -0.924 -10.748
  554   HD22  ASN  72          2HD2      ASN  72  -3.791  -0.866 -11.171
  555    H    VAL  73           H        VAL  73   0.373   0.199  -7.384
  556    HA   VAL  73           HA       VAL  73   0.385  -2.516  -7.557
  557    HB   VAL  73           HB       VAL  73   2.046  -0.624  -5.929
  558   HG11  VAL  73          1HG1      VAL  73   3.535  -2.817  -5.672
  559   HG12  VAL  73          2HG1      VAL  73   1.941  -3.568  -5.603
  560   HG13  VAL  73          3HG1      VAL  73   2.373  -2.310  -4.444
  561   HG21  VAL  73          3HG2      VAL  73   3.172  -2.535  -7.888
  562   HG22  VAL  73          1HG2      VAL  73   3.575  -0.845  -7.588
  563   HG23  VAL  73          2HG2      VAL  73   2.134  -1.255  -8.517
  564    H    VAL  74           H        VAL  74  -0.415  -0.589  -4.709
  565    HA   VAL  74           HA       VAL  74  -0.787  -2.807  -2.958
  566    HB   VAL  74           HB       VAL  74  -1.870   0.002  -2.778
  567   HG11  VAL  74          1HG1      VAL  74  -1.688  -2.030  -0.562
  568   HG12  VAL  74          2HG1      VAL  74  -3.167  -1.657  -1.444
  569   HG13  VAL  74          3HG1      VAL  74  -2.380  -0.412  -0.476
  570   HG21  VAL  74          3HG2      VAL  74   0.237   0.551  -2.283
  571   HG22  VAL  74          1HG2      VAL  74   0.735  -1.142  -2.257
  572   HG23  VAL  74          2HG2      VAL  74   0.060  -0.398  -0.809
  573    H    ALA  75           H        ALA  75  -3.046  -0.809  -4.881
  574    HA   ALA  75           HA       ALA  75  -5.475  -1.791  -4.125
  575    HB1  ALA  75           3HB      ALA  75  -6.258  -1.339  -6.394
  576    HB2  ALA  75           1HB      ALA  75  -4.595  -1.284  -6.971
  577    HB3  ALA  75           2HB      ALA  75  -5.176  -0.057  -5.846
  578    H    ASP  76           H        ASP  76  -2.981  -3.338  -5.974
  579    HA   ASP  76           HA       ASP  76  -4.560  -5.549  -6.879
  580    HB2  ASP  76           2HB      ASP  76  -2.192  -4.591  -7.670
  581    HB3  ASP  76           1HB      ASP  76  -1.612  -5.839  -6.569
  582    H    HIS  77           H        HIS  77  -2.343  -5.010  -4.177
  583    HA   HIS  77           HA       HIS  77  -2.327  -7.629  -3.184
  584    HD1  HIS  77           1HD      HIS  77  -0.686  -6.547  -4.545
  585    HD2  HIS  77           2HD      HIS  77   0.919  -4.674  -1.201
  586    HE1  HIS  77           1HE      HIS  77   1.620  -5.817  -5.226
  587    HE2  HIS  77           2HE      HIS  77   2.603  -4.764  -3.159
  588    HB2  HIS  77           2HB      HIS  77  -2.037  -5.098  -1.559
  589    HB3  HIS  77           1HB      HIS  77  -1.439  -6.694  -1.143
  590    H    LEU  78           H        LEU  78  -4.535  -4.911  -2.483
  591    HA   LEU  78           HA       LEU  78  -5.964  -6.294  -0.461
  592    HG   LEU  78           HG       LEU  78  -5.026  -3.195  -0.639
  593    HB2  LEU  78           2HB      LEU  78  -6.685  -3.922  -2.182
  594    HB3  LEU  78           1HB      LEU  78  -7.715  -4.534  -0.905
  595   HD11  LEU  78          1HD1      LEU  78  -7.721  -2.608   0.579
  596   HD12  LEU  78          2HD1      LEU  78  -7.023  -1.775  -0.811
  597   HD13  LEU  78          3HD1      LEU  78  -6.249  -1.655   0.769
  598   HD21  LEU  78          3HD2      LEU  78  -6.547  -4.793   1.414
  599   HD22  LEU  78          1HD2      LEU  78  -5.296  -3.620   1.818
  600   HD23  LEU  78          2HD2      LEU  78  -4.892  -5.046   0.861
  601    H    GLN  79           H        GLN  79  -6.157  -6.153  -3.944
  602    HA   GLN  79           HA       GLN  79  -8.756  -7.275  -4.202
  603    HB2  GLN  79           2HB      GLN  79  -6.442  -7.262  -6.149
  604    HB3  GLN  79           1HB      GLN  79  -8.085  -7.736  -6.546
  605    HG2  GLN  79           2HG      GLN  79  -7.961  -5.118  -5.311
  606    HG3  GLN  79           1HG      GLN  79  -7.000  -5.219  -6.784
  607   HE21  GLN  79          1HE2      GLN  79  -8.856  -3.548  -7.144
  608   HE22  GLN  79          2HE2      GLN  79 -10.237  -4.176  -7.971
  609    H    ARG  80           H        ARG  80  -5.515  -8.701  -4.551
  610    HA   ARG  80           HA       ARG  80  -6.308 -11.317  -5.033
  611    HE   ARG  80           HE       ARG  80  -1.129 -13.673  -3.193
  612    HB2  ARG  80           2HB      ARG  80  -4.068 -10.877  -5.458
  613    HB3  ARG  80           1HB      ARG  80  -3.831 -10.053  -3.924
  614    HG2  ARG  80           2HG      ARG  80  -3.606 -12.031  -2.750
  615    HG3  ARG  80           1HG      ARG  80  -4.401 -12.987  -4.002
  616    HD2  ARG  80           2HD      ARG  80  -2.479 -12.594  -5.488
  617    HD3  ARG  80           1HD      ARG  80  -1.684 -11.690  -4.200
  618   HH11  ARG  80          1HH1      ARG  80  -3.546 -14.275  -5.637
  619   HH12  ARG  80          2HH1      ARG  80  -3.405 -15.997  -5.529
  620   HH21  ARG  80          1HH2      ARG  80  -0.942 -15.938  -3.050
  621   HH22  ARG  80          2HH2      ARG  80  -1.927 -16.942  -4.061
  622    H    MET  81           H        MET  81  -5.990  -9.579  -1.992
  623    HA   MET  81           HA       MET  81  -6.325 -11.978  -0.421
  624    HB2  MET  81           2HB      MET  81  -6.316 -10.473   1.518
  625    HB3  MET  81           1HB      MET  81  -4.946 -10.211   0.457
  626    HG2  MET  81           2HG      MET  81  -5.650  -8.084   1.122
  627    HG3  MET  81           1HG      MET  81  -6.222  -8.275  -0.531
  628    HE1  MET  81           3HE      MET  81  -8.263  -6.001   1.815
  629    HE2  MET  81           1HE      MET  81  -6.642  -6.626   2.118
  630    HE3  MET  81           2HE      MET  81  -7.987  -7.130   3.141
  631    H    ALA  82           H        ALA  82  -8.432  -9.860  -2.011
  632    HA   ALA  82           HA       ALA  82 -10.689 -10.902  -0.417
  633    HB1  ALA  82           3HB      ALA  82 -10.791  -8.702   0.222
  634    HB2  ALA  82           1HB      ALA  82 -11.804  -8.661  -1.221
  635    HB3  ALA  82           2HB      ALA  82 -10.130  -8.112  -1.303
  636    H    ASN  83           H        ASN  83 -11.022 -12.580  -1.898
  637    HA   ASN  83           HA       ASN  83 -11.437 -12.003  -4.694
  638    HB2  ASN  83           2HB      ASN  83 -11.197 -14.400  -3.015
  639    HB3  ASN  83           1HB      ASN  83 -12.364 -14.560  -4.323
  640   HD21  ASN  83          1HD2      ASN  83  -9.030 -14.123  -3.490
  641   HD22  ASN  83          2HD2      ASN  83  -8.384 -14.425  -5.063
  642    H    SER  84           H        SER  84 -13.210 -10.781  -5.061
  643    HA   SER  84           HA       SER  84 -15.749 -11.927  -5.083
  644    HG   SER  84           HG       SER  84 -14.238 -10.220  -2.299
  645    HB2  SER  84           2HB      SER  84 -16.864 -10.501  -3.325
  646    HB3  SER  84           1HB      SER  84 -15.812 -11.763  -2.685
  647    H    GLU  85           H        GLU  85 -14.645  -8.661  -4.178
  648    HA   GLU  85           HA       GLU  85 -15.813  -7.669  -6.697
  649    HB2  GLU  85           2HB      GLU  85 -16.377  -5.609  -5.576
  650    HB3  GLU  85           1HB      GLU  85 -17.039  -6.951  -4.651
  651    HG2  GLU  85           2HG      GLU  85 -15.101  -6.796  -3.120
  652    HG3  GLU  85           1HG      GLU  85 -14.551  -5.379  -4.013
  653    H    SER  86           H        SER  86 -14.746  -5.845  -7.688
  654    HA   SER  86           HA       SER  86 -11.905  -6.075  -7.612
  655    HG   SER  86           HG       SER  86 -12.937  -5.463 -10.810
  656    HB2  SER  86           2HB      SER  86 -13.884  -4.459  -9.146
  657    HB3  SER  86           1HB      SER  86 -12.227  -3.861  -9.080
  658    H    LEU  87           H        LEU  87 -11.839  -5.646  -5.254
  659    HA   LEU  87           HA       LEU  87 -11.817  -4.239  -3.395
  660    HG   LEU  87           HG       LEU  87  -8.264  -4.308  -3.216
  661    HB2  LEU  87           2HB      LEU  87  -9.529  -4.093  -5.101
  662    HB3  LEU  87           1HB      LEU  87  -9.777  -2.525  -4.359
  663   HD11  LEU  87          1HD1      LEU  87  -9.275  -3.387  -0.953
  664   HD12  LEU  87          2HD1      LEU  87 -10.186  -2.359  -2.058
  665   HD13  LEU  87          3HD1      LEU  87  -8.422  -2.332  -2.080
  666   HD21  LEU  87          3HD2      LEU  87 -10.949  -5.092  -2.090
  667   HD22  LEU  87          1HD2      LEU  87  -9.371  -5.672  -1.567
  668   HD23  LEU  87          2HD2      LEU  87  -9.972  -6.091  -3.169
  669    H    GLU  88           H        GLU  88 -13.381  -2.846  -2.892
  670    HA   GLU  88           HA       GLU  88 -13.960  -0.546  -4.515
  671    HB2  GLU  88           2HB      GLU  88 -15.676  -1.662  -3.086
  672    HB3  GLU  88           1HB      GLU  88 -14.780  -1.151  -1.660
  673    HG2  GLU  88           2HG      GLU  88 -15.553   0.953  -1.765
  674    HG3  GLU  88           1HG      GLU  88 -15.486   1.002  -3.527
  675    H    ILE  89           H        ILE  89 -12.175   0.764  -4.680
  676    HA   ILE  89           HA       ILE  89 -11.156   1.850  -2.150
  677    HB   ILE  89           HB       ILE  89  -8.916   1.783  -2.842
  678   HG12  ILE  89          2HG1      ILE  89  -9.865   1.118  -5.638
  679   HG13  ILE  89          1HG1      ILE  89  -9.221   2.670  -5.112
  680   HG21  ILE  89          1HG2      ILE  89  -8.523  -0.560  -3.638
  681   HG22  ILE  89          2HG2      ILE  89 -10.276  -0.723  -3.773
  682   HG23  ILE  89          3HG2      ILE  89  -9.539  -0.403  -2.205
  683   HD11  ILE  89          3HD1      ILE  89  -7.586   0.210  -4.782
  684   HD12  ILE  89          1HD1      ILE  89  -7.074   1.887  -4.982
  685   HD13  ILE  89          2HD1      ILE  89  -7.710   0.989  -6.362
  686    H    ALA  90           H        ALA  90 -11.193   4.068  -2.010
  687    HA   ALA  90           HA       ALA  90 -11.767   5.523  -4.495
  688    HB1  ALA  90           3HB      ALA  90 -13.193   5.862  -2.392
  689    HB2  ALA  90           1HB      ALA  90 -12.586   7.310  -3.195
  690    HB3  ALA  90           2HB      ALA  90 -11.801   6.724  -1.731
  691    H    TRP  91           H        TRP  91 -10.001   6.148  -5.524
  692    HA   TRP  91           HA       TRP  91  -7.588   6.745  -4.006
  693    HD1  TRP  91           HD       TRP  91 -10.019   7.208  -6.988
  694    HE1  TRP  91           1HE      TRP  91 -10.184   7.574  -9.527
  695    HE3  TRP  91           3HE      TRP  91  -5.270   5.857  -8.317
  696    HZ2  TRP  91           2HZ      TRP  91  -8.526   7.323 -11.795
  697    HZ3  TRP  91           3HZ      TRP  91  -4.641   5.948 -10.694
  698    HH2  TRP  91           HH       TRP  91  -6.237   6.665 -12.396
  699    HB2  TRP  91           2HB      TRP  91  -6.384   6.558  -6.070
  700    HB3  TRP  91           1HB      TRP  91  -7.493   5.197  -5.957
  701    H    GLN  92           H        GLN  92  -6.746   8.684  -3.740
  702    HA   GLN  92           HA       GLN  92  -8.201  10.978  -4.791
  703    HB2  GLN  92           2HB      GLN  92  -5.982  10.732  -2.754
  704    HB3  GLN  92           1HB      GLN  92  -6.643  12.273  -3.282
  705    HG2  GLN  92           2HG      GLN  92  -8.912  11.308  -2.566
  706    HG3  GLN  92           1HG      GLN  92  -7.959  10.111  -1.690
  707   HE21  GLN  92          1HE2      GLN  92  -5.825  11.752  -0.927
  708   HE22  GLN  92          2HE2      GLN  92  -6.401  12.890   0.238
  709    HA   PRO  93           HA       PRO  93  -5.616  12.076  -8.173
  710    HB2  PRO  93           2HB      PRO  93  -5.260  14.677  -6.765
  711    HB3  PRO  93           1HB      PRO  93  -5.703  14.366  -8.448
  712    HG2  PRO  93           2HG      PRO  93  -7.550  15.098  -6.670
  713    HG3  PRO  93           1HG      PRO  93  -7.911  13.892  -7.919
  714    HD2  PRO  93           2HD      PRO  93  -7.450  13.523  -5.007
  715    HD3  PRO  93           1HD      PRO  93  -8.452  12.575  -6.124
  716    H    ALA  94           H        ALA  94  -4.465  13.064  -4.966
  717    HA   ALA  94           HA       ALA  94  -2.426  12.475  -3.995
  718    HB1  ALA  94           3HB      ALA  94  -0.738  11.382  -5.085
  719    HB2  ALA  94           1HB      ALA  94  -0.970  12.298  -6.572
  720    HB3  ALA  94           2HB      ALA  94  -2.074  10.988  -6.169
  721    H    GLU  95           H        GLU  95  -2.482  14.466  -6.914
  722    HA   GLU  95           HA       GLU  95  -1.033  16.551  -5.429
  723    HB2  GLU  95           2HB      GLU  95   0.212  15.218  -7.363
  724    HB3  GLU  95           1HB      GLU  95  -0.667  16.349  -8.383
  725    HG2  GLU  95           2HG      GLU  95   0.323  18.123  -6.726
  726    HG3  GLU  95           1HG      GLU  95   1.511  16.857  -6.425
  727    H    SER  96           H        SER  96  -1.472  18.734  -6.142
  728    HA   SER  96           HA       SER  96  -4.203  18.992  -7.171
  729    HG   SER  96           HG       SER  96  -5.041  21.209  -6.753
  730    HB2  SER  96           2HB      SER  96  -3.194  20.066  -4.942
  731    HB3  SER  96           1HB      SER  96  -2.741  21.341  -6.073
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1   6.985  13.294  -5.149
    2    HB2  MET   1           2HB      MET   1   7.614  13.560  -2.828
    3    HB3  MET   1           1HB      MET   1   8.921  14.102  -3.876
    4    HG2  MET   1           2HG      MET   1   7.106  16.248  -3.127
    5    HG3  MET   1           1HG      MET   1   7.866  15.473  -1.741
    6    HE1  MET   1           3HE      MET   1  11.236  15.074  -3.563
    7    HE2  MET   1           1HE      MET   1  10.224  14.516  -2.230
    8    HE3  MET   1           2HE      MET   1  11.394  15.810  -1.968
    9    H    PHE   2           H        PHE   2   4.892  13.350  -5.708
   10    HA   PHE   2           HA       PHE   2   3.055  15.110  -4.255
   11    HD1  PHE   2           2HD      PHE   2   3.517  16.499  -6.712
   12    HD2  PHE   2           1HD      PHE   2   3.016  12.511  -8.121
   13    HE1  PHE   2           2HE      PHE   2   4.807  17.053  -8.732
   14    HE2  PHE   2           1HE      PHE   2   4.292  13.067 -10.145
   15    HZ   PHE   2           HZ       PHE   2   5.197  15.336 -10.453
   16    HB2  PHE   2           2HB      PHE   2   1.956  13.155  -6.189
   17    HB3  PHE   2           1HB      PHE   2   1.577  14.859  -5.982
   18    H    ARG   3           H        ARG   3   0.913  13.916  -3.522
   19    HA   ARG   3           HA       ARG   3   1.476  11.194  -2.696
   20    HE   ARG   3           HE       ARG   3   3.587  10.998   1.808
   21    HB2  ARG   3           2HB      ARG   3   2.008  13.296  -0.903
   22    HB3  ARG   3           1HB      ARG   3   0.513  12.550  -0.346
   23    HG2  ARG   3           2HG      ARG   3   1.816  11.068   0.666
   24    HG3  ARG   3           1HG      ARG   3   2.086  10.387  -0.923
   25    HD2  ARG   3           2HD      ARG   3   4.235  10.948  -0.855
   26    HD3  ARG   3           1HD      ARG   3   3.830  12.627  -0.511
   27   HH11  ARG   3          1HH1      ARG   3   5.920  12.611  -0.226
   28   HH12  ARG   3          2HH1      ARG   3   7.092  12.781   1.039
   29   HH21  ARG   3          1HH2      ARG   3   5.127  11.220   3.472
   30   HH22  ARG   3          2HH2      ARG   3   6.642  11.990   3.138
   31    H    SER   4           H        SER   4  -0.240   9.980  -2.861
   32    HA   SER   4           HA       SER   4  -2.931  11.165  -2.745
   33    HG   SER   4           HG       SER   4  -4.131   8.623  -4.896
   34    HB2  SER   4           2HB      SER   4  -2.951  10.378  -4.915
   35    HB3  SER   4           1HB      SER   4  -1.672   9.201  -4.604
   36    H    THR   5           H        THR   5  -4.621   9.557  -1.965
   37    HA   THR   5           HA       THR   5  -3.496   7.433  -0.332
   38    HB   THR   5           HB       THR   5  -4.505   8.139   1.731
   39    HG1  THR   5           1HG      THR   5  -6.215   9.313   1.579
   40   HG21  THR   5          3HG2      THR   5  -3.363  10.743   0.850
   41   HG22  THR   5          1HG2      THR   5  -2.314   9.327   0.935
   42   HG23  THR   5          2HG2      THR   5  -3.171   9.877   2.372
   43    H    SER   6           H        SER   6  -4.670   5.663  -0.330
   44    HA   SER   6           HA       SER   6  -7.476   5.854  -1.226
   45    HG   SER   6           HG       SER   6  -8.087   4.031  -2.747
   46    HB2  SER   6           2HB      SER   6  -5.895   4.581  -2.712
   47    HB3  SER   6           1HB      SER   6  -5.666   3.432  -1.394
   48    H    HIS   7           H        HIS   7  -9.051   5.192   0.120
   49    HA   HIS   7           HA       HIS   7  -8.249   3.755   2.574
   50    HD1  HIS   7           1HD      HIS   7  -9.767   6.878   5.070
   51    HD2  HIS   7           2HD      HIS   7 -10.164   2.792   4.429
   52    HE1  HIS   7           1HE      HIS   7 -10.055   5.864   7.353
   53    HE2  HIS   7           2HE      HIS   7 -10.384   3.401   6.931
   54    HB2  HIS   7           2HB      HIS   7  -9.195   6.173   2.695
   55    HB3  HIS   7           1HB      HIS   7 -10.746   5.412   2.373
   56    H    VAL   8           H        VAL   8  -9.167   1.821   2.999
   57    HA   VAL   8           HA       VAL   8 -11.675   1.096   1.661
   58    HB   VAL   8           HB       VAL   8  -9.458  -0.922   1.759
   59   HG11  VAL   8          1HG1      VAL   8 -10.681  -1.982  -0.011
   60   HG12  VAL   8          2HG1      VAL   8 -11.762  -0.599  -0.157
   61   HG13  VAL   8          3HG1      VAL   8 -11.802  -1.600   1.295
   62   HG21  VAL   8          3HG2      VAL   8  -8.617   1.122   0.575
   63   HG22  VAL   8          1HG2      VAL   8  -9.916   0.900  -0.597
   64   HG23  VAL   8          2HG2      VAL   8  -8.672  -0.337  -0.413
   65    H    ARG   9           H        ARG   9 -12.828  -0.661   2.694
   66    HA   ARG   9           HA       ARG   9 -12.061  -0.934   5.516
   67    HE   ARG   9           HE       ARG   9 -14.293   3.040   6.521
   68    HB2  ARG   9           2HB      ARG   9 -14.671  -0.987   4.101
   69    HB3  ARG   9           1HB      ARG   9 -14.500  -2.057   5.483
   70    HG2  ARG   9           2HG      ARG   9 -15.442  -0.012   6.247
   71    HG3  ARG   9           1HG      ARG   9 -13.780  -0.100   6.835
   72    HD2  ARG   9           2HD      ARG   9 -13.035   1.527   5.363
   73    HD3  ARG   9           1HD      ARG   9 -14.391   1.291   4.260
   74   HH11  ARG   9          1HH1      ARG   9 -16.419   1.123   4.525
   75   HH12  ARG   9          2HH1      ARG   9 -17.818   2.081   4.877
   76   HH21  ARG   9          1HH2      ARG   9 -16.132   4.301   6.985
   77   HH22  ARG   9          2HH2      ARG   9 -17.655   3.885   6.274
   78    H    THR  10           H        THR  10 -10.759  -2.633   5.818
   79    HA   THR  10           HA       THR  10 -11.591  -5.231   4.707
   80    HB   THR  10           HB       THR  10  -9.325  -3.817   3.941
   81    HG1  THR  10           1HG      THR  10  -9.925  -5.307   2.559
   82   HG21  THR  10          3HG2      THR  10  -7.436  -4.784   4.759
   83   HG22  THR  10          1HG2      THR  10  -8.283  -6.227   5.316
   84   HG23  THR  10          2HG2      THR  10  -8.430  -4.716   6.222
   85    H    GLU  11           H        GLU  11 -10.851  -7.120   5.920
   86    HA   GLU  11           HA       GLU  11 -10.564  -6.506   8.783
   87    HB2  GLU  11           2HB      GLU  11 -12.229  -8.310   7.353
   88    HB3  GLU  11           1HB      GLU  11 -11.135  -9.265   8.345
   89    HG2  GLU  11           2HG      GLU  11 -12.249  -8.764  10.188
   90    HG3  GLU  11           1HG      GLU  11 -12.177  -7.039   9.829
   91    H    SER  12           H        SER  12  -8.980  -7.512  10.060
   92    HA   SER  12           HA       SER  12  -6.938  -8.356  10.552
   93    HG   SER  12           HG       SER  12  -5.535 -10.451  10.076
   94    HB2  SER  12           2HB      SER  12  -7.839 -10.492  10.116
   95    HB3  SER  12           1HB      SER  12  -7.797 -10.248   8.370
   96    H    ALA  13           H        ALA  13  -7.201  -6.235   8.573
   97    HA   ALA  13           HA       ALA  13  -5.485  -6.344   6.407
   98    HB1  ALA  13           3HB      ALA  13  -5.639  -3.982   8.210
   99    HB2  ALA  13           1HB      ALA  13  -6.958  -4.424   7.139
  100    HB3  ALA  13           2HB      ALA  13  -5.384  -3.997   6.473
  101    H    ALA  14           H        ALA  14  -4.583  -5.264   9.660
  102    HA   ALA  14           HA       ALA  14  -1.999  -4.562   9.347
  103    HB1  ALA  14           3HB      ALA  14  -3.069  -6.180  11.644
  104    HB2  ALA  14           1HB      ALA  14  -3.180  -4.431  11.445
  105    HB3  ALA  14           2HB      ALA  14  -1.605  -5.196  11.661
  106    H    ARG  15           H        ARG  15  -3.067  -7.914   9.117
  107    HA   ARG  15           HA       ARG  15  -0.372  -8.919   9.365
  108    HE   ARG  15           HE       ARG  15  -1.676 -13.717   7.992
  109    HB2  ARG  15           2HB      ARG  15  -2.512 -10.163  10.020
  110    HB3  ARG  15           1HB      ARG  15  -2.734 -10.461   8.302
  111    HG2  ARG  15           2HG      ARG  15  -0.225 -11.204   9.766
  112    HG3  ARG  15           1HG      ARG  15  -1.612 -12.284   9.637
  113    HD2  ARG  15           2HD      ARG  15  -0.721 -11.118   7.101
  114    HD3  ARG  15           1HD      ARG  15   0.456 -12.174   7.865
  115   HH11  ARG  15          1HH1      ARG  15  -0.579 -11.731   5.334
  116   HH12  ARG  15          2HH1      ARG  15  -1.292 -12.743   4.125
  117   HH21  ARG  15          1HH2      ARG  15  -2.607 -15.045   6.398
  118   HH22  ARG  15          2HH2      ARG  15  -2.441 -14.623   4.727
  119    H    TYR  16           H        TYR  16  -2.654  -8.300   6.748
  120    HA   TYR  16           HA       TYR  16  -1.055  -9.415   4.692
  121    HD1  TYR  16           1HD      TYR  16  -2.671 -10.806   4.939
  122    HD2  TYR  16           2HD      TYR  16  -5.308  -7.714   3.647
  123    HE1  TYR  16           1HE      TYR  16  -4.561 -12.337   5.137
  124    HE2  TYR  16           2HE      TYR  16  -7.205  -9.253   3.856
  125    HH   TYR  16           HH       TYR  16  -7.660 -11.619   3.882
  126    HB2  TYR  16           2HB      TYR  16  -3.057  -7.160   4.465
  127    HB3  TYR  16           1HB      TYR  16  -2.397  -8.084   3.126
  128    H    VAL  17           H        VAL  17  -0.803  -6.503   6.519
  129    HA   VAL  17           HA       VAL  17   0.977  -5.214   4.633
  130    HB   VAL  17           HB       VAL  17  -0.081  -4.469   7.329
  131   HG11  VAL  17          1HG1      VAL  17   1.649  -2.435   6.926
  132   HG12  VAL  17          2HG1      VAL  17   2.633  -3.786   6.388
  133   HG13  VAL  17          3HG1      VAL  17   1.962  -3.776   8.020
  134   HG21  VAL  17          3HG2      VAL  17  -0.623  -2.420   6.256
  135   HG22  VAL  17          1HG2      VAL  17  -1.109  -3.739   5.188
  136   HG23  VAL  17          2HG2      VAL  17   0.368  -2.832   4.857
  137    H    ASN  18           H        ASN  18   1.201  -7.037   7.646
  138    HA   ASN  18           HA       ASN  18   4.006  -6.720   7.925
  139    HB2  ASN  18           2HB      ASN  18   2.230  -8.855   9.114
  140    HB3  ASN  18           1HB      ASN  18   3.839  -8.409   9.670
  141   HD21  ASN  18          1HD2      ASN  18   1.286  -8.391  11.082
  142   HD22  ASN  18          2HD2      ASN  18   1.065  -6.773  11.647
  143    H    ARG  19           H        ARG  19   2.001  -9.101   6.267
  144    HA   ARG  19           HA       ARG  19   4.154 -10.954   5.918
  145    HE   ARG  19           HE       ARG  19   1.012 -15.357   5.554
  146    HB2  ARG  19           2HB      ARG  19   1.452 -11.154   5.740
  147    HB3  ARG  19           1HB      ARG  19   1.893 -11.098   4.037
  148    HG2  ARG  19           2HG      ARG  19   2.397 -13.246   4.124
  149    HG3  ARG  19           1HG      ARG  19   3.684 -12.876   5.271
  150    HD2  ARG  19           2HD      ARG  19   2.351 -13.351   7.115
  151    HD3  ARG  19           1HD      ARG  19   0.857 -13.164   6.201
  152   HH11  ARG  19          1HH1      ARG  19   4.075 -14.342   6.884
  153   HH12  ARG  19          2HH1      ARG  19   4.744 -15.939   6.889
  154   HH21  ARG  19          1HH2      ARG  19   1.891 -17.458   5.560
  155   HH22  ARG  19          2HH2      ARG  19   3.505 -17.708   6.137
  156    H    LEU  20           H        LEU  20   3.207  -8.093   4.295
  157    HA   LEU  20           HA       LEU  20   4.154  -8.738   1.699
  158    HG   LEU  20           HG       LEU  20   1.679  -6.879   2.895
  159    HB2  LEU  20           2HB      LEU  20   3.861  -6.049   3.022
  160    HB3  LEU  20           1HB      LEU  20   4.162  -6.297   1.315
  161   HD11  LEU  20          1HD1      LEU  20   0.655  -5.347   1.458
  162   HD12  LEU  20          2HD1      LEU  20   1.911  -5.518   0.232
  163   HD13  LEU  20          3HD1      LEU  20   2.251  -4.645   1.724
  164   HD21  LEU  20          3HD2      LEU  20   2.452  -8.016   0.207
  165   HD22  LEU  20          1HD2      LEU  20   0.776  -7.839   0.721
  166   HD23  LEU  20          2HD2      LEU  20   1.869  -8.877   1.633
  167    H    CYS  21           H        CYS  21   5.696  -6.980   4.400
  168    HA   CYS  21           HA       CYS  21   8.063  -6.355   3.072
  169    HG   CYS  21           HG       CYS  21   6.339  -4.776   5.220
  170    HB2  CYS  21           2HB      CYS  21   7.647  -6.934   6.017
  171    HB3  CYS  21           1HB      CYS  21   9.098  -6.211   5.337
  172    H    LYS  22           H        LYS  22   7.029  -9.322   4.585
  173    HA   LYS  22           HA       LYS  22   9.622 -10.572   4.278
  174    HB2  LYS  22           2HB      LYS  22   6.961 -11.783   5.042
  175    HB3  LYS  22           1HB      LYS  22   8.532 -12.562   5.180
  176    HG2  LYS  22           2HG      LYS  22   8.975 -11.567   7.127
  177    HG3  LYS  22           1HG      LYS  22   8.419  -9.994   6.555
  178    HD2  LYS  22           2HD      LYS  22   6.995 -10.622   8.350
  179    HD3  LYS  22           1HD      LYS  22   6.067 -10.830   6.864
  180    HE2  LYS  22           2HE      LYS  22   5.611 -12.758   8.102
  181    HE3  LYS  22           1HE      LYS  22   6.838 -13.268   6.942
  182    HZ1  LYS  22           3HZ      LYS  22   7.040 -12.937   9.841
  183    HZ2  LYS  22           1HZ      LYS  22   8.414 -12.582   8.917
  184    HZ3  LYS  22           2HZ      LYS  22   7.716 -14.120   8.838
  185    H    HIS  23           H        HIS  23   6.777 -10.109   2.423
  186    HA   HIS  23           HA       HIS  23   7.162 -12.400   0.717
  187    HD1  HIS  23           1HD      HIS  23   3.145 -12.668   0.115
  188    HD2  HIS  23           2HD      HIS  23   6.393 -11.762  -2.313
  189    HE1  HIS  23           1HE      HIS  23   2.713 -13.860  -2.058
  190    HE2  HIS  23           2HE      HIS  23   4.733 -13.368  -3.480
  191    HB2  HIS  23           2HB      HIS  23   4.908 -11.409   1.335
  192    HB3  HIS  23           1HB      HIS  23   5.293 -10.087   0.238
  193    H    TRP  24           H        TRP  24   7.034  -8.861   0.057
  194    HA   TRP  24           HA       TRP  24   8.471  -9.334  -2.427
  195    HD1  TRP  24           HD       TRP  24   4.851  -7.644  -1.054
  196    HE1  TRP  24           1HE      TRP  24   3.118  -8.344  -2.823
  197    HE3  TRP  24           3HE      TRP  24   7.952  -8.102  -5.092
  198    HZ2  TRP  24           2HZ      TRP  24   3.072  -9.004  -5.568
  199    HZ3  TRP  24           3HZ      TRP  24   6.984  -8.772  -7.252
  200    HH2  TRP  24           HH       TRP  24   4.594  -9.214  -7.483
  201    HB2  TRP  24           2HB      TRP  24   7.340  -6.817  -1.198
  202    HB3  TRP  24           1HB      TRP  24   8.140  -6.885  -2.765
  203    H    GLY  25           H        GLY  25   9.327  -8.639   0.802
  204    HA2  GLY  25           2HA      GLY  25  11.553  -6.930   0.343
  205    HA3  GLY  25           1HA      GLY  25  11.274  -7.905   1.774
  206    H    HIS  26           H        HIS  26  12.158  -8.373  -1.644
  207    HA   HIS  26           HA       HIS  26  14.040 -10.450  -0.756
  208    HD1  HIS  26           1HD      HIS  26  13.573 -11.460  -5.342
  209    HD2  HIS  26           2HD      HIS  26  12.167  -7.991  -3.537
  210    HE1  HIS  26           1HE      HIS  26  13.088  -9.869  -7.228
  211    HE2  HIS  26           2HE      HIS  26  12.160  -7.808  -6.115
  212    HB2  HIS  26           2HB      HIS  26  13.798 -11.522  -2.852
  213    HB3  HIS  26           1HB      HIS  26  12.168 -11.075  -2.366
  214    H    LYS  27           H        LYS  27  13.722  -7.415  -2.417
  215    HA   LYS  27           HA       LYS  27  16.626  -7.162  -2.465
  216    HB2  LYS  27           2HB      LYS  27  16.258  -8.198  -4.611
  217    HB3  LYS  27           1HB      LYS  27  14.941  -7.099  -4.979
  218    HG2  LYS  27           2HG      LYS  27  17.491  -5.751  -4.463
  219    HG3  LYS  27           1HG      LYS  27  17.514  -6.842  -5.849
  220    HD2  LYS  27           2HD      LYS  27  15.232  -4.947  -5.539
  221    HD3  LYS  27           1HD      LYS  27  16.781  -4.331  -6.114
  222    HE2  LYS  27           2HE      LYS  27  16.220  -6.728  -7.526
  223    HE3  LYS  27           1HE      LYS  27  14.768  -5.727  -7.561
  224    HZ1  LYS  27           3HZ      LYS  27  16.767  -5.461  -9.282
  225    HZ2  LYS  27           1HZ      LYS  27  17.276  -4.361  -8.101
  226    HZ3  LYS  27           2HZ      LYS  27  15.763  -4.176  -8.832
  227    H    PHE  28           H        PHE  28  14.090  -5.887  -1.297
  228    HA   PHE  28           HA       PHE  28  14.926  -3.146  -1.861
  229    HD1  PHE  28           2HD      PHE  28  13.833  -1.311  -3.622
  230    HD2  PHE  28           1HD      PHE  28  12.281  -5.237  -4.153
  231    HE1  PHE  28           2HE      PHE  28  14.164  -1.110  -6.053
  232    HE2  PHE  28           1HE      PHE  28  12.610  -5.045  -6.582
  233    HZ   PHE  28           HZ       PHE  28  13.553  -2.979  -7.535
  234    HB2  PHE  28           2HB      PHE  28  12.100  -4.171  -2.058
  235    HB3  PHE  28           1HB      PHE  28  12.482  -2.461  -1.869
  236    H    GLU  29           H        GLU  29  14.054  -1.573  -0.275
  237    HA   GLU  29           HA       GLU  29  14.409  -2.668   2.369
  238    HB2  GLU  29           2HB      GLU  29  14.207  -0.285   3.105
  239    HB3  GLU  29           1HB      GLU  29  15.482  -0.579   1.934
  240    HG2  GLU  29           2HG      GLU  29  14.268   0.442   0.199
  241    HG3  GLU  29           1HG      GLU  29  12.774   0.428   1.132
  242    H    VAL  30           H        VAL  30  12.756  -3.708   3.252
  243    HA   VAL  30           HA       VAL  30  10.102  -2.447   3.114
  244    HB   VAL  30           HB       VAL  30   9.499  -4.978   3.857
  245   HG11  VAL  30          1HG1      VAL  30   9.066  -5.375   1.361
  246   HG12  VAL  30          2HG1      VAL  30   9.674  -3.736   1.141
  247   HG13  VAL  30          3HG1      VAL  30   8.256  -4.025   2.152
  248   HG21  VAL  30          3HG2      VAL  30  11.645  -5.401   1.804
  249   HG22  VAL  30          1HG2      VAL  30  10.757  -6.602   2.745
  250   HG23  VAL  30          2HG2      VAL  30  11.950  -5.569   3.535
  251    H    GLU  31           H        GLU  31   9.639  -1.454   4.973
  252    HA   GLU  31           HA       GLU  31  10.749  -2.469   7.472
  253    HB2  GLU  31           2HB      GLU  31  10.342   0.091   6.502
  254    HB3  GLU  31           1HB      GLU  31   9.031  -0.112   7.655
  255    HG2  GLU  31           2HG      GLU  31  10.705  -0.785   9.358
  256    HG3  GLU  31           1HG      GLU  31  11.975  -0.410   8.193
  257    H    LEU  32           H        LEU  32   9.583  -3.464   9.000
  258    HA   LEU  32           HA       LEU  32   6.668  -3.676   8.561
  259    HG   LEU  32           HG       LEU  32   5.814  -6.322   8.469
  260    HB2  LEU  32           2HB      LEU  32   8.088  -5.776   8.261
  261    HB3  LEU  32           1HB      LEU  32   8.337  -5.746   9.997
  262   HD11  LEU  32          1HD1      LEU  32   7.757  -7.865   9.760
  263   HD12  LEU  32          2HD1      LEU  32   6.194  -8.403   9.147
  264   HD13  LEU  32          3HD1      LEU  32   6.352  -7.886  10.825
  265   HD21  LEU  32          3HD2      LEU  32   4.677  -6.329  10.733
  266   HD22  LEU  32          1HD2      LEU  32   5.013  -4.741  10.047
  267   HD23  LEU  32          2HD2      LEU  32   6.042  -5.385  11.325
  268    H    THR  33           H        THR  33   5.669  -2.392   9.929
  269    HA   THR  33           HA       THR  33   6.418  -2.552  12.796
  270    HB   THR  33           HB       THR  33   5.332  -0.094  12.686
  271    HG1  THR  33           1HG      THR  33   5.591   0.875  10.820
  272   HG21  THR  33          3HG2      THR  33   8.212  -0.551  11.954
  273   HG22  THR  33          1HG2      THR  33   7.564  -0.646  13.592
  274   HG23  THR  33          2HG2      THR  33   7.515   0.882  12.711
  275    HA   PRO  34           HA       PRO  34   2.126  -3.390  13.347
  276    HB2  PRO  34           2HB      PRO  34   1.529  -2.255  15.709
  277    HB3  PRO  34           1HB      PRO  34   2.603  -3.645  15.569
  278    HG2  PRO  34           2HG      PRO  34   3.280  -0.767  15.959
  279    HG3  PRO  34           1HG      PRO  34   4.028  -2.201  16.680
  280    HD2  PRO  34           2HD      PRO  34   5.057  -0.813  14.528
  281    HD3  PRO  34           1HD      PRO  34   5.422  -2.509  14.898
  282    H    GLU  35           H        GLU  35   2.405  -1.375  11.551
  283    HA   GLU  35           HA       GLU  35  -0.040   0.078  11.909
  284    HB2  GLU  35           2HB      GLU  35   2.577   1.588  11.738
  285    HB3  GLU  35           1HB      GLU  35   0.984   2.317  11.577
  286    HG2  GLU  35           2HG      GLU  35   0.490   1.401  13.883
  287    HG3  GLU  35           1HG      GLU  35   2.213   1.048  14.000
  288    H    ARG  36           H        ARG  36   2.890  -0.388   9.905
  289    HA   ARG  36           HA       ARG  36   1.327  -0.814   7.591
  290    HE   ARG  36           HE       ARG  36   2.094   3.072  10.122
  291    HB2  ARG  36           2HB      ARG  36   2.135   1.156   6.299
  292    HB3  ARG  36           1HB      ARG  36   1.029   1.573   7.598
  293    HG2  ARG  36           2HG      ARG  36   3.378   1.803   8.890
  294    HG3  ARG  36           1HG      ARG  36   3.877   2.221   7.250
  295    HD2  ARG  36           2HD      ARG  36   3.182   4.281   7.781
  296    HD3  ARG  36           1HD      ARG  36   1.567   3.637   7.503
  297   HH11  ARG  36          1HH1      ARG  36   2.052   5.977   8.188
  298   HH12  ARG  36          2HH1      ARG  36   1.598   7.000   9.510
  299   HH21  ARG  36          1HH2      ARG  36   1.496   4.417  11.862
  300   HH22  ARG  36          2HH2      ARG  36   1.282   6.115  11.596
  301    H    GLY  37           H        GLY  37   2.653  -0.880   5.581
  302    HA2  GLY  37           2HA      GLY  37   5.307  -2.004   6.206
  303    HA3  GLY  37           1HA      GLY  37   4.314  -2.467   4.831
  304    H    PHE  38           H        PHE  38   7.021  -0.704   5.586
  305    HA   PHE  38           HA       PHE  38   6.551   1.382   3.574
  306    HD1  PHE  38           2HD      PHE  38   7.171   3.793   3.723
  307    HD2  PHE  38           1HD      PHE  38  10.786   1.930   4.999
  308    HE1  PHE  38           2HE      PHE  38   8.463   5.653   2.780
  309    HE2  PHE  38           1HE      PHE  38  12.078   3.793   4.056
  310    HZ   PHE  38           HZ       PHE  38  10.920   5.654   2.936
  311    HB2  PHE  38           2HB      PHE  38   7.423   2.046   5.774
  312    HB3  PHE  38           1HB      PHE  38   8.789   0.962   5.575
  313    H    ILE  39           H        ILE  39   7.062   0.864   1.564
  314    HA   ILE  39           HA       ILE  39   9.475  -0.796   1.113
  315    HB   ILE  39           HB       ILE  39   7.161  -0.818  -0.807
  316   HG12  ILE  39          2HG1      ILE  39   7.484  -2.448   1.708
  317   HG13  ILE  39          1HG1      ILE  39   6.033  -1.689   1.064
  318   HG21  ILE  39          1HG2      ILE  39   8.835  -3.199  -0.489
  319   HG22  ILE  39          2HG2      ILE  39   9.725  -1.760  -0.984
  320   HG23  ILE  39          3HG2      ILE  39   8.364  -2.327  -1.947
  321   HD11  ILE  39          3HD1      ILE  39   6.697  -3.556  -0.862
  322   HD12  ILE  39          1HD1      ILE  39   5.448  -3.707   0.374
  323   HD13  ILE  39          2HD1      ILE  39   7.058  -4.362   0.662
  324    H    ASP  40           H        ASP  40  10.999   0.585   0.290
  325    HA   ASP  40           HA       ASP  40  10.076   2.591  -1.651
  326    HB2  ASP  40           2HB      ASP  40  11.310   4.078  -0.536
  327    HB3  ASP  40           1HB      ASP  40  11.858   2.833   0.574
  328    H    PHE  41           H        PHE  41  10.758   2.564  -3.669
  329    HA   PHE  41           HA       PHE  41  12.555   0.386  -4.470
  330    HD1  PHE  41           2HD      PHE  41   8.854   0.286  -4.548
  331    HD2  PHE  41           1HD      PHE  41  11.910  -1.128  -7.150
  332    HE1  PHE  41           2HE      PHE  41   7.828  -1.949  -4.531
  333    HE2  PHE  41           1HE      PHE  41  10.885  -3.365  -7.143
  334    HZ   PHE  41           HZ       PHE  41   8.844  -3.778  -5.830
  335    HB2  PHE  41           2HB      PHE  41  10.285   1.822  -5.767
  336    HB3  PHE  41           1HB      PHE  41  11.567   1.232  -6.815
  337    H    GLY  42           H        GLY  42  13.106   3.296  -3.495
  338    HA2  GLY  42           2HA      GLY  42  15.309   4.232  -3.963
  339    HA3  GLY  42           1HA      GLY  42  14.991   3.960  -5.671
  340    H    ASP  43           H        ASP  43  14.030   5.546  -6.832
  341    HA   ASP  43           HA       ASP  43  13.495   8.064  -5.485
  342    HB2  ASP  43           2HB      ASP  43  13.331   7.358  -8.428
  343    HB3  ASP  43           1HB      ASP  43  13.248   8.981  -7.750
  344    H    SER  44           H        SER  44  11.754   6.414  -4.493
  345    HA   SER  44           HA       SER  44   9.247   7.437  -4.819
  346    HG   SER  44           HG       SER  44  10.284   5.740  -7.896
  347    HB2  SER  44           2HB      SER  44   8.347   5.196  -6.085
  348    HB3  SER  44           1HB      SER  44   8.708   6.710  -6.921
  349    H    ASN  45           H        ASN  45   7.578   6.113  -3.629
  350    HA   ASN  45           HA       ASN  45   8.664   3.798  -2.231
  351    HB2  ASN  45           2HB      ASN  45   7.379   5.811  -0.461
  352    HB3  ASN  45           1HB      ASN  45   8.667   4.664  -0.109
  353   HD21  ASN  45          1HD2      ASN  45  10.475   5.627   0.404
  354   HD22  ASN  45          2HD2      ASN  45  11.084   7.095  -0.274
  355    H    CYS  46           H        CYS  46   6.939   2.879  -0.689
  356    HA   CYS  46           HA       CYS  46   4.214   3.468  -1.484
  357    HG   CYS  46           HG       CYS  46   6.575   1.806  -3.570
  358    HB2  CYS  46           2HB      CYS  46   4.367   0.652  -1.707
  359    HB3  CYS  46           1HB      CYS  46   4.002   1.817  -2.974
  360    H    GLU  47           H        GLU  47   3.498   3.811   0.544
  361    HA   GLU  47           HA       GLU  47   4.159   1.882   2.645
  362    HB2  GLU  47           2HB      GLU  47   4.280   4.537   2.752
  363    HB3  GLU  47           1HB      GLU  47   2.581   4.372   3.160
  364    HG2  GLU  47           2HG      GLU  47   3.027   3.405   5.195
  365    HG3  GLU  47           1HG      GLU  47   4.595   2.778   4.682
  366    H    LEU  48           H        LEU  48   2.461   0.985   3.982
  367    HA   LEU  48           HA       LEU  48  -0.252   1.195   2.903
  368    HG   LEU  48           HG       LEU  48  -0.935  -2.097   3.760
  369    HB2  LEU  48           2HB      LEU  48   0.716  -0.686   1.695
  370    HB3  LEU  48           1HB      LEU  48   1.228  -1.430   3.195
  371   HD11  LEU  48          1HD1      LEU  48  -2.283  -0.226   3.573
  372   HD12  LEU  48          2HD1      LEU  48  -2.918  -1.290   2.319
  373   HD13  LEU  48          3HD1      LEU  48  -1.852   0.044   1.884
  374   HD21  LEU  48          3HD2      LEU  48  -1.895  -2.922   1.450
  375   HD22  LEU  48          1HD2      LEU  48  -0.425  -3.610   2.137
  376   HD23  LEU  48          2HD2      LEU  48  -0.319  -2.390   0.870
  377    H    LEU  49           H        LEU  49  -1.477   1.740   4.571
  378    HA   LEU  49           HA       LEU  49  -0.729   0.909   7.279
  379    HG   LEU  49           HG       LEU  49  -2.082   1.762   9.047
  380    HB2  LEU  49           2HB      LEU  49  -1.565   3.272   6.611
  381    HB3  LEU  49           1HB      LEU  49  -3.155   2.532   6.598
  382   HD11  LEU  49          1HD1      LEU  49  -1.687   4.289   9.829
  383   HD12  LEU  49          2HD1      LEU  49  -1.024   4.385   8.198
  384   HD13  LEU  49          3HD1      LEU  49  -0.376   3.212   9.345
  385   HD21  LEU  49          3HD2      LEU  49  -4.382   2.314   8.738
  386   HD22  LEU  49          1HD2      LEU  49  -3.984   3.971   8.287
  387   HD23  LEU  49          2HD2      LEU  49  -3.725   3.422   9.942
  388    H    ALA  50           H        ALA  50  -1.730  -0.686   8.387
  389    HA   ALA  50           HA       ALA  50  -4.292  -1.650   7.372
  390    HB1  ALA  50           3HB      ALA  50  -1.900  -3.432   7.723
  391    HB2  ALA  50           1HB      ALA  50  -2.597  -2.915   6.188
  392    HB3  ALA  50           2HB      ALA  50  -3.525  -3.938   7.273
  393    H    HIS  51           H        HIS  51  -5.617  -1.616   9.003
  394    HA   HIS  51           HA       HIS  51  -4.690  -2.522  11.613
  395    HD1  HIS  51           1HD      HIS  51  -7.590   0.086  13.771
  396    HD2  HIS  51           2HD      HIS  51  -3.716  -1.333  13.264
  397    HE1  HIS  51           1HE      HIS  51  -6.488   0.318  16.018
  398    HE2  HIS  51           2HE      HIS  51  -4.169  -0.615  15.705
  399    HB2  HIS  51           2HB      HIS  51  -5.860  -0.099  11.013
  400    HB3  HIS  51           1HB      HIS  51  -7.241  -1.050  11.538
  401    HA   PRO  52           HA       PRO  52  -7.263  -6.069  11.788
  402    HB2  PRO  52           2HB      PRO  52  -8.937  -4.658  13.827
  403    HB3  PRO  52           1HB      PRO  52  -8.259  -6.292  13.856
  404    HG2  PRO  52           2HG      PRO  52  -7.095  -4.346  15.224
  405    HG3  PRO  52           1HG      PRO  52  -6.116  -5.536  14.350
  406    HD2  PRO  52           2HD      PRO  52  -6.703  -2.697  13.663
  407    HD3  PRO  52           1HD      PRO  52  -5.242  -3.649  13.354
  408    H    ASP  53           H        ASP  53  -8.880  -2.998  11.227
  409    HA   ASP  53           HA       ASP  53 -10.892  -4.486   9.714
  410    HB2  ASP  53           2HB      ASP  53 -12.718  -3.135  10.595
  411    HB3  ASP  53           1HB      ASP  53 -11.879  -3.949  11.913
  412    H    HIS  54           H        HIS  54  -8.625  -2.048   9.590
  413    HA   HIS  54           HA       HIS  54  -9.910  -1.097   7.166
  414    HD1  HIS  54           1HD      HIS  54  -7.204   2.003   8.744
  415    HD2  HIS  54           2HD      HIS  54  -9.886   0.304  11.423
  416    HE1  HIS  54           1HE      HIS  54  -6.292   2.523  11.027
  417    HE2  HIS  54           2HE      HIS  54  -8.012   1.617  12.628
  418    HB2  HIS  54           2HB      HIS  54  -9.425   1.281   7.677
  419    HB3  HIS  54           1HB      HIS  54 -10.639   0.566   8.721
  420    H    VAL  55           H        VAL  55  -8.451   0.039   5.668
  421    HA   VAL  55           HA       VAL  55  -5.614  -0.317   6.240
  422    HB   VAL  55           HB       VAL  55  -6.760  -2.285   4.928
  423   HG11  VAL  55          1HG1      VAL  55  -7.777  -0.845   3.210
  424   HG12  VAL  55          2HG1      VAL  55  -6.698  -2.059   2.527
  425   HG13  VAL  55          3HG1      VAL  55  -6.162  -0.385   2.671
  426   HG21  VAL  55          3HG2      VAL  55  -4.368  -2.077   5.439
  427   HG22  VAL  55          1HG2      VAL  55  -4.160  -1.107   3.982
  428   HG23  VAL  55          2HG2      VAL  55  -4.662  -2.792   3.855
  429    H    LEU  56           H        LEU  56  -4.338   1.212   5.350
  430    HA   LEU  56           HA       LEU  56  -5.617   3.177   3.559
  431    HG   LEU  56           HG       LEU  56  -6.357   4.785   5.498
  432    HB2  LEU  56           2HB      LEU  56  -4.329   3.550   6.114
  433    HB3  LEU  56           1HB      LEU  56  -3.422   4.399   4.884
  434   HD11  LEU  56          1HD1      LEU  56  -4.161   6.764   5.981
  435   HD12  LEU  56          2HD1      LEU  56  -4.610   5.565   7.195
  436   HD13  LEU  56          3HD1      LEU  56  -5.799   6.739   6.632
  437   HD21  LEU  56          3HD2      LEU  56  -5.757   6.948   4.105
  438   HD22  LEU  56          1HD2      LEU  56  -6.272   5.463   3.308
  439   HD23  LEU  56          2HD2      LEU  56  -4.558   5.876   3.386
  440    H    MET  57           H        MET  57  -4.391   3.983   1.865
  441    HA   MET  57           HA       MET  57  -1.802   2.664   1.434
  442    HB2  MET  57           2HB      MET  57  -3.707   3.232  -0.812
  443    HB3  MET  57           1HB      MET  57  -2.332   2.134  -0.786
  444    HG2  MET  57           2HG      MET  57  -3.509   0.670   0.773
  445    HG3  MET  57           1HG      MET  57  -4.887   1.773   0.761
  446    HE1  MET  57           3HE      MET  57  -6.786   0.273  -0.064
  447    HE2  MET  57           1HE      MET  57  -7.054   0.308  -1.808
  448    HE3  MET  57           2HE      MET  57  -6.729   1.806  -0.934
  449    H    ILE  58           H        ILE  58  -0.236   4.170   1.431
  450    HA   ILE  58           HA       ILE  58  -0.792   6.714   0.068
  451    HB   ILE  58           HB       ILE  58   1.013   6.345   2.463
  452   HG12  ILE  58          2HG1      ILE  58  -1.841   6.672   2.344
  453   HG13  ILE  58          1HG1      ILE  58  -0.815   6.503   3.754
  454   HG21  ILE  58          1HG2      ILE  58   0.099   8.845   1.057
  455   HG22  ILE  58          2HG2      ILE  58   1.698   8.108   0.915
  456   HG23  ILE  58          3HG2      ILE  58   1.164   8.766   2.461
  457   HD11  ILE  58          3HD1      ILE  58  -0.632   8.793   4.054
  458   HD12  ILE  58          1HD1      ILE  58  -2.309   8.577   3.553
  459   HD13  ILE  58          2HD1      ILE  58  -1.108   9.152   2.394
  460    H    LEU  59           H        LEU  59   0.731   7.404  -1.364
  461    HA   LEU  59           HA       LEU  59   3.169   5.771  -1.586
  462    HG   LEU  59           HG       LEU  59   1.423   6.931  -5.306
  463    HB2  LEU  59           2HB      LEU  59   3.040   5.730  -3.904
  464    HB3  LEU  59           1HB      LEU  59   1.384   5.473  -3.402
  465   HD11  LEU  59          1HD1      LEU  59   0.830   8.512  -2.826
  466   HD12  LEU  59          2HD1      LEU  59  -0.253   7.342  -3.578
  467   HD13  LEU  59          3HD1      LEU  59   0.192   8.815  -4.440
  468   HD21  LEU  59          3HD2      LEU  59   2.827   8.637  -5.660
  469   HD22  LEU  59          1HD2      LEU  59   3.805   7.852  -4.425
  470   HD23  LEU  59          2HD2      LEU  59   2.744   9.192  -3.996
  471    H    ASN  60           H        ASN  60   5.084   6.786  -2.062
  472    HA   ASN  60           HA       ASN  60   4.994   9.733  -2.130
  473    HB2  ASN  60           2HB      ASN  60   7.209   8.088  -0.887
  474    HB3  ASN  60           1HB      ASN  60   7.017   9.838  -0.827
  475   HD21  ASN  60          1HD2      ASN  60   7.378   8.870   1.512
  476   HD22  ASN  60          2HD2      ASN  60   5.920   8.693   2.422
  477    H    SER  61           H        SER  61   5.317  10.137  -4.248
  478    HA   SER  61           HA       SER  61   7.858   9.206  -5.380
  479    HG   SER  61           HG       SER  61   5.887   7.056  -5.140
  480    HB2  SER  61           2HB      SER  61   5.694   8.859  -7.318
  481    HB3  SER  61           1HB      SER  61   7.049   7.802  -6.941
  482    HA   PRO  62           HA       PRO  62   7.998  13.332  -6.998
  483    HB2  PRO  62           2HB      PRO  62   9.957  12.916  -8.826
  484    HB3  PRO  62           1HB      PRO  62  10.235  13.062  -7.088
  485    HG2  PRO  62           2HG      PRO  62   9.965  10.571  -8.741
  486    HG3  PRO  62           1HG      PRO  62  11.198  10.975  -7.526
  487    HD2  PRO  62           2HD      PRO  62   9.141   9.413  -6.908
  488    HD3  PRO  62           1HD      PRO  62   9.735  10.621  -5.754
  489    H    ASP  63           H        ASP  63   7.046  10.613  -8.917
  490    HA   ASP  63           HA       ASP  63   6.037  12.513 -10.918
  491    HB2  ASP  63           2HB      ASP  63   6.506  10.835 -12.698
  492    HB3  ASP  63           1HB      ASP  63   7.965  11.456 -11.932
  493    H    GLU  64           H        GLU  64   4.020  11.934 -11.892
  494    HA   GLU  64           HA       GLU  64   2.300  10.463 -10.162
  495    HB2  GLU  64           2HB      GLU  64   1.704  12.283 -12.010
  496    HB3  GLU  64           1HB      GLU  64   1.482  10.852 -13.015
  497    HG2  GLU  64           2HG      GLU  64   0.171  10.135 -10.773
  498    HG3  GLU  64           1HG      GLU  64  -0.110  11.872 -10.776
  499    H    ASP  65           H        ASP  65   3.849   9.525 -13.277
  500    HA   ASP  65           HA       ASP  65   2.666   7.064 -13.665
  501    HB2  ASP  65           2HB      ASP  65   4.427   8.144 -15.120
  502    HB3  ASP  65           1HB      ASP  65   5.627   7.614 -13.941
  503    H    SER  66           H        SER  66   5.572   7.802 -11.773
  504    HA   SER  66           HA       SER  66   5.895   5.274 -10.573
  505    HG   SER  66           HG       SER  66   7.821   5.433  -9.014
  506    HB2  SER  66           2HB      SER  66   7.625   7.078 -10.547
  507    HB3  SER  66           1HB      SER  66   6.617   7.974  -9.406
  508    H    LEU  67           H        LEU  67   4.520   8.245  -9.344
  509    HA   LEU  67           HA       LEU  67   3.494   7.630  -6.936
  510    HG   LEU  67           HG       LEU  67   1.168   9.264  -6.484
  511    HB2  LEU  67           2HB      LEU  67   3.267   9.827  -7.691
  512    HB3  LEU  67           1HB      LEU  67   2.494   9.347  -9.173
  513   HD11  LEU  67          1HD1      LEU  67  -0.080  11.205  -7.901
  514   HD12  LEU  67          2HD1      LEU  67   1.600  11.426  -8.381
  515   HD13  LEU  67          3HD1      LEU  67   1.155  11.480  -6.675
  516   HD21  LEU  67          3HD2      LEU  67  -0.106   7.816  -7.742
  517   HD22  LEU  67          1HD2      LEU  67   0.273   8.645  -9.253
  518   HD23  LEU  67          2HD2      LEU  67  -0.873   9.358  -8.120
  519    H    ALA  68           H        ALA  68   1.559   7.244  -9.924
  520    HA   ALA  68           HA       ALA  68  -0.512   5.824  -8.630
  521    HB1  ALA  68           3HB      ALA  68  -0.658   6.997 -10.862
  522    HB2  ALA  68           1HB      ALA  68  -1.383   5.389 -10.804
  523    HB3  ALA  68           2HB      ALA  68   0.194   5.619 -11.559
  524    H    HIS  69           H        HIS  69   2.491   4.843 -10.168
  525    HA   HIS  69           HA       HIS  69   2.065   2.109 -10.438
  526    HD1  HIS  69           1HD      HIS  69   3.660   0.211  -9.455
  527    HD2  HIS  69           2HD      HIS  69   5.966   1.969 -12.431
  528    HE1  HIS  69           1HE      HIS  69   4.845  -1.689 -10.597
  529    HE2  HIS  69           2HE      HIS  69   6.299  -0.594 -12.338
  530    HB2  HIS  69           2HB      HIS  69   4.105   3.548 -11.130
  531    HB3  HIS  69           1HB      HIS  69   4.702   3.217  -9.507
  532    H    MET  70           H        MET  70   2.988   4.016  -7.642
  533    HA   MET  70           HA       MET  70   3.283   1.690  -5.950
  534    HB2  MET  70           2HB      MET  70   3.000   4.052  -4.359
  535    HB3  MET  70           1HB      MET  70   4.424   3.061  -4.592
  536    HG2  MET  70           2HG      MET  70   3.677   5.190  -6.563
  537    HG3  MET  70           1HG      MET  70   4.565   5.556  -5.097
  538    HE1  MET  70           3HE      MET  70   4.984   2.406  -7.726
  539    HE2  MET  70           1HE      MET  70   5.289   2.092  -6.019
  540    HE3  MET  70           2HE      MET  70   6.627   2.113  -7.165
  541    H    GLN  71           H        GLN  71   0.986   4.473  -5.892
  542    HA   GLN  71           HA       GLN  71  -0.691   3.418  -3.959
  543    HB2  GLN  71           2HB      GLN  71  -2.507   4.845  -5.094
  544    HB3  GLN  71           1HB      GLN  71  -1.119   5.653  -4.397
  545    HG2  GLN  71           2HG      GLN  71  -0.803   6.663  -6.326
  546    HG3  GLN  71           1HG      GLN  71  -0.511   5.108  -7.092
  547   HE21  GLN  71          1HE2      GLN  71  -3.068   7.341  -6.147
  548   HE22  GLN  71          2HE2      GLN  71  -4.155   6.922  -7.423
  549    H    ASN  72           H        ASN  72  -0.491   2.579  -7.340
  550    HA   ASN  72           HA       ASN  72  -3.038   1.217  -7.331
  551    HB2  ASN  72           2HB      ASN  72  -1.807   2.322  -9.354
  552    HB3  ASN  72           1HB      ASN  72  -0.953   0.784  -9.437
  553   HD21  ASN  72          1HD2      ASN  72  -4.024   2.380  -9.750
  554   HD22  ASN  72          2HD2      ASN  72  -4.836   1.093 -10.569
  555    H    VAL  73           H        VAL  73   0.388   0.268  -7.351
  556    HA   VAL  73           HA       VAL  73   0.245  -2.439  -7.560
  557    HB   VAL  73           HB       VAL  73   2.045  -0.658  -5.965
  558   HG11  VAL  73          1HG1      VAL  73   3.449  -2.640  -5.405
  559   HG12  VAL  73          2HG1      VAL  73   2.101  -3.670  -5.884
  560   HG13  VAL  73          3HG1      VAL  73   1.924  -2.565  -4.521
  561   HG21  VAL  73          3HG2      VAL  73   2.029  -1.364  -8.558
  562   HG22  VAL  73          1HG2      VAL  73   3.062  -2.633  -7.902
  563   HG23  VAL  73          2HG2      VAL  73   3.493  -0.939  -7.672
  564    H    VAL  74           H        VAL  74  -0.437  -0.517  -4.673
  565    HA   VAL  74           HA       VAL  74  -0.844  -2.758  -2.959
  566    HB   VAL  74           HB       VAL  74  -1.822   0.082  -2.674
  567   HG11  VAL  74          1HG1      VAL  74  -2.281  -0.389  -0.371
  568   HG12  VAL  74          2HG1      VAL  74  -1.645  -2.025  -0.528
  569   HG13  VAL  74          3HG1      VAL  74  -3.136  -1.576  -1.353
  570   HG21  VAL  74          3HG2      VAL  74   0.306   0.551  -2.209
  571   HG22  VAL  74          1HG2      VAL  74   0.756  -1.153  -2.281
  572   HG23  VAL  74          2HG2      VAL  74   0.151  -0.462  -0.776
  573    H    ALA  75           H        ALA  75  -3.088  -0.632  -4.766
  574    HA   ALA  75           HA       ALA  75  -5.511  -1.598  -3.924
  575    HB1  ALA  75           3HB      ALA  75  -6.377  -1.038  -6.178
  576    HB2  ALA  75           1HB      ALA  75  -4.715  -0.816  -6.729
  577    HB3  ALA  75           2HB      ALA  75  -5.381   0.240  -5.482
  578    H    ASP  76           H        ASP  76  -3.107  -3.149  -5.861
  579    HA   ASP  76           HA       ASP  76  -4.821  -5.251  -6.826
  580    HB2  ASP  76           2HB      ASP  76  -2.685  -4.398  -7.946
  581    HB3  ASP  76           1HB      ASP  76  -1.808  -5.320  -6.728
  582    H    HIS  77           H        HIS  77  -2.466  -4.860  -4.215
  583    HA   HIS  77           HA       HIS  77  -2.397  -7.540  -3.381
  584    HD1  HIS  77           1HD      HIS  77  -0.800  -6.375  -4.748
  585    HD2  HIS  77           2HD      HIS  77   0.935  -4.685  -1.372
  586    HE1  HIS  77           1HE      HIS  77   1.471  -5.586  -5.483
  587    HE2  HIS  77           2HE      HIS  77   2.535  -4.645  -3.403
  588    HB2  HIS  77           2HB      HIS  77  -2.014  -5.119  -1.610
  589    HB3  HIS  77           1HB      HIS  77  -1.398  -6.740  -1.339
  590    H    LEU  78           H        LEU  78  -4.539  -4.869  -2.375
  591    HA   LEU  78           HA       LEU  78  -5.837  -6.224  -0.303
  592    HG   LEU  78           HG       LEU  78  -5.125  -3.100  -0.701
  593    HB2  LEU  78           2HB      LEU  78  -6.773  -4.024  -2.142
  594    HB3  LEU  78           1HB      LEU  78  -7.729  -4.614  -0.797
  595   HD11  LEU  78          1HD1      LEU  78  -6.387  -1.549   0.640
  596   HD12  LEU  78          2HD1      LEU  78  -7.797  -2.610   0.601
  597   HD13  LEU  78          3HD1      LEU  78  -7.233  -1.837  -0.882
  598   HD21  LEU  78          3HD2      LEU  78  -5.338  -3.392   1.803
  599   HD22  LEU  78          1HD2      LEU  78  -4.779  -4.802   0.904
  600   HD23  LEU  78          2HD2      LEU  78  -6.450  -4.717   1.463
  601    H    GLN  79           H        GLN  79  -6.118  -6.464  -3.746
  602    HA   GLN  79           HA       GLN  79  -8.682  -7.723  -3.800
  603    HB2  GLN  79           2HB      GLN  79  -6.532  -7.954  -5.901
  604    HB3  GLN  79           1HB      GLN  79  -8.267  -8.122  -6.116
  605    HG2  GLN  79           2HG      GLN  79  -7.845  -5.563  -5.039
  606    HG3  GLN  79           1HG      GLN  79  -6.634  -5.786  -6.298
  607   HE21  GLN  79          1HE2      GLN  79  -8.048  -3.942  -7.109
  608   HE22  GLN  79          2HE2      GLN  79  -9.354  -4.386  -8.149
  609    H    ARG  80           H        ARG  80  -5.394  -8.984  -4.345
  610    HA   ARG  80           HA       ARG  80  -6.052 -11.670  -4.501
  611    HE   ARG  80           HE       ARG  80  -2.859 -13.365  -5.710
  612    HB2  ARG  80           2HB      ARG  80  -3.908 -11.172  -5.201
  613    HB3  ARG  80           1HB      ARG  80  -3.581 -10.143  -3.816
  614    HG2  ARG  80           2HG      ARG  80  -3.160 -11.984  -2.416
  615    HG3  ARG  80           1HG      ARG  80  -3.862 -13.122  -3.568
  616    HD2  ARG  80           2HD      ARG  80  -1.499 -11.460  -4.341
  617    HD3  ARG  80           1HD      ARG  80  -1.275 -12.910  -3.364
  618   HH11  ARG  80          1HH1      ARG  80   0.400 -13.145  -4.484
  619   HH12  ARG  80          2HH1      ARG  80   1.071 -14.140  -5.732
  620   HH21  ARG  80          1HH2      ARG  80  -1.980 -14.674  -7.353
  621   HH22  ARG  80          2HH2      ARG  80  -0.281 -15.008  -7.361
  622    H    MET  81           H        MET  81  -5.604  -9.639  -1.671
  623    HA   MET  81           HA       MET  81  -5.542 -11.885   0.132
  624    HB2  MET  81           2HB      MET  81  -5.502 -10.219   1.914
  625    HB3  MET  81           1HB      MET  81  -4.304  -9.881   0.683
  626    HG2  MET  81           2HG      MET  81  -5.232  -7.813   1.308
  627    HG3  MET  81           1HG      MET  81  -5.887  -8.199  -0.279
  628    HE1  MET  81           3HE      MET  81  -7.679  -7.005   3.428
  629    HE2  MET  81           1HE      MET  81  -7.933  -5.995   2.005
  630    HE3  MET  81           2HE      MET  81  -6.306  -6.521   2.432
  631    H    ALA  82           H        ALA  82  -8.012 -10.142  -1.414
  632    HA   ALA  82           HA       ALA  82  -9.975 -11.066   0.596
  633    HB1  ALA  82           3HB      ALA  82 -10.117  -8.703   0.437
  634    HB2  ALA  82           1HB      ALA  82 -11.501  -9.350  -0.444
  635    HB3  ALA  82           2HB      ALA  82 -10.099  -8.749  -1.326
  636    H    ASN  83           H        ASN  83  -9.864 -10.368  -2.909
  637    HA   ASN  83           HA       ASN  83 -10.615 -11.534  -4.713
  638    HB2  ASN  83           2HB      ASN  83  -9.513 -13.455  -3.155
  639    HB3  ASN  83           1HB      ASN  83 -11.173 -14.036  -3.236
  640   HD21  ASN  83          1HD2      ASN  83 -12.042 -14.622  -5.235
  641   HD22  ASN  83          2HD2      ASN  83 -11.036 -14.968  -6.596
  642    H    SER  84           H        SER  84 -12.521 -10.676  -5.258
  643    HA   SER  84           HA       SER  84 -14.918 -12.030  -4.954
  644    HG   SER  84           HG       SER  84 -16.969 -11.170  -3.481
  645    HB2  SER  84           2HB      SER  84 -14.323 -10.799  -2.555
  646    HB3  SER  84           1HB      SER  84 -15.384  -9.627  -3.336
  647    H    GLU  85           H        GLU  85 -13.378  -8.887  -5.246
  648    HA   GLU  85           HA       GLU  85 -14.724  -8.365  -7.729
  649    HB2  GLU  85           2HB      GLU  85 -15.832  -6.312  -7.067
  650    HB3  GLU  85           1HB      GLU  85 -16.430  -7.639  -6.081
  651    HG2  GLU  85           2HG      GLU  85 -15.227  -6.916  -4.192
  652    HG3  GLU  85           1HG      GLU  85 -14.237  -5.813  -5.148
  653    H    SER  86           H        SER  86 -14.084  -6.019  -8.477
  654    HA   SER  86           HA       SER  86 -11.233  -5.891  -8.308
  655    HG   SER  86           HG       SER  86 -13.746  -3.617 -10.538
  656    HB2  SER  86           2HB      SER  86 -11.554  -3.775  -9.682
  657    HB3  SER  86           1HB      SER  86 -12.217  -5.247 -10.391
  658    H    LEU  87           H        LEU  87 -11.345  -5.744  -5.918
  659    HA   LEU  87           HA       LEU  87 -11.760  -4.483  -3.928
  660    HG   LEU  87           HG       LEU  87  -8.277  -4.637  -3.158
  661    HB2  LEU  87           2HB      LEU  87  -9.194  -4.232  -5.203
  662    HB3  LEU  87           1HB      LEU  87  -9.578  -2.737  -4.382
  663   HD11  LEU  87          1HD1      LEU  87  -9.547  -3.881  -1.014
  664   HD12  LEU  87          2HD1      LEU  87 -10.400  -2.810  -2.127
  665   HD13  LEU  87          3HD1      LEU  87  -8.646  -2.700  -1.967
  666   HD21  LEU  87          3HD2      LEU  87 -10.029  -6.363  -3.560
  667   HD22  LEU  87          1HD2      LEU  87 -11.104  -5.447  -2.505
  668   HD23  LEU  87          2HD2      LEU  87  -9.615  -6.136  -1.864
  669    H    GLU  88           H        GLU  88 -13.360  -3.070  -3.573
  670    HA   GLU  88           HA       GLU  88 -13.688  -0.700  -5.137
  671    HB2  GLU  88           2HB      GLU  88 -15.564  -1.825  -3.928
  672    HB3  GLU  88           1HB      GLU  88 -14.830  -1.342  -2.405
  673    HG2  GLU  88           2HG      GLU  88 -15.050   1.032  -3.145
  674    HG3  GLU  88           1HG      GLU  88 -15.971   0.451  -4.531
  675    H    ILE  89           H        ILE  89 -11.890   0.580  -5.085
  676    HA   ILE  89           HA       ILE  89 -11.189   1.687  -2.464
  677    HB   ILE  89           HB       ILE  89  -8.863   1.543  -2.806
  678   HG12  ILE  89          2HG1      ILE  89  -9.077   2.150  -5.337
  679   HG13  ILE  89          1HG1      ILE  89  -7.719   1.177  -4.801
  680   HG21  ILE  89          1HG2      ILE  89 -10.199  -0.974  -3.726
  681   HG22  ILE  89          2HG2      ILE  89  -9.635  -0.558  -2.108
  682   HG23  ILE  89          3HG2      ILE  89  -8.471  -0.873  -3.395
  683   HD11  ILE  89          3HD1      ILE  89  -8.655   0.318  -6.862
  684   HD12  ILE  89          1HD1      ILE  89 -10.228   0.131  -6.088
  685   HD13  ILE  89          2HD1      ILE  89  -8.857  -0.842  -5.548
  686    H    ALA  90           H        ALA  90 -11.169   3.914  -2.425
  687    HA   ALA  90           HA       ALA  90 -11.405   5.239  -5.030
  688    HB1  ALA  90           3HB      ALA  90 -13.077   5.694  -3.160
  689    HB2  ALA  90           1HB      ALA  90 -12.347   7.101  -3.933
  690    HB3  ALA  90           2HB      ALA  90 -11.773   6.573  -2.354
  691    H    TRP  91           H        TRP  91  -9.553   5.807  -5.885
  692    HA   TRP  91           HA       TRP  91  -7.301   6.533  -4.183
  693    HD1  TRP  91           HD       TRP  91  -8.817   4.372  -7.724
  694    HE1  TRP  91           1HE      TRP  91  -9.388   5.283 -10.062
  695    HE3  TRP  91           3HE      TRP  91  -5.947   8.604  -7.672
  696    HZ2  TRP  91           2HZ      TRP  91  -8.712   7.502 -11.672
  697    HZ3  TRP  91           3HZ      TRP  91  -5.965  10.065  -9.652
  698    HH2  TRP  91           HH       TRP  91  -7.320   9.523 -11.609
  699    HB2  TRP  91           2HB      TRP  91  -5.976   6.447  -6.258
  700    HB3  TRP  91           1HB      TRP  91  -6.876   4.955  -5.999
  701    H    GLN  92           H        GLN  92  -6.537   8.537  -3.947
  702    HA   GLN  92           HA       GLN  92  -8.042  10.715  -5.153
  703    HB2  GLN  92           2HB      GLN  92  -5.891  10.677  -3.029
  704    HB3  GLN  92           1HB      GLN  92  -6.675  12.140  -3.607
  705    HG2  GLN  92           2HG      GLN  92  -8.841  11.248  -2.855
  706    HG3  GLN  92           1HG      GLN  92  -8.011   9.829  -2.219
  707   HE21  GLN  92          1HE2      GLN  92  -7.617  13.358  -2.095
  708   HE22  GLN  92          2HE2      GLN  92  -7.367  13.440  -0.388
  709    HA   PRO  93           HA       PRO  93  -5.363  11.932  -8.416
  710    HB2  PRO  93           2HB      PRO  93  -5.174  14.553  -7.013
  711    HB3  PRO  93           1HB      PRO  93  -5.541  14.213  -8.707
  712    HG2  PRO  93           2HG      PRO  93  -7.481  14.875  -7.002
  713    HG3  PRO  93           1HG      PRO  93  -7.745  13.653  -8.260
  714    HD2  PRO  93           2HD      PRO  93  -7.382  13.308  -5.332
  715    HD3  PRO  93           1HD      PRO  93  -8.302  12.319  -6.482
  716    H    ALA  94           H        ALA  94  -4.396  12.992  -5.170
  717    HA   ALA  94           HA       ALA  94  -2.381  12.437  -4.109
  718    HB1  ALA  94           3HB      ALA  94  -0.570  11.493  -5.158
  719    HB2  ALA  94           1HB      ALA  94  -0.843  12.383  -6.654
  720    HB3  ALA  94           2HB      ALA  94  -1.860  11.000  -6.256
  721    H    GLU  95           H        GLU  95  -3.561  14.961  -4.921
  722    HA   GLU  95           HA       GLU  95  -1.147  16.611  -4.713
  723    HB2  GLU  95           2HB      GLU  95  -2.452  16.441  -7.082
  724    HB3  GLU  95           1HB      GLU  95  -3.334  17.765  -6.334
  725    HG2  GLU  95           2HG      GLU  95  -0.776  18.503  -5.836
  726    HG3  GLU  95           1HG      GLU  95  -0.597  17.665  -7.377
  727    H    SER  96           H        SER  96  -4.661  17.163  -4.964
  728    HA   SER  96           HA       SER  96  -4.533  18.519  -2.350
  729    HG   SER  96           HG       SER  96  -6.092  19.840  -5.747
  730    HB2  SER  96           2HB      SER  96  -6.327  20.033  -3.175
  731    HB3  SER  96           1HB      SER  96  -4.834  20.183  -4.101
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1   6.887  13.339  -5.116
    2    HB2  MET   1           2HB      MET   1   7.616  13.505  -2.842
    3    HB3  MET   1           1HB      MET   1   8.876  14.150  -3.887
    4    HG2  MET   1           2HG      MET   1   8.790  16.158  -2.928
    5    HG3  MET   1           1HG      MET   1   7.030  16.196  -2.958
    6    HE1  MET   1           3HE      MET   1   6.424  17.197  -1.116
    7    HE2  MET   1           1HE      MET   1   7.801  17.533  -0.068
    8    HE3  MET   1           2HE      MET   1   6.449  16.572   0.532
    9    H    PHE   2           H        PHE   2   4.795  13.441  -5.639
   10    HA   PHE   2           HA       PHE   2   3.002  15.175  -4.100
   11    HD1  PHE   2           2HD      PHE   2   3.464  16.647  -6.469
   12    HD2  PHE   2           1HD      PHE   2   2.859  12.756  -8.087
   13    HE1  PHE   2           2HE      PHE   2   4.734  17.287  -8.477
   14    HE2  PHE   2           1HE      PHE   2   4.115  13.394 -10.097
   15    HZ   PHE   2           HZ       PHE   2   5.061  15.659 -10.296
   16    HB2  PHE   2           2HB      PHE   2   1.864  13.299  -6.095
   17    HB3  PHE   2           1HB      PHE   2   1.488  14.992  -5.810
   18    H    ARG   3           H        ARG   3   0.854  13.975  -3.373
   19    HA   ARG   3           HA       ARG   3   1.419  11.224  -2.633
   20    HE   ARG   3           HE       ARG   3   4.601  10.622   1.475
   21    HB2  ARG   3           2HB      ARG   3   1.984  13.271  -0.794
   22    HB3  ARG   3           1HB      ARG   3   0.486  12.531  -0.239
   23    HG2  ARG   3           2HG      ARG   3   1.783  11.014   0.727
   24    HG3  ARG   3           1HG      ARG   3   2.027  10.365  -0.881
   25    HD2  ARG   3           2HD      ARG   3   4.188  10.851  -0.769
   26    HD3  ARG   3           1HD      ARG   3   3.813  12.551  -0.507
   27   HH11  ARG   3          1HH1      ARG   3   2.968  13.655   0.916
   28   HH12  ARG   3          2HH1      ARG   3   3.207  14.225   2.532
   29   HH21  ARG   3          1HH2      ARG   3   4.916  11.370   3.603
   30   HH22  ARG   3          2HH2      ARG   3   4.313  12.928   4.059
   31    H    SER   4           H        SER   4  -0.300  10.011  -2.802
   32    HA   SER   4           HA       SER   4  -2.989  11.191  -2.618
   33    HG   SER   4           HG       SER   4  -3.251   7.823  -4.263
   34    HB2  SER   4           2HB      SER   4  -3.048  10.454  -4.801
   35    HB3  SER   4           1HB      SER   4  -1.766   9.268  -4.540
   36    H    THR   5           H        THR   5  -4.668   9.565  -1.866
   37    HA   THR   5           HA       THR   5  -3.530   7.401  -0.300
   38    HB   THR   5           HB       THR   5  -4.523   8.063   1.790
   39    HG1  THR   5           1HG      THR   5  -5.597  10.219   0.311
   40   HG21  THR   5          3HG2      THR   5  -2.323   9.237   1.022
   41   HG22  THR   5          1HG2      THR   5  -3.175   9.783   2.463
   42   HG23  THR   5          2HG2      THR   5  -3.350  10.668   0.951
   43    H    SER   6           H        SER   6  -4.701   5.629  -0.357
   44    HA   SER   6           HA       SER   6  -7.514   5.850  -1.217
   45    HG   SER   6           HG       SER   6  -7.730   3.582  -3.192
   46    HB2  SER   6           2HB      SER   6  -5.958   4.586  -2.731
   47    HB3  SER   6           1HB      SER   6  -5.713   3.425  -1.426
   48    H    HIS   7           H        HIS   7  -9.086   5.180   0.127
   49    HA   HIS   7           HA       HIS   7  -8.277   3.728   2.570
   50    HD1  HIS   7           1HD      HIS   7  -9.825   6.807   5.084
   51    HD2  HIS   7           2HD      HIS   7 -10.249   2.731   4.403
   52    HE1  HIS   7           1HE      HIS   7 -10.142   5.775   7.353
   53    HE2  HIS   7           2HE      HIS   7 -10.484   3.320   6.907
   54    HB2  HIS   7           2HB      HIS   7  -9.250   6.130   2.708
   55    HB3  HIS   7           1HB      HIS   7 -10.791   5.361   2.362
   56    H    VAL   8           H        VAL   8  -9.185   1.790   3.004
   57    HA   VAL   8           HA       VAL   8 -11.670   1.029   1.640
   58    HB   VAL   8           HB       VAL   8  -9.450  -0.978   1.782
   59   HG11  VAL   8          1HG1      VAL   8 -11.710  -0.654  -0.186
   60   HG12  VAL   8          2HG1      VAL   8 -11.785  -1.650   1.269
   61   HG13  VAL   8          3HG1      VAL   8 -10.636  -2.042  -0.010
   62   HG21  VAL   8          3HG2      VAL   8  -9.850   0.776  -0.628
   63   HG22  VAL   8          1HG2      VAL   8  -8.569  -0.396  -0.326
   64   HG23  VAL   8          2HG2      VAL   8  -8.624   1.103   0.597
   65    H    ARG   9           H        ARG   9 -12.812  -0.735   2.679
   66    HA   ARG   9           HA       ARG   9 -12.045  -0.984   5.505
   67    HE   ARG   9           HE       ARG   9 -16.061   1.333   4.739
   68    HB2  ARG   9           2HB      ARG   9 -14.647  -0.949   4.110
   69    HB3  ARG   9           1HB      ARG   9 -14.512  -2.124   5.409
   70    HG2  ARG   9           2HG      ARG   9 -15.409  -0.146   6.344
   71    HG3  ARG   9           1HG      ARG   9 -13.738  -0.265   6.893
   72    HD2  ARG   9           2HD      ARG   9 -13.681   1.899   6.247
   73    HD3  ARG   9           1HD      ARG   9 -13.368   1.180   4.669
   74   HH11  ARG   9          1HH1      ARG   9 -13.538   3.668   5.338
   75   HH12  ARG   9          2HH1      ARG   9 -14.487   5.016   4.808
   76   HH21  ARG   9          1HH2      ARG   9 -17.311   3.104   4.040
   77   HH22  ARG   9          2HH2      ARG   9 -16.629   4.696   4.071
   78    H    THR  10           H        THR  10 -10.745  -2.687   5.800
   79    HA   THR  10           HA       THR  10 -11.606  -5.287   4.728
   80    HB   THR  10           HB       THR  10  -9.295  -3.875   3.973
   81    HG1  THR  10           1HG      THR  10 -10.182  -5.271   2.574
   82   HG21  THR  10          3HG2      THR  10  -8.459  -5.072   6.197
   83   HG22  THR  10          1HG2      THR  10  -7.452  -4.892   4.756
   84   HG23  THR  10          2HG2      THR  10  -8.283  -6.417   5.063
   85    H    GLU  11           H        GLU  11 -10.877  -7.164   5.975
   86    HA   GLU  11           HA       GLU  11 -10.533  -6.475   8.816
   87    HB2  GLU  11           2HB      GLU  11 -12.262  -8.284   7.468
   88    HB3  GLU  11           1HB      GLU  11 -11.176  -9.232   8.475
   89    HG2  GLU  11           2HG      GLU  11 -12.232  -8.629  10.325
   90    HG3  GLU  11           1HG      GLU  11 -12.163  -6.923   9.887
   91    H    SER  12           H        SER  12  -8.953  -7.484  10.095
   92    HA   SER  12           HA       SER  12  -6.924  -8.371  10.574
   93    HG   SER  12           HG       SER  12  -5.760 -10.902  10.189
   94    HB2  SER  12           2HB      SER  12  -7.875 -10.499  10.158
   95    HB3  SER  12           1HB      SER  12  -7.828 -10.267   8.410
   96    H    ALA  13           H        ALA  13  -7.187  -6.263   8.558
   97    HA   ALA  13           HA       ALA  13  -5.488  -6.444   6.386
   98    HB1  ALA  13           3HB      ALA  13  -6.927  -4.509   6.958
   99    HB2  ALA  13           1HB      ALA  13  -5.295  -4.072   6.454
  100    HB3  ALA  13           2HB      ALA  13  -5.726  -4.061   8.157
  101    H    ALA  14           H        ALA  14  -4.562  -5.362   9.635
  102    HA   ALA  14           HA       ALA  14  -1.968  -4.675   9.300
  103    HB1  ALA  14           3HB      ALA  14  -1.560  -5.387  11.614
  104    HB2  ALA  14           1HB      ALA  14  -3.090  -6.266  11.592
  105    HB3  ALA  14           2HB      ALA  14  -3.078  -4.510  11.413
  106    H    ARG  15           H        ARG  15  -3.109  -7.973   9.013
  107    HA   ARG  15           HA       ARG  15  -0.472  -9.115   9.276
  108    HE   ARG  15           HE       ARG  15   1.692 -12.344   9.542
  109    HB2  ARG  15           2HB      ARG  15  -2.840 -10.200   9.683
  110    HB3  ARG  15           1HB      ARG  15  -2.736 -10.566   7.969
  111    HG2  ARG  15           2HG      ARG  15  -1.178 -11.648  10.238
  112    HG3  ARG  15           1HG      ARG  15  -1.884 -12.466   8.850
  113    HD2  ARG  15           2HD      ARG  15  -0.101 -11.777   7.426
  114    HD3  ARG  15           1HD      ARG  15   0.504 -10.641   8.628
  115   HH11  ARG  15          1HH1      ARG  15  -0.965 -13.732   7.751
  116   HH12  ARG  15          2HH1      ARG  15  -0.499 -15.366   8.086
  117   HH21  ARG  15          1HH2      ARG  15   2.307 -14.493   9.977
  118   HH22  ARG  15          2HH2      ARG  15   1.358 -15.798   9.346
  119    H    TYR  16           H        TYR  16  -2.634  -8.277   6.623
  120    HA   TYR  16           HA       TYR  16  -0.988  -9.414   4.604
  121    HD1  TYR  16           2HD      TYR  16  -2.632 -10.788   4.823
  122    HD2  TYR  16           1HD      TYR  16  -5.184  -7.681   3.405
  123    HE1  TYR  16           2HE      TYR  16  -4.542 -12.306   4.935
  124    HE2  TYR  16           1HE      TYR  16  -7.100  -9.206   3.523
  125    HH   TYR  16           HH       TYR  16  -7.064 -12.211   3.486
  126    HB2  TYR  16           2HB      TYR  16  -2.976  -7.148   4.335
  127    HB3  TYR  16           1HB      TYR  16  -2.277  -8.061   3.008
  128    H    VAL  17           H        VAL  17  -0.792  -6.489   6.443
  129    HA   VAL  17           HA       VAL  17   1.018  -5.190   4.603
  130    HB   VAL  17           HB       VAL  17  -0.028  -4.482   7.316
  131   HG11  VAL  17          1HG1      VAL  17   2.663  -3.805   6.370
  132   HG12  VAL  17          2HG1      VAL  17   1.957  -3.645   7.980
  133   HG13  VAL  17          3HG1      VAL  17   1.673  -2.407   6.764
  134   HG21  VAL  17          3HG2      VAL  17  -1.132  -3.791   5.207
  135   HG22  VAL  17          1HG2      VAL  17   0.315  -2.858   4.820
  136   HG23  VAL  17          2HG2      VAL  17  -0.639  -2.447   6.243
  137    H    ASN  18           H        ASN  18   1.237  -6.933   7.677
  138    HA   ASN  18           HA       ASN  18   4.048  -6.690   7.901
  139    HB2  ASN  18           2HB      ASN  18   2.270  -8.804   9.127
  140    HB3  ASN  18           1HB      ASN  18   3.877  -8.336   9.675
  141   HD21  ASN  18          1HD2      ASN  18   1.427  -8.335  11.173
  142   HD22  ASN  18          2HD2      ASN  18   1.153  -6.707  11.686
  143    H    ARG  19           H        ARG  19   1.968  -8.955   6.219
  144    HA   ARG  19           HA       ARG  19   4.013 -10.928   5.858
  145    HE   ARG  19           HE       ARG  19   2.127 -15.318   6.530
  146    HB2  ARG  19           2HB      ARG  19   1.297 -10.944   5.655
  147    HB3  ARG  19           1HB      ARG  19   1.765 -10.912   3.959
  148    HG2  ARG  19           2HG      ARG  19   2.116 -13.091   4.046
  149    HG3  ARG  19           1HG      ARG  19   3.412 -12.809   5.207
  150    HD2  ARG  19           2HD      ARG  19   1.973 -13.097   7.041
  151    HD3  ARG  19           1HD      ARG  19   0.532 -12.991   6.030
  152   HH11  ARG  19          1HH1      ARG  19  -0.011 -13.786   4.236
  153   HH12  ARG  19          2HH1      ARG  19  -0.503 -15.279   3.509
  154   HH21  ARG  19          1HH2      ARG  19   1.480 -17.282   5.575
  155   HH22  ARG  19          2HH2      ARG  19   0.344 -17.263   4.269
  156    H    LEU  20           H        LEU  20   3.237  -7.994   4.272
  157    HA   LEU  20           HA       LEU  20   4.170  -8.664   1.674
  158    HG   LEU  20           HG       LEU  20   1.741  -6.749   2.848
  159    HB2  LEU  20           2HB      LEU  20   3.947  -5.980   3.020
  160    HB3  LEU  20           1HB      LEU  20   4.265  -6.217   1.314
  161   HD11  LEU  20          1HD1      LEU  20   0.770  -5.192   1.384
  162   HD12  LEU  20          2HD1      LEU  20   2.091  -5.335   0.223
  163   HD13  LEU  20          3HD1      LEU  20   2.353  -4.509   1.758
  164   HD21  LEU  20          3HD2      LEU  20   2.524  -7.866   0.154
  165   HD22  LEU  20          1HD2      LEU  20   0.846  -7.661   0.651
  166   HD23  LEU  20          2HD2      LEU  20   1.906  -8.735   1.560
  167    H    CYS  21           H        CYS  21   5.749  -7.002   4.409
  168    HA   CYS  21           HA       CYS  21   8.149  -6.445   3.098
  169    HG   CYS  21           HG       CYS  21   7.064  -4.920   6.613
  170    HB2  CYS  21           2HB      CYS  21   8.039  -7.170   6.026
  171    HB3  CYS  21           1HB      CYS  21   9.116  -6.041   5.222
  172    H    LYS  22           H        LYS  22   6.978  -9.381   4.577
  173    HA   LYS  22           HA       LYS  22   9.521 -10.733   4.277
  174    HB2  LYS  22           2HB      LYS  22   6.816 -11.853   5.018
  175    HB3  LYS  22           1HB      LYS  22   8.361 -12.680   5.169
  176    HG2  LYS  22           2HG      LYS  22   8.808 -11.710   7.126
  177    HG3  LYS  22           1HG      LYS  22   8.323 -10.116   6.548
  178    HD2  LYS  22           2HD      LYS  22   6.842 -10.676   8.315
  179    HD3  LYS  22           1HD      LYS  22   5.932 -10.874   6.814
  180    HE2  LYS  22           2HE      LYS  22   5.403 -12.766   8.081
  181    HE3  LYS  22           1HE      LYS  22   6.611 -13.325   6.924
  182    HZ1  LYS  22           3HZ      LYS  22   8.223 -12.708   8.875
  183    HZ2  LYS  22           1HZ      LYS  22   7.432 -14.203   8.843
  184    HZ3  LYS  22           2HZ      LYS  22   6.843 -12.955   9.821
  185    H    HIS  23           H        HIS  23   6.681 -10.178   2.418
  186    HA   HIS  23           HA       HIS  23   7.028 -12.466   0.698
  187    HD1  HIS  23           1HD      HIS  23   3.047 -12.720   0.075
  188    HD2  HIS  23           2HD      HIS  23   6.251 -11.682  -2.359
  189    HE1  HIS  23           1HE      HIS  23   2.601 -13.835  -2.134
  190    HE2  HIS  23           2HE      HIS  23   4.600 -13.270  -3.561
  191    HB2  HIS  23           2HB      HIS  23   4.788 -11.459   1.312
  192    HB3  HIS  23           1HB      HIS  23   5.195 -10.114   0.251
  193    H    TRP  24           H        TRP  24   7.009  -8.920   0.113
  194    HA   TRP  24           HA       TRP  24   8.421  -9.379  -2.394
  195    HD1  TRP  24           HD       TRP  24   8.783  -4.857  -2.096
  196    HE1  TRP  24           1HE      TRP  24   9.789  -4.244  -4.383
  197    HE3  TRP  24           3HE      TRP  24   7.626  -9.125  -4.662
  198    HZ2  TRP  24           2HZ      TRP  24  10.056  -5.414  -6.940
  199    HZ3  TRP  24           3HZ      TRP  24   8.292  -9.298  -7.024
  200    HH2  TRP  24           HH       TRP  24   9.481  -7.479  -8.138
  201    HB2  TRP  24           2HB      TRP  24   6.582  -7.771  -2.368
  202    HB3  TRP  24           1HB      TRP  24   7.418  -6.805  -1.156
  203    H    GLY  25           H        GLY  25   9.294  -8.712   0.845
  204    HA2  GLY  25           2HA      GLY  25  11.545  -7.047   0.374
  205    HA3  GLY  25           1HA      GLY  25  11.265  -8.013   1.807
  206    H    HIS  26           H        HIS  26  12.118  -8.493  -1.614
  207    HA   HIS  26           HA       HIS  26  14.036 -10.542  -0.730
  208    HD1  HIS  26           1HD      HIS  26  12.780 -12.475  -0.318
  209    HD2  HIS  26           2HD      HIS  26  14.048 -13.177  -4.214
  210    HE1  HIS  26           1HE      HIS  26  13.377 -14.917  -0.402
  211    HE2  HIS  26           2HE      HIS  26  14.225 -15.297  -2.744
  212    HB2  HIS  26           2HB      HIS  26  11.982 -10.726  -2.625
  213    HB3  HIS  26           1HB      HIS  26  13.464 -10.615  -3.569
  214    H    LYS  27           H        LYS  27  13.576  -7.589  -2.517
  215    HA   LYS  27           HA       LYS  27  16.464  -7.264  -2.693
  216    HB2  LYS  27           2HB      LYS  27  16.094  -8.382  -4.763
  217    HB3  LYS  27           1HB      LYS  27  14.665  -7.425  -5.108
  218    HG2  LYS  27           2HG      LYS  27  17.063  -5.798  -4.806
  219    HG3  LYS  27           1HG      LYS  27  17.191  -6.996  -6.094
  220    HD2  LYS  27           2HD      LYS  27  15.759  -5.888  -7.400
  221    HD3  LYS  27           1HD      LYS  27  14.612  -5.670  -6.080
  222    HE2  LYS  27           2HE      LYS  27  15.720  -3.598  -7.202
  223    HE3  LYS  27           1HE      LYS  27  15.502  -3.648  -5.455
  224    HZ1  LYS  27           3HZ      LYS  27  17.782  -2.978  -6.492
  225    HZ2  LYS  27           1HZ      LYS  27  18.015  -4.650  -6.596
  226    HZ3  LYS  27           2HZ      LYS  27  17.729  -3.926  -5.093
  227    H    PHE  28           H        PHE  28  13.968  -6.034  -1.425
  228    HA   PHE  28           HA       PHE  28  14.680  -3.288  -2.123
  229    HD1  PHE  28           2HD      PHE  28  13.480  -1.563  -3.862
  230    HD2  PHE  28           1HD      PHE  28  11.927  -5.510  -4.187
  231    HE1  PHE  28           2HE      PHE  28  13.659  -1.425  -6.312
  232    HE2  PHE  28           1HE      PHE  28  12.102  -5.381  -6.639
  233    HZ   PHE  28           HZ       PHE  28  12.968  -3.336  -7.704
  234    HB2  PHE  28           2HB      PHE  28  11.885  -4.406  -2.119
  235    HB3  PHE  28           1HB      PHE  28  12.221  -2.680  -2.002
  236    H    GLU  29           H        GLU  29  13.848  -1.690  -0.542
  237    HA   GLU  29           HA       GLU  29  14.349  -2.707   2.120
  238    HB2  GLU  29           2HB      GLU  29  14.204  -0.294   2.783
  239    HB3  GLU  29           1HB      GLU  29  15.431  -0.651   1.577
  240    HG2  GLU  29           2HG      GLU  29  14.171   0.328  -0.148
  241    HG3  GLU  29           1HG      GLU  29  12.711   0.372   0.837
  242    H    VAL  30           H        VAL  30  12.657  -3.809   2.923
  243    HA   VAL  30           HA       VAL  30  10.051  -2.444   2.960
  244    HB   VAL  30           HB       VAL  30   9.333  -4.930   3.632
  245   HG11  VAL  30          1HG1      VAL  30   9.066  -5.303   1.055
  246   HG12  VAL  30          2HG1      VAL  30   9.611  -3.630   0.967
  247   HG13  VAL  30          3HG1      VAL  30   8.159  -4.040   1.884
  248   HG21  VAL  30          3HG2      VAL  30  11.487  -5.513   1.630
  249   HG22  VAL  30          1HG2      VAL  30  10.558  -6.630   2.633
  250   HG23  VAL  30          2HG2      VAL  30  11.793  -5.608   3.366
  251    H    GLU  31           H        GLU  31   9.689  -1.491   4.859
  252    HA   GLU  31           HA       GLU  31  10.842  -2.625   7.288
  253    HB2  GLU  31           2HB      GLU  31  10.198   0.015   6.390
  254    HB3  GLU  31           1HB      GLU  31   9.292  -0.310   7.860
  255    HG2  GLU  31           2HG      GLU  31  11.137  -0.350   9.155
  256    HG3  GLU  31           1HG      GLU  31  12.141  -1.064   7.893
  257    H    LEU  32           H        LEU  32   9.640  -3.422   8.968
  258    HA   LEU  32           HA       LEU  32   6.735  -3.661   8.490
  259    HG   LEU  32           HG       LEU  32   5.862  -6.333   8.427
  260    HB2  LEU  32           2HB      LEU  32   8.115  -5.773   8.183
  261    HB3  LEU  32           1HB      LEU  32   8.400  -5.744   9.912
  262   HD11  LEU  32          1HD1      LEU  32   6.481  -8.379   9.021
  263   HD12  LEU  32          2HD1      LEU  32   6.163  -7.926  10.694
  264   HD13  LEU  32          3HD1      LEU  32   7.787  -7.759  10.029
  265   HD21  LEU  32          3HD2      LEU  32   5.076  -4.696   9.966
  266   HD22  LEU  32          1HD2      LEU  32   6.083  -5.335  11.264
  267   HD23  LEU  32          2HD2      LEU  32   4.711  -6.267  10.673
  268    H    THR  33           H        THR  33   5.754  -2.361   9.849
  269    HA   THR  33           HA       THR  33   6.505  -2.506  12.716
  270    HB   THR  33           HB       THR  33   5.429  -0.061  12.622
  271    HG1  THR  33           1HG      THR  33   5.152  -0.236  10.305
  272   HG21  THR  33          3HG2      THR  33   7.519  -0.065  13.539
  273   HG22  THR  33          1HG2      THR  33   7.823   0.805  12.035
  274   HG23  THR  33          2HG2      THR  33   8.241  -0.903  12.165
  275    HA   PRO  34           HA       PRO  34   2.220  -3.378  13.275
  276    HB2  PRO  34           2HB      PRO  34   1.631  -2.264  15.650
  277    HB3  PRO  34           1HB      PRO  34   2.713  -3.648  15.492
  278    HG2  PRO  34           2HG      PRO  34   3.376  -0.769  15.900
  279    HG3  PRO  34           1HG      PRO  34   4.136  -2.205  16.606
  280    HD2  PRO  34           2HD      PRO  34   5.142  -0.793  14.456
  281    HD3  PRO  34           1HD      PRO  34   5.522  -2.490  14.814
  282    H    GLU  35           H        GLU  35   2.449  -1.384  11.479
  283    HA   GLU  35           HA       GLU  35   0.016   0.077  11.863
  284    HB2  GLU  35           2HB      GLU  35   2.641   1.568  11.701
  285    HB3  GLU  35           1HB      GLU  35   1.063   2.315  11.487
  286    HG2  GLU  35           2HG      GLU  35   0.518   1.401  13.805
  287    HG3  GLU  35           1HG      GLU  35   2.250   1.111  13.959
  288    H    ARG  36           H        ARG  36   2.928  -0.412   9.847
  289    HA   ARG  36           HA       ARG  36   1.348  -0.826   7.542
  290    HE   ARG  36           HE       ARG  36   4.607   4.173   7.577
  291    HB2  ARG  36           2HB      ARG  36   2.164   1.141   6.237
  292    HB3  ARG  36           1HB      ARG  36   1.048   1.555   7.528
  293    HG2  ARG  36           2HG      ARG  36   3.207   1.944   8.919
  294    HG3  ARG  36           1HG      ARG  36   3.987   2.039   7.340
  295    HD2  ARG  36           2HD      ARG  36   2.048   3.705   6.806
  296    HD3  ARG  36           1HD      ARG  36   1.940   3.837   8.560
  297   HH11  ARG  36          1HH1      ARG  36   1.574   5.797   8.158
  298   HH12  ARG  36          2HH1      ARG  36   2.296   7.365   8.294
  299   HH21  ARG  36          1HH2      ARG  36   5.559   6.234   7.756
  300   HH22  ARG  36          2HH2      ARG  36   4.558   7.613   8.066
  301    H    GLY  37           H        GLY  37   2.646  -0.889   5.521
  302    HA2  GLY  37           2HA      GLY  37   5.309  -2.020   6.105
  303    HA3  GLY  37           1HA      GLY  37   4.287  -2.498   4.757
  304    H    PHE  38           H        PHE  38   7.013  -0.737   5.429
  305    HA   PHE  38           HA       PHE  38   6.511   1.336   3.407
  306    HD1  PHE  38           1HD      PHE  38   7.124   3.752   3.571
  307    HD2  PHE  38           2HD      PHE  38  10.774   1.881   4.723
  308    HE1  PHE  38           1HE      PHE  38   8.387   5.619   2.601
  309    HE2  PHE  38           2HE      PHE  38  12.039   3.744   3.745
  310    HZ   PHE  38           HZ       PHE  38  10.847   5.616   2.677
  311    HB2  PHE  38           2HB      PHE  38   7.432   1.999   5.597
  312    HB3  PHE  38           1HB      PHE  38   8.793   0.917   5.359
  313    H    ILE  39           H        ILE  39   7.003   0.816   1.385
  314    HA   ILE  39           HA       ILE  39   9.395  -0.877   0.932
  315    HB   ILE  39           HB       ILE  39   7.063  -0.914  -0.966
  316   HG12  ILE  39          2HG1      ILE  39   7.393  -2.471   1.585
  317   HG13  ILE  39          1HG1      ILE  39   5.939  -1.752   0.899
  318   HG21  ILE  39          1HG2      ILE  39   8.719  -3.303  -0.648
  319   HG22  ILE  39          2HG2      ILE  39   9.622  -1.879  -1.159
  320   HG23  ILE  39          3HG2      ILE  39   8.243  -2.436  -2.106
  321   HD11  ILE  39          3HD1      ILE  39   5.866  -4.181   0.846
  322   HD12  ILE  39          1HD1      ILE  39   7.331  -4.210  -0.137
  323   HD13  ILE  39          2HD1      ILE  39   5.849  -3.501  -0.782
  324    H    ASP  40           H        ASP  40  10.924   0.462   0.079
  325    HA   ASP  40           HA       ASP  40  10.018   2.498  -1.838
  326    HB2  ASP  40           2HB      ASP  40  11.299   3.915  -0.675
  327    HB3  ASP  40           1HB      ASP  40  11.941   2.617   0.315
  328    H    PHE  41           H        PHE  41  10.596   2.429  -3.877
  329    HA   PHE  41           HA       PHE  41  12.301   0.208  -4.750
  330    HD1  PHE  41           1HD      PHE  41   8.574   0.282  -4.813
  331    HD2  PHE  41           2HD      PHE  41  11.571  -1.217  -7.435
  332    HE1  PHE  41           1HE      PHE  41   7.443  -1.900  -4.850
  333    HE2  PHE  41           2HE      PHE  41  10.444  -3.403  -7.478
  334    HZ   PHE  41           HZ       PHE  41   8.377  -3.746  -6.184
  335    HB2  PHE  41           2HB      PHE  41  10.081   1.777  -5.981
  336    HB3  PHE  41           1HB      PHE  41  11.321   1.157  -7.062
  337    H    GLY  42           H        GLY  42  12.856   3.206  -3.820
  338    HA2  GLY  42           2HA      GLY  42  15.183   3.956  -4.314
  339    HA3  GLY  42           1HA      GLY  42  14.738   3.824  -6.011
  340    H    ASP  43           H        ASP  43  13.893   5.575  -6.994
  341    HA   ASP  43           HA       ASP  43  13.500   7.981  -5.406
  342    HB2  ASP  43           2HB      ASP  43  14.205   7.386  -8.145
  343    HB3  ASP  43           1HB      ASP  43  12.844   8.503  -8.103
  344    H    SER  44           H        SER  44  11.684   6.291  -4.603
  345    HA   SER  44           HA       SER  44   9.216   7.486  -4.881
  346    HG   SER  44           HG       SER  44  10.191   4.529  -7.064
  347    HB2  SER  44           2HB      SER  44   8.343   5.231  -6.229
  348    HB3  SER  44           1HB      SER  44   8.583   6.819  -6.959
  349    H    ASN  45           H        ASN  45   7.435   6.057  -3.805
  350    HA   ASN  45           HA       ASN  45   8.484   3.720  -2.440
  351    HB2  ASN  45           2HB      ASN  45   7.329   5.736  -0.585
  352    HB3  ASN  45           1HB      ASN  45   8.573   4.527  -0.295
  353   HD21  ASN  45          1HD2      ASN  45  10.409   5.423   0.242
  354   HD22  ASN  45          2HD2      ASN  45  11.073   6.875  -0.418
  355    H    CYS  46           H        CYS  46   6.772   2.819  -0.882
  356    HA   CYS  46           HA       CYS  46   4.050   3.562  -1.535
  357    HG   CYS  46           HG       CYS  46   2.600   0.424  -2.963
  358    HB2  CYS  46           2HB      CYS  46   4.910   1.958  -3.331
  359    HB3  CYS  46           1HB      CYS  46   4.891   0.724  -2.073
  360    H    GLU  47           H        GLU  47   3.443   3.836   0.529
  361    HA   GLU  47           HA       GLU  47   4.120   1.816   2.523
  362    HB2  GLU  47           2HB      GLU  47   4.219   4.479   2.690
  363    HB3  GLU  47           1HB      GLU  47   2.550   4.266   3.194
  364    HG2  GLU  47           2HG      GLU  47   3.131   3.350   5.190
  365    HG3  GLU  47           1HG      GLU  47   4.602   2.609   4.562
  366    H    LEU  48           H        LEU  48   2.449   0.905   3.900
  367    HA   LEU  48           HA       LEU  48  -0.279   1.113   2.854
  368    HG   LEU  48           HG       LEU  48  -0.983  -2.105   3.769
  369    HB2  LEU  48           2HB      LEU  48   0.680  -0.772   1.648
  370    HB3  LEU  48           1HB      LEU  48   1.211  -1.506   3.146
  371   HD11  LEU  48          1HD1      LEU  48  -2.885  -1.406   2.095
  372   HD12  LEU  48          2HD1      LEU  48  -1.812  -0.040   1.796
  373   HD13  LEU  48          3HD1      LEU  48  -2.406  -0.356   3.427
  374   HD21  LEU  48          3HD2      LEU  48  -0.457  -3.746   2.296
  375   HD22  LEU  48          1HD2      LEU  48  -0.242  -2.629   0.948
  376   HD23  LEU  48          2HD2      LEU  48  -1.865  -3.081   1.468
  377    H    LEU  49           H        LEU  49  -1.511   1.639   4.514
  378    HA   LEU  49           HA       LEU  49  -0.735   0.845   7.227
  379    HG   LEU  49           HG       LEU  49  -2.107   1.689   8.990
  380    HB2  LEU  49           2HB      LEU  49  -1.588   3.192   6.553
  381    HB3  LEU  49           1HB      LEU  49  -3.171   2.439   6.528
  382   HD11  LEU  49          1HD1      LEU  49  -0.494   3.170   9.428
  383   HD12  LEU  49          2HD1      LEU  49  -1.813   4.316   9.667
  384   HD13  LEU  49          3HD1      LEU  49  -0.981   4.239   8.113
  385   HD21  LEU  49          3HD2      LEU  49  -4.408   2.185   8.696
  386   HD22  LEU  49          1HD2      LEU  49  -4.059   3.832   8.175
  387   HD23  LEU  49          2HD2      LEU  49  -3.782   3.361   9.852
  388    H    ALA  50           H        ALA  50  -1.731  -0.734   8.368
  389    HA   ALA  50           HA       ALA  50  -4.286  -1.735   7.374
  390    HB1  ALA  50           3HB      ALA  50  -2.613  -3.003   6.186
  391    HB2  ALA  50           1HB      ALA  50  -3.493  -4.023   7.311
  392    HB3  ALA  50           2HB      ALA  50  -1.868  -3.481   7.711
  393    H    HIS  51           H        HIS  51  -5.607  -1.720   9.010
  394    HA   HIS  51           HA       HIS  51  -4.653  -2.582  11.625
  395    HD1  HIS  51           1HD      HIS  51  -7.590  -0.072  13.798
  396    HD2  HIS  51           2HD      HIS  51  -3.654  -1.299  13.253
  397    HE1  HIS  51           1HE      HIS  51  -6.483   0.198  16.038
  398    HE2  HIS  51           2HE      HIS  51  -4.127  -0.626  15.703
  399    HB2  HIS  51           2HB      HIS  51  -5.826  -0.168  11.011
  400    HB3  HIS  51           1HB      HIS  51  -7.209  -1.112  11.540
  401    HA   PRO  52           HA       PRO  52  -7.228  -6.118  11.884
  402    HB2  PRO  52           2HB      PRO  52  -8.920  -4.660  13.875
  403    HB3  PRO  52           1HB      PRO  52  -8.248  -6.294  13.948
  404    HG2  PRO  52           2HG      PRO  52  -7.085  -4.330  15.283
  405    HG3  PRO  52           1HG      PRO  52  -6.101  -5.530  14.428
  406    HD2  PRO  52           2HD      PRO  52  -6.707  -2.706  13.688
  407    HD3  PRO  52           1HD      PRO  52  -5.232  -3.647  13.409
  408    H    ASP  53           H        ASP  53  -8.852  -3.065  11.233
  409    HA   ASP  53           HA       ASP  53 -10.801  -4.593   9.692
  410    HB2  ASP  53           2HB      ASP  53 -11.654  -3.899  12.051
  411    HB3  ASP  53           1HB      ASP  53 -11.808  -2.297  11.336
  412    H    HIS  54           H        HIS  54  -8.585  -2.150   9.574
  413    HA   HIS  54           HA       HIS  54  -9.900  -1.184   7.177
  414    HD1  HIS  54           1HD      HIS  54 -10.051   0.385  11.229
  415    HD2  HIS  54           2HD      HIS  54  -6.944   1.830   8.877
  416    HE1  HIS  54           1HE      HIS  54  -8.384   1.355  12.840
  417    HE2  HIS  54           2HE      HIS  54  -6.545   2.288  11.391
  418    HB2  HIS  54           2HB      HIS  54  -9.420   1.196   7.670
  419    HB3  HIS  54           1HB      HIS  54 -10.615   0.485   8.740
  420    H    VAL  55           H        VAL  55  -8.467  -0.073   5.654
  421    HA   VAL  55           HA       VAL  55  -5.622  -0.420   6.198
  422    HB   VAL  55           HB       VAL  55  -6.790  -2.393   4.894
  423   HG11  VAL  55          1HG1      VAL  55  -7.100  -2.195   2.635
  424   HG12  VAL  55          2HG1      VAL  55  -5.995  -0.828   2.493
  425   HG13  VAL  55          3HG1      VAL  55  -7.605  -0.593   3.172
  426   HG21  VAL  55          3HG2      VAL  55  -4.389  -2.168   5.409
  427   HG22  VAL  55          1HG2      VAL  55  -4.189  -1.237   3.924
  428   HG23  VAL  55          2HG2      VAL  55  -4.696  -2.924   3.847
  429    H    LEU  56           H        LEU  56  -4.349   1.089   5.270
  430    HA   LEU  56           HA       LEU  56  -5.647   3.054   3.492
  431    HG   LEU  56           HG       LEU  56  -6.396   4.635   5.465
  432    HB2  LEU  56           2HB      LEU  56  -4.329   3.433   6.038
  433    HB3  LEU  56           1HB      LEU  56  -3.463   4.302   4.793
  434   HD11  LEU  56          1HD1      LEU  56  -5.817   6.657   6.532
  435   HD12  LEU  56          2HD1      LEU  56  -4.155   6.583   5.946
  436   HD13  LEU  56          3HD1      LEU  56  -4.713   5.436   7.166
  437   HD21  LEU  56          3HD2      LEU  56  -4.647   5.762   3.329
  438   HD22  LEU  56          1HD2      LEU  56  -5.852   6.812   4.073
  439   HD23  LEU  56          2HD2      LEU  56  -6.355   5.324   3.276
  440    H    MET  57           H        MET  57  -4.410   3.889   1.806
  441    HA   MET  57           HA       MET  57  -1.821   2.572   1.372
  442    HB2  MET  57           2HB      MET  57  -3.736   3.138  -0.870
  443    HB3  MET  57           1HB      MET  57  -2.337   2.070  -0.864
  444    HG2  MET  57           2HG      MET  57  -3.488   0.574   0.708
  445    HG3  MET  57           1HG      MET  57  -4.896   1.635   0.657
  446    HE1  MET  57           3HE      MET  57  -7.044   0.214  -1.380
  447    HE2  MET  57           1HE      MET  57  -6.471   1.520  -2.418
  448    HE3  MET  57           2HE      MET  57  -6.505   1.735  -0.668
  449    H    ILE  58           H        ILE  58  -0.260   4.087   1.382
  450    HA   ILE  58           HA       ILE  58  -0.833   6.647   0.055
  451    HB   ILE  58           HB       ILE  58   1.000   6.238   2.424
  452   HG12  ILE  58          2HG1      ILE  58  -1.859   6.581   2.332
  453   HG13  ILE  58          1HG1      ILE  58  -0.827   6.355   3.729
  454   HG21  ILE  58          1HG2      ILE  58   1.657   8.029   0.885
  455   HG22  ILE  58          2HG2      ILE  58   1.166   8.652   2.460
  456   HG23  ILE  58          3HG2      ILE  58   0.067   8.767   1.083
  457   HD11  ILE  58          3HD1      ILE  58  -0.619   8.632   4.103
  458   HD12  ILE  58          1HD1      ILE  58  -2.301   8.449   3.605
  459   HD13  ILE  58          2HD1      ILE  58  -1.101   9.051   2.459
  460    H    LEU  59           H        LEU  59   0.662   7.361  -1.390
  461    HA   LEU  59           HA       LEU  59   3.102   5.734  -1.689
  462    HG   LEU  59           HG       LEU  59   1.286   7.022  -5.333
  463    HB2  LEU  59           2HB      LEU  59   2.951   5.803  -4.008
  464    HB3  LEU  59           1HB      LEU  59   1.311   5.489  -3.489
  465   HD11  LEU  59          1HD1      LEU  59   0.687   8.487  -2.786
  466   HD12  LEU  59          2HD1      LEU  59  -0.378   7.324  -3.576
  467   HD13  LEU  59          3HD1      LEU  59   0.026   8.842  -4.379
  468   HD21  LEU  59          3HD2      LEU  59   2.550   9.281  -3.975
  469   HD22  LEU  59          1HD2      LEU  59   2.644   8.766  -5.654
  470   HD23  LEU  59          2HD2      LEU  59   3.656   7.992  -4.440
  471    H    ASN  60           H        ASN  60   5.008   6.765  -2.200
  472    HA   ASN  60           HA       ASN  60   4.932   9.712  -2.155
  473    HB2  ASN  60           2HB      ASN  60   7.259   8.104  -1.108
  474    HB3  ASN  60           1HB      ASN  60   6.895   9.806  -0.834
  475   HD21  ASN  60          1HD2      ASN  60   5.546   6.576  -0.267
  476   HD22  ASN  60          2HD2      ASN  60   4.899   6.934   1.294
  477    H    SER  61           H        SER  61   5.184  10.171  -4.276
  478    HA   SER  61           HA       SER  61   7.670   9.223  -5.521
  479    HG   SER  61           HG       SER  61   5.651   7.138  -5.300
  480    HB2  SER  61           2HB      SER  61   5.422   9.041  -7.389
  481    HB3  SER  61           1HB      SER  61   6.760   7.929  -7.123
  482    HA   PRO  62           HA       PRO  62   7.902  13.406  -6.956
  483    HB2  PRO  62           2HB      PRO  62   9.788  13.011  -8.864
  484    HB3  PRO  62           1HB      PRO  62  10.120  13.074  -7.133
  485    HG2  PRO  62           2HG      PRO  62   9.733  10.665  -8.878
  486    HG3  PRO  62           1HG      PRO  62  11.005  10.981  -7.679
  487    HD2  PRO  62           2HD      PRO  62   8.912   9.455  -7.081
  488    HD3  PRO  62           1HD      PRO  62   9.578  10.585  -5.889
  489    H    ASP  63           H        ASP  63   6.785  10.813  -8.968
  490    HA   ASP  63           HA       ASP  63   5.663  12.840 -10.750
  491    HB2  ASP  63           2HB      ASP  63   7.455  10.594 -11.587
  492    HB3  ASP  63           1HB      ASP  63   6.192  11.151 -12.681
  493    H    GLU  64           H        GLU  64   3.719  12.170 -11.852
  494    HA   GLU  64           HA       GLU  64   2.071  10.516 -10.237
  495    HB2  GLU  64           2HB      GLU  64   1.659  11.802 -12.908
  496    HB3  GLU  64           1HB      GLU  64   0.585  10.495 -12.440
  497    HG2  GLU  64           2HG      GLU  64  -0.580  12.209 -11.557
  498    HG3  GLU  64           1HG      GLU  64   0.475  11.867 -10.181
  499    H    ASP  65           H        ASP  65   3.720   9.709 -13.324
  500    HA   ASP  65           HA       ASP  65   2.646   7.222 -13.810
  501    HB2  ASP  65           2HB      ASP  65   4.478   8.400 -15.109
  502    HB3  ASP  65           1HB      ASP  65   5.609   7.793 -13.902
  503    H    SER  66           H        SER  66   5.419   7.966 -11.756
  504    HA   SER  66           HA       SER  66   5.706   5.425 -10.573
  505    HG   SER  66           HG       SER  66   6.563   6.104  -8.065
  506    HB2  SER  66           2HB      SER  66   7.436   7.245 -10.505
  507    HB3  SER  66           1HB      SER  66   6.410   8.101  -9.350
  508    H    LEU  67           H        LEU  67   4.340   8.411  -9.349
  509    HA   LEU  67           HA       LEU  67   3.242   7.785  -6.981
  510    HG   LEU  67           HG       LEU  67   1.031   9.507  -6.497
  511    HB2  LEU  67           2HB      LEU  67   3.090   9.989  -7.791
  512    HB3  LEU  67           1HB      LEU  67   2.257   9.494  -9.234
  513   HD11  LEU  67          1HD1      LEU  67   1.016  11.708  -6.751
  514   HD12  LEU  67          2HD1      LEU  67  -0.246  11.413  -7.947
  515   HD13  LEU  67          3HD1      LEU  67   1.429  11.603  -8.461
  516   HD21  LEU  67          3HD2      LEU  67   0.016   8.800  -9.200
  517   HD22  LEU  67          1HD2      LEU  67  -1.073   9.562  -8.044
  518   HD23  LEU  67          2HD2      LEU  67  -0.302   8.028  -7.646
  519    H    ALA  68           H        ALA  68   1.377   7.449 -10.021
  520    HA   ALA  68           HA       ALA  68  -0.737   6.033  -8.766
  521    HB1  ALA  68           3HB      ALA  68  -1.315   7.093 -10.772
  522    HB2  ALA  68           1HB      ALA  68  -1.271   5.385 -11.205
  523    HB3  ALA  68           2HB      ALA  68   0.078   6.439 -11.633
  524    H    HIS  69           H        HIS  69   2.205   5.029 -10.435
  525    HA   HIS  69           HA       HIS  69   1.686   2.311 -10.735
  526    HD1  HIS  69           1HD      HIS  69   6.261   2.187 -11.539
  527    HD2  HIS  69           2HD      HIS  69   2.814   0.163 -10.409
  528    HE1  HIS  69           1HE      HIS  69   6.818  -0.256 -11.746
  529    HE2  HIS  69           2HE      HIS  69   4.746  -1.462 -10.973
  530    HB2  HIS  69           2HB      HIS  69   3.685   3.504 -11.636
  531    HB3  HIS  69           1HB      HIS  69   4.348   3.548 -10.006
  532    H    MET  70           H        MET  70   2.737   4.157  -7.956
  533    HA   MET  70           HA       MET  70   3.152   1.840  -6.278
  534    HB2  MET  70           2HB      MET  70   2.829   4.636  -5.241
  535    HB3  MET  70           1HB      MET  70   3.861   3.360  -4.620
  536    HG2  MET  70           2HG      MET  70   4.553   4.196  -7.328
  537    HG3  MET  70           1HG      MET  70   4.668   5.482  -6.132
  538    HE1  MET  70           3HE      MET  70   6.927   3.023  -7.881
  539    HE2  MET  70           1HE      MET  70   5.653   1.996  -7.222
  540    HE3  MET  70           2HE      MET  70   7.310   1.828  -6.641
  541    H    GLN  71           H        GLN  71   0.769   4.556  -6.136
  542    HA   GLN  71           HA       GLN  71  -0.788   3.485  -4.127
  543    HB2  GLN  71           2HB      GLN  71  -2.736   4.743  -5.357
  544    HB3  GLN  71           1HB      GLN  71  -1.465   5.628  -4.537
  545    HG2  GLN  71           2HG      GLN  71  -0.884   6.634  -6.418
  546    HG3  GLN  71           1HG      GLN  71  -0.804   5.109  -7.297
  547   HE21  GLN  71          1HE2      GLN  71  -2.904   4.202  -7.992
  548   HE22  GLN  71          2HE2      GLN  71  -4.126   5.304  -8.518
  549    H    ASN  72           H        ASN  72  -0.664   2.560  -7.476
  550    HA   ASN  72           HA       ASN  72  -3.119   1.044  -7.348
  551    HB2  ASN  72           2HB      ASN  72  -1.851   2.151  -9.427
  552    HB3  ASN  72           1HB      ASN  72  -1.154   0.536  -9.518
  553   HD21  ASN  72          1HD2      ASN  72  -4.310   2.091  -9.054
  554   HD22  ASN  72          2HD2      ASN  72  -5.184   1.004 -10.074
  555    H    VAL  73           H        VAL  73   0.361   0.335  -7.321
  556    HA   VAL  73           HA       VAL  73   0.427  -2.378  -7.500
  557    HB   VAL  73           HB       VAL  73   2.035  -0.483  -5.816
  558   HG11  VAL  73          1HG1      VAL  73   2.047  -2.475  -4.482
  559   HG12  VAL  73          2HG1      VAL  73   3.594  -2.359  -5.322
  560   HG13  VAL  73          3HG1      VAL  73   2.358  -3.479  -5.899
  561   HG21  VAL  73          3HG2      VAL  73   3.296  -2.239  -7.804
  562   HG22  VAL  73          1HG2      VAL  73   3.503  -0.511  -7.517
  563   HG23  VAL  73          2HG2      VAL  73   2.124  -1.091  -8.451
  564    H    VAL  74           H        VAL  74  -0.331  -0.492  -4.591
  565    HA   VAL  74           HA       VAL  74  -0.716  -2.772  -2.920
  566    HB   VAL  74           HB       VAL  74  -1.742   0.047  -2.583
  567   HG11  VAL  74          1HG1      VAL  74  -2.217  -0.471  -0.302
  568   HG12  VAL  74          2HG1      VAL  74  -1.517  -2.078  -0.461
  569   HG13  VAL  74          3HG1      VAL  74  -3.017  -1.686  -1.297
  570   HG21  VAL  74          3HG2      VAL  74   0.275  -0.623  -0.705
  571   HG22  VAL  74          1HG2      VAL  74   0.324   0.593  -1.979
  572   HG23  VAL  74          2HG2      VAL  74   0.868  -1.053  -2.307
  573    H    ALA  75           H        ALA  75  -2.970  -0.647  -4.707
  574    HA   ALA  75           HA       ALA  75  -5.386  -1.671  -3.892
  575    HB1  ALA  75           3HB      ALA  75  -4.597  -0.800  -6.673
  576    HB2  ALA  75           1HB      ALA  75  -5.276   0.215  -5.399
  577    HB3  ALA  75           2HB      ALA  75  -6.254  -1.057  -6.130
  578    H    ASP  76           H        ASP  76  -2.950  -3.104  -5.876
  579    HA   ASP  76           HA       ASP  76  -4.597  -5.216  -6.919
  580    HB2  ASP  76           2HB      ASP  76  -2.210  -4.181  -7.678
  581    HB3  ASP  76           1HB      ASP  76  -1.668  -5.612  -6.807
  582    H    HIS  77           H        HIS  77  -2.267  -4.875  -4.272
  583    HA   HIS  77           HA       HIS  77  -2.165  -7.563  -3.503
  584    HD1  HIS  77           1HD      HIS  77  -0.586  -6.308  -4.804
  585    HD2  HIS  77           2HD      HIS  77   1.058  -4.718  -1.335
  586    HE1  HIS  77           1HE      HIS  77   1.684  -5.454  -5.465
  587    HE2  HIS  77           2HE      HIS  77   2.691  -4.572  -3.332
  588    HB2  HIS  77           2HB      HIS  77  -1.891  -5.184  -1.662
  589    HB3  HIS  77           1HB      HIS  77  -1.243  -6.795  -1.411
  590    H    LEU  78           H        LEU  78  -4.401  -4.991  -2.507
  591    HA   LEU  78           HA       LEU  78  -5.742  -6.490  -0.529
  592    HG   LEU  78           HG       LEU  78  -4.994  -3.272  -0.715
  593    HB2  LEU  78           2HB      LEU  78  -6.618  -4.126  -2.187
  594    HB3  LEU  78           1HB      LEU  78  -7.578  -4.799  -0.889
  595   HD11  LEU  78          1HD1      LEU  78  -6.210  -1.859   0.743
  596   HD12  LEU  78          2HD1      LEU  78  -7.547  -3.003   0.850
  597   HD13  LEU  78          3HD1      LEU  78  -7.236  -2.150  -0.661
  598   HD21  LEU  78          3HD2      LEU  78  -4.424  -4.991   0.738
  599   HD22  LEU  78          1HD2      LEU  78  -6.096  -5.266   1.228
  600   HD23  LEU  78          2HD2      LEU  78  -5.230  -3.844   1.807
  601    H    GLN  79           H        GLN  79  -5.851  -6.593  -3.961
  602    HA   GLN  79           HA       GLN  79  -8.507  -7.565  -4.249
  603    HB2  GLN  79           2HB      GLN  79  -6.137  -7.855  -6.099
  604    HB3  GLN  79           1HB      GLN  79  -7.810  -8.183  -6.527
  605    HG2  GLN  79           2HG      GLN  79  -7.530  -5.538  -5.423
  606    HG3  GLN  79           1HG      GLN  79  -6.436  -5.778  -6.783
  607   HE21  GLN  79          1HE2      GLN  79  -8.321  -3.946  -7.106
  608   HE22  GLN  79          2HE2      GLN  79  -9.571  -4.499  -8.162
  609    H    ARG  80           H        ARG  80  -5.402  -9.296  -4.643
  610    HA   ARG  80           HA       ARG  80  -6.480 -11.841  -4.829
  611    HE   ARG  80           HE       ARG  80  -3.930 -11.865  -1.723
  612    HB2  ARG  80           2HB      ARG  80  -4.181 -12.554  -3.825
  613    HB3  ARG  80           1HB      ARG  80  -4.256 -11.794  -5.408
  614    HG2  ARG  80           2HG      ARG  80  -2.950 -10.145  -4.746
  615    HG3  ARG  80           1HG      ARG  80  -3.992  -9.795  -3.365
  616    HD2  ARG  80           2HD      ARG  80  -1.694 -11.731  -3.523
  617    HD3  ARG  80           1HD      ARG  80  -1.853 -10.315  -2.484
  618   HH11  ARG  80          1HH1      ARG  80  -0.517 -12.485  -2.098
  619   HH12  ARG  80          2HH1      ARG  80  -0.471 -13.691  -0.856
  620   HH21  ARG  80          1HH2      ARG  80  -3.873 -13.451  -0.089
  621   HH22  ARG  80          2HH2      ARG  80  -2.377 -14.240   0.284
  622    H    MET  81           H        MET  81  -5.859  -9.924  -1.954
  623    HA   MET  81           HA       MET  81  -6.227 -12.159  -0.182
  624    HB2  MET  81           2HB      MET  81  -6.128 -10.529   1.627
  625    HB3  MET  81           1HB      MET  81  -4.804 -10.318   0.501
  626    HG2  MET  81           2HG      MET  81  -5.540  -8.166   1.112
  627    HG3  MET  81           1HG      MET  81  -6.092  -8.440  -0.537
  628    HE1  MET  81           3HE      MET  81  -8.017  -7.290   3.138
  629    HE2  MET  81           1HE      MET  81  -8.082  -6.118   1.821
  630    HE3  MET  81           2HE      MET  81  -6.545  -6.858   2.270
  631    H    ALA  82           H        ALA  82  -8.322 -10.100  -1.880
  632    HA   ALA  82           HA       ALA  82 -10.585 -11.075  -0.257
  633    HB1  ALA  82           3HB      ALA  82 -10.022  -8.282  -1.171
  634    HB2  ALA  82           1HB      ALA  82 -10.569  -8.859   0.404
  635    HB3  ALA  82           2HB      ALA  82 -11.686  -8.827  -0.961
  636    H    ASN  83           H        ASN  83 -11.021 -12.714  -1.735
  637    HA   ASN  83           HA       ASN  83 -11.411 -12.095  -4.531
  638    HB2  ASN  83           2HB      ASN  83 -11.167 -14.504  -2.897
  639    HB3  ASN  83           1HB      ASN  83 -12.422 -14.642  -4.124
  640   HD21  ASN  83          1HD2      ASN  83 -11.586 -13.511  -6.280
  641   HD22  ASN  83          2HD2      ASN  83 -10.065 -14.123  -6.823
  642    H    SER  84           H        SER  84 -13.183 -11.025  -5.109
  643    HA   SER  84           HA       SER  84 -15.746 -12.082  -4.939
  644    HG   SER  84           HG       SER  84 -17.672 -10.752  -2.742
  645    HB2  SER  84           2HB      SER  84 -15.792 -11.650  -2.587
  646    HB3  SER  84           1HB      SER  84 -15.138 -10.027  -2.807
  647    H    GLU  85           H        GLU  85 -13.817  -9.140  -5.041
  648    HA   GLU  85           HA       GLU  85 -15.092  -8.339  -7.500
  649    HB2  GLU  85           2HB      GLU  85 -15.867  -6.181  -6.745
  650    HB3  GLU  85           1HB      GLU  85 -16.613  -7.426  -5.754
  651    HG2  GLU  85           2HG      GLU  85 -15.022  -6.983  -3.969
  652    HG3  GLU  85           1HG      GLU  85 -14.229  -5.763  -4.964
  653    H    SER  86           H        SER  86 -14.103  -6.171  -8.258
  654    HA   SER  86           HA       SER  86 -11.245  -6.428  -8.004
  655    HG   SER  86           HG       SER  86 -10.982  -3.526  -9.200
  656    HB2  SER  86           2HB      SER  86 -12.136  -5.917 -10.192
  657    HB3  SER  86           1HB      SER  86 -12.973  -4.495  -9.568
  658    H    LEU  87           H        LEU  87 -11.416  -5.997  -5.654
  659    HA   LEU  87           HA       LEU  87 -11.627  -4.564  -3.807
  660    HG   LEU  87           HG       LEU  87  -8.128  -4.735  -3.221
  661    HB2  LEU  87           2HB      LEU  87  -9.142  -4.456  -5.229
  662    HB3  LEU  87           1HB      LEU  87  -9.461  -2.887  -4.516
  663   HD11  LEU  87          1HD1      LEU  87  -9.195  -3.724  -1.079
  664   HD12  LEU  87          2HD1      LEU  87 -10.106  -2.734  -2.220
  665   HD13  LEU  87          3HD1      LEU  87  -8.342  -2.671  -2.209
  666   HD21  LEU  87          3HD2      LEU  87  -9.492  -5.982  -1.652
  667   HD22  LEU  87          1HD2      LEU  87  -9.892  -6.440  -3.305
  668   HD23  LEU  87          2HD2      LEU  87 -10.960  -5.367  -2.402
  669    H    GLU  88           H        GLU  88 -13.170  -3.113  -3.456
  670    HA   GLU  88           HA       GLU  88 -13.536  -0.840  -5.181
  671    HB2  GLU  88           2HB      GLU  88 -15.411  -1.912  -3.919
  672    HB3  GLU  88           1HB      GLU  88 -14.673  -1.361  -2.421
  673    HG2  GLU  88           2HG      GLU  88 -14.999   0.939  -3.055
  674    HG3  GLU  88           1HG      GLU  88 -15.613   0.451  -4.633
  675    H    ILE  89           H        ILE  89 -11.726   0.443  -5.175
  676    HA   ILE  89           HA       ILE  89 -10.984   1.577  -2.573
  677    HB   ILE  89           HB       ILE  89  -8.660   1.566  -3.081
  678   HG12  ILE  89          2HG1      ILE  89  -9.135   1.970  -5.642
  679   HG13  ILE  89          1HG1      ILE  89  -7.657   1.182  -5.126
  680   HG21  ILE  89          1HG2      ILE  89  -9.058  -0.489  -2.194
  681   HG22  ILE  89          2HG2      ILE  89  -8.347  -0.944  -3.740
  682   HG23  ILE  89          3HG2      ILE  89 -10.095  -0.992  -3.528
  683   HD11  ILE  89          3HD1      ILE  89  -8.585   0.039  -7.022
  684   HD12  ILE  89          1HD1      ILE  89 -10.123  -0.167  -6.188
  685   HD13  ILE  89          2HD1      ILE  89  -8.683  -1.000  -5.600
  686    H    ALA  90           H        ALA  90 -11.063   3.796  -2.491
  687    HA   ALA  90           HA       ALA  90 -11.369   5.172  -5.064
  688    HB1  ALA  90           3HB      ALA  90 -13.045   5.520  -3.168
  689    HB2  ALA  90           1HB      ALA  90 -12.380   6.967  -3.924
  690    HB3  ALA  90           2HB      ALA  90 -11.769   6.435  -2.359
  691    H    TRP  91           H        TRP  91  -9.535   5.818  -5.906
  692    HA   TRP  91           HA       TRP  91  -7.311   6.579  -4.181
  693    HD1  TRP  91           HD       TRP  91  -8.818   4.497  -7.746
  694    HE1  TRP  91           1HE      TRP  91  -9.351   5.425 -10.087
  695    HE3  TRP  91           3HE      TRP  91  -5.864   8.669  -7.656
  696    HZ2  TRP  91           2HZ      TRP  91  -8.616   7.634 -11.684
  697    HZ3  TRP  91           3HZ      TRP  91  -5.835  10.137  -9.631
  698    HH2  TRP  91           HH       TRP  91  -7.183   9.628 -11.603
  699    HB2  TRP  91           2HB      TRP  91  -5.967   6.548  -6.237
  700    HB3  TRP  91           1HB      TRP  91  -6.842   5.035  -6.019
  701    H    GLN  92           H        GLN  92  -6.606   8.595  -3.907
  702    HA   GLN  92           HA       GLN  92  -8.151  10.753  -5.098
  703    HB2  GLN  92           2HB      GLN  92  -5.993  10.778  -2.980
  704    HB3  GLN  92           1HB      GLN  92  -6.889  12.194  -3.513
  705    HG2  GLN  92           2HG      GLN  92  -8.970  11.159  -2.740
  706    HG3  GLN  92           1HG      GLN  92  -8.055   9.759  -2.182
  707   HE21  GLN  92          1HE2      GLN  92  -9.633  11.122  -0.441
  708   HE22  GLN  92          2HE2      GLN  92  -8.659  11.985   0.695
  709    HA   PRO  93           HA       PRO  93  -5.449  12.136  -8.270
  710    HB2  PRO  93           2HB      PRO  93  -5.240  14.704  -6.779
  711    HB3  PRO  93           1HB      PRO  93  -5.626  14.423  -8.480
  712    HG2  PRO  93           2HG      PRO  93  -7.544  15.041  -6.733
  713    HG3  PRO  93           1HG      PRO  93  -7.829  13.861  -8.027
  714    HD2  PRO  93           2HD      PRO  93  -7.419  13.418  -5.115
  715    HD3  PRO  93           1HD      PRO  93  -8.381  12.484  -6.278
  716    H    ALA  94           H        ALA  94  -4.470  13.082  -4.989
  717    HA   ALA  94           HA       ALA  94  -2.456  12.479  -3.955
  718    HB1  ALA  94           3HB      ALA  94  -0.646  11.563  -5.043
  719    HB2  ALA  94           1HB      ALA  94  -0.934  12.490  -6.513
  720    HB3  ALA  94           2HB      ALA  94  -1.951  11.101  -6.139
  721    H    GLU  95           H        GLU  95  -3.455  14.933  -4.015
  722    HA   GLU  95           HA       GLU  95  -2.944  17.135  -3.764
  723    HB2  GLU  95           2HB      GLU  95  -0.863  15.814  -2.693
  724    HB3  GLU  95           1HB      GLU  95  -0.020  16.674  -3.974
  725    HG2  GLU  95           2HG      GLU  95  -0.149  18.621  -2.905
  726    HG3  GLU  95           1HG      GLU  95  -1.841  18.375  -2.475
  727    H    SER  96           H        SER  96  -3.469  18.353  -5.455
  728    HA   SER  96           HA       SER  96  -1.579  18.485  -7.708
  729    HG   SER  96           HG       SER  96  -5.055  18.602  -6.985
  730    HB2  SER  96           2HB      SER  96  -3.870  19.089  -8.974
  731    HB3  SER  96           1HB      SER  96  -3.263  17.438  -8.848
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1   6.869  13.267  -5.224
    2    HB2  MET   1           2HB      MET   1   7.503  13.573  -2.909
    3    HB3  MET   1           1HB      MET   1   8.804  14.102  -3.972
    4    HG2  MET   1           2HG      MET   1   6.975  16.247  -3.239
    5    HG3  MET   1           1HG      MET   1   7.770  15.505  -1.854
    6    HE1  MET   1           3HE      MET   1  10.436  18.100  -1.782
    7    HE2  MET   1           1HE      MET   1   9.547  16.846  -0.916
    8    HE3  MET   1           2HE      MET   1   8.683  18.208  -1.627
    9    H    PHE   2           H        PHE   2   4.781  13.334  -5.811
   10    HA   PHE   2           HA       PHE   2   2.928  15.076  -4.361
   11    HD1  PHE   2           1HD      PHE   2   3.453  16.448  -6.736
   12    HD2  PHE   2           2HD      PHE   2   2.859  12.528  -8.286
   13    HE1  PHE   2           1HE      PHE   2   4.743  17.049  -8.743
   14    HE2  PHE   2           2HE      PHE   2   4.138  13.125 -10.293
   15    HZ   PHE   2           HZ       PHE   2   5.089  15.385 -10.526
   16    HB2  PHE   2           2HB      PHE   2   1.871  13.096  -6.300
   17    HB3  PHE   2           1HB      PHE   2   1.446  14.788  -6.085
   18    H    ARG   3           H        ARG   3   0.790  13.860  -3.617
   19    HA   ARG   3           HA       ARG   3   1.390  11.149  -2.775
   20    HE   ARG   3           HE       ARG   3   4.424  12.733   1.145
   21    HB2  ARG   3           2HB      ARG   3   1.966  13.242  -1.016
   22    HB3  ARG   3           1HB      ARG   3   0.453  12.557  -0.431
   23    HG2  ARG   3           2HG      ARG   3   1.734  11.066   0.603
   24    HG3  ARG   3           1HG      ARG   3   1.930  10.332  -0.979
   25    HD2  ARG   3           2HD      ARG   3   4.115  10.610  -0.658
   26    HD3  ARG   3           1HD      ARG   3   3.824  12.311  -1.001
   27   HH11  ARG   3          1HH1      ARG   3   3.091   9.506   1.036
   28   HH12  ARG   3          2HH1      ARG   3   3.324   9.222   2.728
   29   HH21  ARG   3          1HH2      ARG   3   4.731  12.355   3.367
   30   HH22  ARG   3          2HH2      ARG   3   4.255  10.837   4.050
   31    H    SER   4           H        SER   4  -0.315   9.910  -2.889
   32    HA   SER   4           HA       SER   4  -3.019  11.063  -2.755
   33    HG   SER   4           HG       SER   4  -4.517   8.845  -4.102
   34    HB2  SER   4           2HB      SER   4  -3.062  10.245  -4.907
   35    HB3  SER   4           1HB      SER   4  -1.759   9.096  -4.604
   36    H    THR   5           H        THR   5  -4.686   9.480  -1.953
   37    HA   THR   5           HA       THR   5  -3.572   7.354  -0.314
   38    HB   THR   5           HB       THR   5  -4.552   8.077   1.751
   39    HG1  THR   5           1HG      THR   5  -5.841   9.847   1.910
   40   HG21  THR   5          3HG2      THR   5  -3.430  10.683   0.856
   41   HG22  THR   5          1HG2      THR   5  -2.374   9.271   0.920
   42   HG23  THR   5          2HG2      THR   5  -3.211   9.813   2.372
   43    H    SER   6           H        SER   6  -4.747   5.582  -0.400
   44    HA   SER   6           HA       SER   6  -7.555   5.813  -1.274
   45    HG   SER   6           HG       SER   6  -8.111   3.115  -1.430
   46    HB2  SER   6           2HB      SER   6  -6.024   4.501  -2.751
   47    HB3  SER   6           1HB      SER   6  -5.749   3.385  -1.415
   48    H    HIS   7           H        HIS   7  -9.170   5.126   0.037
   49    HA   HIS   7           HA       HIS   7  -8.390   3.750   2.529
   50    HD1  HIS   7           1HD      HIS   7 -11.088   7.152   1.001
   51    HD2  HIS   7           2HD      HIS   7 -12.567   3.942   3.191
   52    HE1  HIS   7           1HE      HIS   7 -13.560   7.113   0.550
   53    HE2  HIS   7           2HE      HIS   7 -14.403   5.074   1.763
   54    HB2  HIS   7           2HB      HIS   7  -9.940   4.980   3.740
   55    HB3  HIS   7           1HB      HIS   7  -9.375   6.167   2.570
   56    H    VAL   8           H        VAL   8  -9.295   1.820   2.993
   57    HA   VAL   8           HA       VAL   8 -11.781   1.041   1.646
   58    HB   VAL   8           HB       VAL   8  -9.548  -0.955   1.803
   59   HG11  VAL   8          1HG1      VAL   8 -10.752  -2.082   0.077
   60   HG12  VAL   8          2HG1      VAL   8 -11.823  -0.701  -0.156
   61   HG13  VAL   8          3HG1      VAL   8 -11.903  -1.638   1.338
   62   HG21  VAL   8          3HG2      VAL   8  -8.712   1.062   0.580
   63   HG22  VAL   8          1HG2      VAL   8 -10.009   0.816  -0.590
   64   HG23  VAL   8          2HG2      VAL   8  -8.762  -0.414  -0.383
   65    H    ARG   9           H        ARG   9 -12.931  -0.692   2.725
   66    HA   ARG   9           HA       ARG   9 -12.136  -0.914   5.545
   67    HE   ARG   9           HE       ARG   9 -14.847   2.492   6.897
   68    HB2  ARG   9           2HB      ARG   9 -14.771  -0.957   4.167
   69    HB3  ARG   9           1HB      ARG   9 -14.594  -1.961   5.597
   70    HG2  ARG   9           2HG      ARG   9 -15.481   0.141   6.272
   71    HG3  ARG   9           1HG      ARG   9 -13.812   0.047   6.837
   72    HD2  ARG   9           2HD      ARG   9 -13.054   1.526   5.174
   73    HD3  ARG   9           1HD      ARG   9 -14.547   1.371   4.246
   74   HH11  ARG   9          1HH1      ARG   9 -14.371   3.151   3.500
   75   HH12  ARG   9          2HH1      ARG   9 -14.970   4.772   3.607
   76   HH21  ARG   9          1HH2      ARG   9 -15.633   4.622   7.033
   77   HH22  ARG   9          2HH2      ARG   9 -15.685   5.608   5.609
   78    H    THR  10           H        THR  10 -10.861  -2.633   5.842
   79    HA   THR  10           HA       THR  10 -11.768  -5.229   4.792
   80    HB   THR  10           HB       THR  10  -9.520  -3.879   3.917
   81    HG1  THR  10           1HG      THR  10 -10.107  -6.650   3.879
   82   HG21  THR  10          3HG2      THR  10  -7.612  -4.716   4.770
   83   HG22  THR  10          1HG2      THR  10  -8.370  -6.229   5.274
   84   HG23  THR  10          2HG2      THR  10  -8.595  -4.767   6.243
   85    H    GLU  11           H        GLU  11 -11.032  -7.116   6.004
   86    HA   GLU  11           HA       GLU  11 -10.652  -6.480   8.854
   87    HB2  GLU  11           2HB      GLU  11 -12.386  -8.269   7.486
   88    HB3  GLU  11           1HB      GLU  11 -11.280  -9.233   8.454
   89    HG2  GLU  11           2HG      GLU  11 -12.343  -8.707  10.319
   90    HG3  GLU  11           1HG      GLU  11 -12.237  -6.986   9.957
   91    H    SER  12           H        SER  12  -9.047  -7.523  10.094
   92    HA   SER  12           HA       SER  12  -7.015  -8.425  10.527
   93    HG   SER  12           HG       SER  12  -5.905 -10.872   8.273
   94    HB2  SER  12           2HB      SER  12  -7.979 -10.535  10.035
   95    HB3  SER  12           1HB      SER  12  -7.917 -10.246   8.297
   96    H    ALA  13           H        ALA  13  -7.291  -6.249   8.594
   97    HA   ALA  13           HA       ALA  13  -5.631  -6.337   6.393
   98    HB1  ALA  13           3HB      ALA  13  -5.820  -4.047   8.301
   99    HB2  ALA  13           1HB      ALA  13  -7.028  -4.412   7.079
  100    HB3  ALA  13           2HB      ALA  13  -5.394  -3.962   6.599
  101    H    ALA  14           H        ALA  14  -4.616  -5.478   9.690
  102    HA   ALA  14           HA       ALA  14  -2.015  -4.792   9.292
  103    HB1  ALA  14           3HB      ALA  14  -1.564  -5.675  11.576
  104    HB2  ALA  14           1HB      ALA  14  -3.183  -6.375  11.557
  105    HB3  ALA  14           2HB      ALA  14  -2.976  -4.627  11.434
  106    H    ARG  15           H        ARG  15  -3.246  -7.998   8.844
  107    HA   ARG  15           HA       ARG  15  -0.676  -9.295   9.052
  108    HE   ARG  15           HE       ARG  15   0.662 -13.590   8.284
  109    HB2  ARG  15           2HB      ARG  15  -2.950 -10.334   9.523
  110    HB3  ARG  15           1HB      ARG  15  -3.194 -10.357   7.789
  111    HG2  ARG  15           2HG      ARG  15  -1.989 -12.311   9.399
  112    HG3  ARG  15           1HG      ARG  15  -2.170 -12.309   7.651
  113    HD2  ARG  15           2HD      ARG  15   0.008 -11.625   7.293
  114    HD3  ARG  15           1HD      ARG  15   0.123 -10.828   8.862
  115   HH11  ARG  15          1HH1      ARG  15  -0.198 -11.297  10.770
  116   HH12  ARG  15          2HH1      ARG  15   0.411 -12.279  12.060
  117   HH21  ARG  15          1HH2      ARG  15   1.462 -14.883   9.980
  118   HH22  ARG  15          2HH2      ARG  15   1.354 -14.314  11.613
  119    H    TYR  16           H        TYR  16  -2.712  -8.075   6.454
  120    HA   TYR  16           HA       TYR  16  -1.119  -9.271   4.398
  121    HD1  TYR  16           2HD      TYR  16  -2.794 -10.617   4.608
  122    HD2  TYR  16           1HD      TYR  16  -5.322  -7.409   3.408
  123    HE1  TYR  16           2HE      TYR  16  -4.744 -12.074   4.837
  124    HE2  TYR  16           1HE      TYR  16  -7.281  -8.867   3.645
  125    HH   TYR  16           HH       TYR  16  -7.123 -11.935   5.159
  126    HB2  TYR  16           2HB      TYR  16  -3.049  -6.959   4.136
  127    HB3  TYR  16           1HB      TYR  16  -2.415  -7.945   2.827
  128    H    VAL  17           H        VAL  17  -0.817  -6.386   6.288
  129    HA   VAL  17           HA       VAL  17   0.979  -5.134   4.381
  130    HB   VAL  17           HB       VAL  17   0.034  -4.348   7.123
  131   HG11  VAL  17          1HG1      VAL  17   1.538  -2.216   6.301
  132   HG12  VAL  17          2HG1      VAL  17   2.557  -3.581   5.853
  133   HG13  VAL  17          3HG1      VAL  17   2.026  -3.388   7.525
  134   HG21  VAL  17          3HG2      VAL  17  -1.369  -3.796   5.191
  135   HG22  VAL  17          1HG2      VAL  17  -0.019  -2.906   4.484
  136   HG23  VAL  17          2HG2      VAL  17  -0.737  -2.355   5.997
  137    H    ASN  18           H        ASN  18   1.235  -6.724   7.546
  138    HA   ASN  18           HA       ASN  18   4.014  -6.349   7.812
  139    HB2  ASN  18           2HB      ASN  18   2.180  -8.348   9.138
  140    HB3  ASN  18           1HB      ASN  18   3.838  -8.020   9.634
  141   HD21  ASN  18          1HD2      ASN  18   1.543  -7.732  11.255
  142   HD22  ASN  18          2HD2      ASN  18   1.401  -6.063  11.678
  143    H    ARG  19           H        ARG  19   2.127  -8.934   6.312
  144    HA   ARG  19           HA       ARG  19   4.435 -10.666   6.170
  145    HE   ARG  19           HE       ARG  19   4.834 -11.869   7.692
  146    HB2  ARG  19           2HB      ARG  19   1.609 -10.910   5.709
  147    HB3  ARG  19           1HB      ARG  19   2.500 -11.596   4.357
  148    HG2  ARG  19           2HG      ARG  19   2.074 -13.316   5.968
  149    HG3  ARG  19           1HG      ARG  19   3.798 -12.959   5.955
  150    HD2  ARG  19           2HD      ARG  19   1.967 -11.626   7.908
  151    HD3  ARG  19           1HD      ARG  19   2.599 -13.239   8.224
  152   HH11  ARG  19          1HH1      ARG  19   2.122 -11.142   9.769
  153   HH12  ARG  19          2HH1      ARG  19   3.067 -10.231  10.896
  154   HH21  ARG  19          1HH2      ARG  19   6.078 -10.668   9.186
  155   HH22  ARG  19          2HH2      ARG  19   5.309  -9.962  10.565
  156    H    LEU  20           H        LEU  20   3.248  -8.129   4.201
  157    HA   LEU  20           HA       LEU  20   4.207  -9.034   1.693
  158    HG   LEU  20           HG       LEU  20   1.697  -7.192   2.704
  159    HB2  LEU  20           2HB      LEU  20   3.831  -6.215   2.684
  160    HB3  LEU  20           1HB      LEU  20   4.117  -6.659   1.014
  161   HD11  LEU  20          1HD1      LEU  20   0.544  -5.919   1.055
  162   HD12  LEU  20          2HD1      LEU  20   1.937  -5.945  -0.027
  163   HD13  LEU  20          3HD1      LEU  20   2.003  -5.017   1.471
  164   HD21  LEU  20          3HD2      LEU  20   2.440  -8.482   0.078
  165   HD22  LEU  20          1HD2      LEU  20   0.784  -8.378   0.671
  166   HD23  LEU  20          2HD2      LEU  20   1.993  -9.270   1.592
  167    H    CYS  21           H        CYS  21   5.716  -6.902   4.123
  168    HA   CYS  21           HA       CYS  21   8.015  -6.200   2.807
  169    HG   CYS  21           HG       CYS  21   8.387  -7.363   6.944
  170    HB2  CYS  21           2HB      CYS  21   9.108  -6.060   5.015
  171    HB3  CYS  21           1HB      CYS  21   7.485  -5.379   5.051
  172    H    LYS  22           H        LYS  22   7.378  -9.210   4.523
  173    HA   LYS  22           HA       LYS  22   9.988 -10.287   3.989
  174    HB2  LYS  22           2HB      LYS  22   7.479 -11.628   5.010
  175    HB3  LYS  22           1HB      LYS  22   9.082 -12.350   4.988
  176    HG2  LYS  22           2HG      LYS  22   9.733 -11.261   6.838
  177    HG3  LYS  22           1HG      LYS  22   8.940  -9.757   6.363
  178    HD2  LYS  22           2HD      LYS  22   7.842 -10.523   8.317
  179    HD3  LYS  22           1HD      LYS  22   6.755 -10.846   6.966
  180    HE2  LYS  22           2HE      LYS  22   6.692 -12.794   8.269
  181    HE3  LYS  22           1HE      LYS  22   7.765 -13.182   6.925
  182    HZ1  LYS  22           3HZ      LYS  22   9.522 -12.270   8.688
  183    HZ2  LYS  22           1HZ      LYS  22   9.074 -13.899   8.594
  184    HZ3  LYS  22           2HZ      LYS  22   8.365 -12.892   9.753
  185    H    HIS  23           H        HIS  23   7.013 -10.102   2.331
  186    HA   HIS  23           HA       HIS  23   7.433 -12.426   0.679
  187    HD1  HIS  23           1HD      HIS  23   3.477 -12.967   0.798
  188    HD2  HIS  23           2HD      HIS  23   6.279 -12.414  -2.221
  189    HE1  HIS  23           1HE      HIS  23   2.879 -14.635  -0.986
  190    HE2  HIS  23           2HE      HIS  23   4.638 -14.339  -2.766
  191    HB2  HIS  23           2HB      HIS  23   5.182 -11.293   1.421
  192    HB3  HIS  23           1HB      HIS  23   5.453 -10.292  -0.001
  193    H    TRP  24           H        TRP  24   7.186  -8.907  -0.053
  194    HA   TRP  24           HA       TRP  24   8.441  -9.387  -2.626
  195    HD1  TRP  24           HD       TRP  24   5.166  -8.545  -0.980
  196    HE1  TRP  24           1HE      TRP  24   3.218  -8.887  -2.627
  197    HE3  TRP  24           3HE      TRP  24   7.433  -6.928  -5.269
  198    HZ2  TRP  24           2HZ      TRP  24   2.709  -8.520  -5.379
  199    HZ3  TRP  24           3HZ      TRP  24   6.146  -6.957  -7.365
  200    HH2  TRP  24           HH       TRP  24   3.833  -7.736  -7.418
  201    HB2  TRP  24           2HB      TRP  24   7.423  -6.861  -1.317
  202    HB3  TRP  24           1HB      TRP  24   8.107  -6.933  -2.939
  203    H    GLY  25           H        GLY  25   9.514  -8.677   0.538
  204    HA2  GLY  25           2HA      GLY  25  11.713  -6.990  -0.060
  205    HA3  GLY  25           1HA      GLY  25  11.526  -7.970   1.382
  206    H    HIS  26           H        HIS  26  12.283  -8.315  -2.077
  207    HA   HIS  26           HA       HIS  26  14.162 -10.461  -1.348
  208    HD1  HIS  26           1HD      HIS  26  12.861 -12.829  -4.920
  209    HD2  HIS  26           2HD      HIS  26  13.369 -12.332  -0.826
  210    HE1  HIS  26           1HE      HIS  26  12.835 -15.150  -3.953
  211    HE2  HIS  26           2HE      HIS  26  13.233 -14.829  -1.487
  212    HB2  HIS  26           2HB      HIS  26  12.182 -10.255  -3.425
  213    HB3  HIS  26           1HB      HIS  26  13.775 -10.449  -4.148
  214    H    LYS  27           H        LYS  27  13.761  -7.432  -3.058
  215    HA   LYS  27           HA       LYS  27  16.662  -7.101  -3.101
  216    HB2  LYS  27           2HB      LYS  27  16.309  -8.087  -5.253
  217    HB3  LYS  27           1HB      LYS  27  14.913  -7.071  -5.565
  218    HG2  LYS  27           2HG      LYS  27  17.362  -5.552  -5.098
  219    HG3  LYS  27           1HG      LYS  27  17.452  -6.639  -6.485
  220    HD2  LYS  27           2HD      LYS  27  16.045  -5.390  -7.693
  221    HD3  LYS  27           1HD      LYS  27  14.929  -5.196  -6.343
  222    HE2  LYS  27           2HE      LYS  27  15.800  -3.211  -5.736
  223    HE3  LYS  27           1HE      LYS  27  17.451  -3.697  -6.117
  224    HZ1  LYS  27           3HZ      LYS  27  15.400  -2.552  -7.887
  225    HZ2  LYS  27           1HZ      LYS  27  16.614  -3.530  -8.545
  226    HZ3  LYS  27           2HZ      LYS  27  17.025  -2.118  -7.712
  227    H    PHE  28           H        PHE  28  14.156  -5.935  -1.817
  228    HA   PHE  28           HA       PHE  28  14.865  -3.150  -2.314
  229    HD1  PHE  28           1HD      PHE  28  13.466  -1.125  -3.727
  230    HD2  PHE  28           2HD      PHE  28  12.334  -5.107  -4.715
  231    HE1  PHE  28           1HE      PHE  28  13.650  -0.580  -6.120
  232    HE2  PHE  28           2HE      PHE  28  12.517  -4.569  -7.110
  233    HZ   PHE  28           HZ       PHE  28  13.175  -2.303  -7.815
  234    HB2  PHE  28           2HB      PHE  28  12.107  -4.324  -2.500
  235    HB3  PHE  28           1HB      PHE  28  12.349  -2.628  -2.096
  236    H    GLU  29           H        GLU  29  14.256  -1.697  -0.609
  237    HA   GLU  29           HA       GLU  29  14.613  -2.908   1.972
  238    HB2  GLU  29           2HB      GLU  29  14.290  -0.479   2.751
  239    HB3  GLU  29           1HB      GLU  29  15.697  -0.842   1.760
  240    HG2  GLU  29           2HG      GLU  29  13.325  -0.042   0.250
  241    HG3  GLU  29           1HG      GLU  29  13.965   1.193   1.332
  242    H    VAL  30           H        VAL  30  13.029  -3.768   3.112
  243    HA   VAL  30           HA       VAL  30  10.346  -2.583   2.895
  244    HB   VAL  30           HB       VAL  30   9.721  -5.122   3.523
  245   HG11  VAL  30          1HG1      VAL  30   8.588  -4.136   1.748
  246   HG12  VAL  30          2HG1      VAL  30   9.446  -5.476   0.994
  247   HG13  VAL  30          3HG1      VAL  30  10.072  -3.835   0.841
  248   HG21  VAL  30          3HG2      VAL  30  11.095  -6.733   2.639
  249   HG22  VAL  30          1HG2      VAL  30  12.281  -5.577   3.241
  250   HG23  VAL  30          2HG2      VAL  30  11.880  -5.611   1.523
  251    H    GLU  31           H        GLU  31   9.768  -1.702   4.776
  252    HA   GLU  31           HA       GLU  31  10.878  -2.726   7.273
  253    HB2  GLU  31           2HB      GLU  31  10.365  -0.168   6.380
  254    HB3  GLU  31           1HB      GLU  31   9.004  -0.478   7.450
  255    HG2  GLU  31           2HG      GLU  31  10.435  -0.879   9.295
  256    HG3  GLU  31           1HG      GLU  31  11.863  -0.910   8.262
  257    H    LEU  32           H        LEU  32   9.453  -3.132   9.119
  258    HA   LEU  32           HA       LEU  32   6.682  -3.771   8.404
  259    HG   LEU  32           HG       LEU  32   5.932  -6.379   8.304
  260    HB2  LEU  32           2HB      LEU  32   8.228  -5.754   8.124
  261    HB3  LEU  32           1HB      LEU  32   8.439  -5.733   9.859
  262   HD11  LEU  32          1HD1      LEU  32   6.728  -8.433   8.601
  263   HD12  LEU  32          2HD1      LEU  32   6.370  -8.231  10.315
  264   HD13  LEU  32          3HD1      LEU  32   7.985  -7.871   9.703
  265   HD21  LEU  32          3HD2      LEU  32   6.230  -5.690  11.224
  266   HD22  LEU  32          1HD2      LEU  32   4.888  -6.647  10.598
  267   HD23  LEU  32          2HD2      LEU  32   5.121  -4.987  10.049
  268    H    THR  33           H        THR  33   5.536  -2.585   9.766
  269    HA   THR  33           HA       THR  33   6.176  -2.783  12.656
  270    HB   THR  33           HB       THR  33   4.991  -0.399  12.624
  271    HG1  THR  33           1HG      THR  33   4.664  -0.173  10.459
  272   HG21  THR  33          3HG2      THR  33   7.114  -0.502  13.583
  273   HG22  THR  33          1HG2      THR  33   7.269   0.677  12.281
  274   HG23  THR  33          2HG2      THR  33   7.876  -0.964  12.060
  275    HA   PRO  34           HA       PRO  34   1.950  -4.061  12.929
  276    HB2  PRO  34           2HB      PRO  34   1.293  -3.270  15.434
  277    HB3  PRO  34           1HB      PRO  34   2.359  -4.634  15.102
  278    HG2  PRO  34           2HG      PRO  34   3.049  -1.853  15.930
  279    HG3  PRO  34           1HG      PRO  34   3.785  -3.385  16.429
  280    HD2  PRO  34           2HD      PRO  34   4.865  -1.699  14.551
  281    HD3  PRO  34           1HD      PRO  34   5.173  -3.446  14.609
  282    H    GLU  35           H        GLU  35   2.095  -1.892  11.414
  283    HA   GLU  35           HA       GLU  35  -0.364  -0.532  11.905
  284    HB2  GLU  35           2HB      GLU  35   2.241   0.997  12.053
  285    HB3  GLU  35           1HB      GLU  35   0.665   1.756  11.857
  286    HG2  GLU  35           2HG      GLU  35   0.025   0.555  14.019
  287    HG3  GLU  35           1HG      GLU  35   1.755   0.274  14.220
  288    H    ARG  36           H        ARG  36   2.622  -0.809  10.019
  289    HA   ARG  36           HA       ARG  36   1.211  -0.846   7.575
  290    HE   ARG  36           HE       ARG  36   4.152   4.708   7.540
  291    HB2  ARG  36           2HB      ARG  36   2.369   1.230   6.648
  292    HB3  ARG  36           1HB      ARG  36   1.007   1.503   7.718
  293    HG2  ARG  36           2HG      ARG  36   2.687   1.759   9.588
  294    HG3  ARG  36           1HG      ARG  36   3.931   1.780   8.336
  295    HD2  ARG  36           2HD      ARG  36   2.173   3.611   7.369
  296    HD3  ARG  36           1HD      ARG  36   1.987   3.839   9.107
  297   HH11  ARG  36          1HH1      ARG  36   3.477   3.243  10.634
  298   HH12  ARG  36          2HH1      ARG  36   4.901   3.882  11.386
  299   HH21  ARG  36          1HH2      ARG  36   6.023   5.549   8.527
  300   HH22  ARG  36          2HH2      ARG  36   6.345   5.191  10.192
  301    H    GLY  37           H        GLY  37   2.691  -0.724   5.679
  302    HA2  GLY  37           2HA      GLY  37   5.296  -1.944   6.358
  303    HA3  GLY  37           1HA      GLY  37   4.349  -2.375   4.933
  304    H    PHE  38           H        PHE  38   7.118  -1.255   5.086
  305    HA   PHE  38           HA       PHE  38   6.625   1.152   3.445
  306    HD1  PHE  38           1HD      PHE  38   7.293   3.557   3.635
  307    HD2  PHE  38           2HD      PHE  38  10.858   1.580   4.869
  308    HE1  PHE  38           1HE      PHE  38   8.631   5.393   2.707
  309    HE2  PHE  38           2HE      PHE  38  12.201   3.404   3.920
  310    HZ   PHE  38           HZ       PHE  38  11.089   5.315   2.835
  311    HB2  PHE  38           2HB      PHE  38   7.478   1.792   5.641
  312    HB3  PHE  38           1HB      PHE  38   8.827   0.681   5.468
  313    H    ILE  39           H        ILE  39   7.216   0.791   1.437
  314    HA   ILE  39           HA       ILE  39   9.670  -0.787   0.945
  315    HB   ILE  39           HB       ILE  39   7.357  -0.952  -0.967
  316   HG12  ILE  39          2HG1      ILE  39   7.725  -2.523   1.578
  317   HG13  ILE  39          1HG1      ILE  39   6.254  -1.817   0.922
  318   HG21  ILE  39          1HG2      ILE  39   9.986  -1.840  -1.008
  319   HG22  ILE  39          2HG2      ILE  39   8.689  -2.335  -2.094
  320   HG23  ILE  39          3HG2      ILE  39   9.043  -3.288  -0.654
  321   HD11  ILE  39          3HD1      ILE  39   6.278  -4.268   0.834
  322   HD12  ILE  39          1HD1      ILE  39   7.676  -4.202  -0.238
  323   HD13  ILE  39          2HD1      ILE  39   6.130  -3.533  -0.761
  324    H    ASP  40           H        ASP  40  11.018   0.861   0.296
  325    HA   ASP  40           HA       ASP  40   9.959   2.738  -1.695
  326    HB2  ASP  40           2HB      ASP  40  12.119   4.032  -1.078
  327    HB3  ASP  40           1HB      ASP  40  10.762   4.052   0.038
  328    H    PHE  41           H        PHE  41  10.725   2.829  -3.658
  329    HA   PHE  41           HA       PHE  41  12.822   0.926  -4.435
  330    HD1  PHE  41           1HD      PHE  41  10.996  -0.227  -3.876
  331    HD2  PHE  41           2HD      PHE  41  10.267   0.425  -8.023
  332    HE1  PHE  41           1HE      PHE  41   9.889  -2.411  -4.021
  333    HE2  PHE  41           2HE      PHE  41   9.158  -1.766  -8.170
  334    HZ   PHE  41           HZ       PHE  41   8.967  -3.185  -6.168
  335    HB2  PHE  41           2HB      PHE  41  10.612   2.353  -5.887
  336    HB3  PHE  41           1HB      PHE  41  11.977   1.716  -6.787
  337    H    GLY  42           H        GLY  42  12.945   3.874  -3.300
  338    HA2  GLY  42           2HA      GLY  42  14.986   5.134  -3.457
  339    HA3  GLY  42           1HA      GLY  42  15.064   4.721  -5.165
  340    H    ASP  43           H        ASP  43  13.789   5.857  -6.649
  341    HA   ASP  43           HA       ASP  43  12.936   8.488  -5.728
  342    HB2  ASP  43           2HB      ASP  43  14.233   7.707  -7.994
  343    HB3  ASP  43           1HB      ASP  43  12.571   7.761  -8.574
  344    H    SER  44           H        SER  44  11.362   6.719  -4.611
  345    HA   SER  44           HA       SER  44   8.777   7.378  -5.070
  346    HG   SER  44           HG       SER  44   9.529   4.356  -7.686
  347    HB2  SER  44           2HB      SER  44   8.042   5.134  -6.272
  348    HB3  SER  44           1HB      SER  44   8.572   6.520  -7.229
  349    H    ASN  45           H        ASN  45   7.271   6.032  -3.779
  350    HA   ASN  45           HA       ASN  45   8.445   3.798  -2.340
  351    HB2  ASN  45           2HB      ASN  45   7.314   6.024  -0.666
  352    HB3  ASN  45           1HB      ASN  45   8.383   4.713  -0.180
  353   HD21  ASN  45          1HD2      ASN  45   8.321   7.536  -2.333
  354   HD22  ASN  45          2HD2      ASN  45   9.953   8.010  -2.035
  355    H    CYS  46           H        CYS  46   6.791   2.827  -0.781
  356    HA   CYS  46           HA       CYS  46   4.038   3.517  -1.390
  357    HG   CYS  46           HG       CYS  46   2.518   0.423  -2.420
  358    HB2  CYS  46           2HB      CYS  46   4.976   1.872  -3.147
  359    HB3  CYS  46           1HB      CYS  46   4.876   0.675  -1.861
  360    H    GLU  47           H        GLU  47   3.448   3.813   0.675
  361    HA   GLU  47           HA       GLU  47   4.116   1.763   2.660
  362    HB2  GLU  47           2HB      GLU  47   4.432   4.413   2.836
  363    HB3  GLU  47           1HB      GLU  47   2.772   4.323   3.398
  364    HG2  GLU  47           2HG      GLU  47   3.344   3.310   5.356
  365    HG3  GLU  47           1HG      GLU  47   4.763   2.520   4.673
  366    H    LEU  48           H        LEU  48   2.420   0.932   4.062
  367    HA   LEU  48           HA       LEU  48  -0.298   1.472   3.146
  368    HG   LEU  48           HG       LEU  48   1.581  -1.819   3.918
  369    HB2  LEU  48           2HB      LEU  48  -0.698  -1.093   3.343
  370    HB3  LEU  48           1HB      LEU  48  -0.110  -0.393   1.848
  371   HD11  LEU  48          1HD1      LEU  48   1.006  -3.698   2.905
  372   HD12  LEU  48          2HD1      LEU  48   1.631  -3.070   1.382
  373   HD13  LEU  48          3HD1      LEU  48  -0.058  -2.813   1.813
  374   HD21  LEU  48          3HD2      LEU  48   3.085  -1.729   1.678
  375   HD22  LEU  48          1HD2      LEU  48   3.199  -0.549   2.982
  376   HD23  LEU  48          2HD2      LEU  48   2.241  -0.186   1.549
  377    H    LEU  49           H        LEU  49  -1.600   1.827   4.755
  378    HA   LEU  49           HA       LEU  49  -0.785   1.021   7.460
  379    HG   LEU  49           HG       LEU  49  -2.170   1.806   9.246
  380    HB2  LEU  49           2HB      LEU  49  -1.743   3.354   6.793
  381    HB3  LEU  49           1HB      LEU  49  -3.292   2.531   6.837
  382   HD11  LEU  49          1HD1      LEU  49  -0.862   4.213   8.333
  383   HD12  LEU  49          2HD1      LEU  49  -0.549   3.228   9.761
  384   HD13  LEU  49          3HD1      LEU  49  -1.769   4.498   9.818
  385   HD21  LEU  49          3HD2      LEU  49  -4.470   2.429   8.959
  386   HD22  LEU  49          1HD2      LEU  49  -4.022   4.086   8.559
  387   HD23  LEU  49          2HD2      LEU  49  -3.762   3.473  10.191
  388    H    ALA  50           H        ALA  50  -1.680  -0.662   8.517
  389    HA   ALA  50           HA       ALA  50  -4.172  -1.751   7.426
  390    HB1  ALA  50           3HB      ALA  50  -3.005  -4.034   7.900
  391    HB2  ALA  50           1HB      ALA  50  -1.546  -3.091   7.655
  392    HB3  ALA  50           2HB      ALA  50  -2.765  -3.186   6.385
  393    H    HIS  51           H        HIS  51  -5.601  -1.614   8.970
  394    HA   HIS  51           HA       HIS  51  -4.864  -2.487  11.653
  395    HD1  HIS  51           1HD      HIS  51  -7.843   0.225  13.586
  396    HD2  HIS  51           2HD      HIS  51  -4.018  -1.394  13.388
  397    HE1  HIS  51           1HE      HIS  51  -6.907   0.420  15.911
  398    HE2  HIS  51           2HE      HIS  51  -4.628  -0.643  15.785
  399    HB2  HIS  51           2HB      HIS  51  -5.941  -0.054  10.971
  400    HB3  HIS  51           1HB      HIS  51  -7.376  -0.974  11.398
  401    HA   PRO  52           HA       PRO  52  -7.342  -6.098  11.618
  402    HB2  PRO  52           2HB      PRO  52  -8.961  -4.758  13.748
  403    HB3  PRO  52           1HB      PRO  52  -8.305  -6.398  13.692
  404    HG2  PRO  52           2HG      PRO  52  -7.101  -4.480  15.100
  405    HG3  PRO  52           1HG      PRO  52  -6.169  -5.709  14.232
  406    HD2  PRO  52           2HD      PRO  52  -6.545  -2.839  13.599
  407    HD3  PRO  52           1HD      PRO  52  -5.210  -3.924  13.173
  408    H    ASP  53           H        ASP  53  -8.976  -2.998  11.241
  409    HA   ASP  53           HA       ASP  53 -11.041  -4.438   9.740
  410    HB2  ASP  53           2HB      ASP  53 -12.807  -3.038  10.669
  411    HB3  ASP  53           1HB      ASP  53 -11.955  -3.870  11.967
  412    H    HIS  54           H        HIS  54  -8.733  -2.021   9.627
  413    HA   HIS  54           HA       HIS  54  -9.981  -1.087   7.180
  414    HD1  HIS  54           1HD      HIS  54  -7.225   1.863   8.729
  415    HD2  HIS  54           2HD      HIS  54 -10.120   0.594  11.424
  416    HE1  HIS  54           1HE      HIS  54  -6.355   2.502  10.999
  417    HE2  HIS  54           2HE      HIS  54  -8.198   1.868  12.594
  418    HB2  HIS  54           2HB      HIS  54  -9.556   1.297   7.669
  419    HB3  HIS  54           1HB      HIS  54 -10.754   0.577   8.727
  420    H    VAL  55           H        VAL  55  -8.508   0.042   5.700
  421    HA   VAL  55           HA       VAL  55  -5.681  -0.298   6.330
  422    HB   VAL  55           HB       VAL  55  -6.786  -2.272   4.996
  423   HG11  VAL  55          1HG1      VAL  55  -7.610  -0.518   3.255
  424   HG12  VAL  55          2HG1      VAL  55  -7.016  -2.087   2.717
  425   HG13  VAL  55          3HG1      VAL  55  -5.973  -0.669   2.621
  426   HG21  VAL  55          3HG2      VAL  55  -4.651  -2.721   3.906
  427   HG22  VAL  55          1HG2      VAL  55  -4.427  -2.118   5.548
  428   HG23  VAL  55          2HG2      VAL  55  -4.166  -1.046   4.172
  429    H    LEU  56           H        LEU  56  -4.407   1.246   5.502
  430    HA   LEU  56           HA       LEU  56  -5.645   3.206   3.680
  431    HG   LEU  56           HG       LEU  56  -6.353   4.844   5.625
  432    HB2  LEU  56           2HB      LEU  56  -4.337   3.583   6.226
  433    HB3  LEU  56           1HB      LEU  56  -3.428   4.407   4.982
  434   HD11  LEU  56          1HD1      LEU  56  -4.558   5.634   7.272
  435   HD12  LEU  56          2HD1      LEU  56  -5.752   6.805   6.715
  436   HD13  LEU  56          3HD1      LEU  56  -4.129   6.809   6.027
  437   HD21  LEU  56          3HD2      LEU  56  -4.592   5.829   3.443
  438   HD22  LEU  56          1HD2      LEU  56  -5.707   6.977   4.180
  439   HD23  LEU  56          2HD2      LEU  56  -6.326   5.502   3.440
  440    H    MET  57           H        MET  57  -4.443   3.943   1.945
  441    HA   MET  57           HA       MET  57  -1.862   2.601   1.523
  442    HB2  MET  57           2HB      MET  57  -3.799   3.108  -0.713
  443    HB3  MET  57           1HB      MET  57  -2.418   2.018  -0.680
  444    HG2  MET  57           2HG      MET  57  -3.566   0.599   0.955
  445    HG3  MET  57           1HG      MET  57  -4.956   1.687   0.901
  446    HE1  MET  57           3HE      MET  57  -6.759   1.723  -0.948
  447    HE2  MET  57           1HE      MET  57  -6.868   0.320   0.115
  448    HE3  MET  57           2HE      MET  57  -7.111   0.132  -1.621
  449    H    ILE  58           H        ILE  58  -0.286   4.101   1.454
  450    HA   ILE  58           HA       ILE  58  -0.858   6.615   0.041
  451    HB   ILE  58           HB       ILE  58   0.977   6.311   2.420
  452   HG12  ILE  58          2HG1      ILE  58  -1.888   6.587   2.336
  453   HG13  ILE  58          1HG1      ILE  58  -0.840   6.423   3.729
  454   HG21  ILE  58          1HG2      ILE  58   1.613   8.069   0.861
  455   HG22  ILE  58          2HG2      ILE  58   1.052   8.744   2.390
  456   HG23  ILE  58          3HG2      ILE  58  -0.005   8.765   0.977
  457   HD11  ILE  58          3HD1      ILE  58  -2.365   8.480   3.554
  458   HD12  ILE  58          1HD1      ILE  58  -1.176   9.078   2.395
  459   HD13  ILE  58          2HD1      ILE  58  -0.688   8.709   4.049
  460    H    LEU  59           H        LEU  59   0.646   7.299  -1.403
  461    HA   LEU  59           HA       LEU  59   3.108   5.692  -1.643
  462    HG   LEU  59           HG       LEU  59   1.298   6.871  -5.328
  463    HB2  LEU  59           2HB      LEU  59   2.976   5.707  -3.968
  464    HB3  LEU  59           1HB      LEU  59   1.335   5.379  -3.455
  465   HD11  LEU  59          1HD1      LEU  59   0.684   8.396  -2.821
  466   HD12  LEU  59          2HD1      LEU  59  -0.370   7.201  -3.576
  467   HD13  LEU  59          3HD1      LEU  59   0.020   8.699  -4.423
  468   HD21  LEU  59          3HD2      LEU  59   3.660   7.858  -4.482
  469   HD22  LEU  59          1HD2      LEU  59   2.567   9.150  -3.992
  470   HD23  LEU  59          2HD2      LEU  59   2.626   8.640  -5.673
  471    H    ASN  60           H        ASN  60   5.004   6.761  -2.171
  472    HA   ASN  60           HA       ASN  60   4.850   9.706  -2.213
  473    HB2  ASN  60           2HB      ASN  60   7.112   8.112  -0.983
  474    HB3  ASN  60           1HB      ASN  60   6.875   9.856  -0.918
  475   HD21  ASN  60          1HD2      ASN  60   6.959   9.831   1.330
  476   HD22  ASN  60          2HD2      ASN  60   5.645   9.249   2.288
  477    H    SER  61           H        SER  61   5.151  10.105  -4.340
  478    HA   SER  61           HA       SER  61   7.689   9.158  -5.483
  479    HG   SER  61           HG       SER  61   5.032   6.761  -6.458
  480    HB2  SER  61           2HB      SER  61   5.464   8.910  -7.384
  481    HB3  SER  61           1HB      SER  61   6.840   7.848  -7.112
  482    HA   PRO  62           HA       PRO  62   7.944  13.308  -7.020
  483    HB2  PRO  62           2HB      PRO  62   9.863  12.852  -8.888
  484    HB3  PRO  62           1HB      PRO  62  10.168  12.983  -7.154
  485    HG2  PRO  62           2HG      PRO  62   9.815  10.505  -8.811
  486    HG3  PRO  62           1HG      PRO  62  11.069  10.873  -7.606
  487    HD2  PRO  62           2HD      PRO  62   8.982   9.363  -6.972
  488    HD3  PRO  62           1HD      PRO  62   9.610  10.557  -5.822
  489    H    ASP  63           H        ASP  63   6.861  10.655  -8.954
  490    HA   ASP  63           HA       ASP  63   5.746  12.605 -10.817
  491    HB2  ASP  63           2HB      ASP  63   7.592  10.368 -11.564
  492    HB3  ASP  63           1HB      ASP  63   6.340  10.879 -12.694
  493    H    GLU  64           H        GLU  64   3.840  11.855 -11.943
  494    HA   GLU  64           HA       GLU  64   2.188  10.228 -10.309
  495    HB2  GLU  64           2HB      GLU  64   1.818  11.401 -13.037
  496    HB3  GLU  64           1HB      GLU  64   0.764  10.085 -12.551
  497    HG2  GLU  64           2HG      GLU  64  -0.464  11.817 -11.782
  498    HG3  GLU  64           1HG      GLU  64   0.534  11.523 -10.353
  499    H    ASP  65           H        ASP  65   3.932   9.339 -13.319
  500    HA   ASP  65           HA       ASP  65   2.924   6.813 -13.736
  501    HB2  ASP  65           2HB      ASP  65   4.766   7.982 -15.031
  502    HB3  ASP  65           1HB      ASP  65   5.877   7.442 -13.775
  503    H    SER  66           H        SER  66   5.631   7.688 -11.638
  504    HA   SER  66           HA       SER  66   5.932   5.196 -10.356
  505    HG   SER  66           HG       SER  66   8.600   6.178 -10.029
  506    HB2  SER  66           2HB      SER  66   6.619   8.004  -9.465
  507    HB3  SER  66           1HB      SER  66   7.104   6.552  -8.586
  508    H    LEU  67           H        LEU  67   4.463   8.200  -9.290
  509    HA   LEU  67           HA       LEU  67   3.324   7.635  -6.926
  510    HG   LEU  67           HG       LEU  67   1.052   9.334  -6.562
  511    HB2  LEU  67           2HB      LEU  67   3.134   9.805  -7.805
  512    HB3  LEU  67           1HB      LEU  67   2.362   9.247  -9.258
  513   HD11  LEU  67          1HD1      LEU  67   0.985  11.516  -6.928
  514   HD12  LEU  67          2HD1      LEU  67  -0.241  11.125  -8.133
  515   HD13  LEU  67          3HD1      LEU  67   1.439  11.337  -8.622
  516   HD21  LEU  67          3HD2      LEU  67  -1.010   9.243  -8.158
  517   HD22  LEU  67          1HD2      LEU  67  -0.202   7.755  -7.668
  518   HD23  LEU  67          2HD2      LEU  67   0.130   8.462  -9.251
  519    H    ALA  68           H        ALA  68   1.551   7.133  -9.997
  520    HA   ALA  68           HA       ALA  68  -0.555   5.710  -8.744
  521    HB1  ALA  68           3HB      ALA  68   0.325   6.087 -11.585
  522    HB2  ALA  68           1HB      ALA  68  -1.159   6.614 -10.790
  523    HB3  ALA  68           2HB      ALA  68  -0.933   4.913 -11.199
  524    H    HIS  69           H        HIS  69   2.505   4.737 -10.180
  525    HA   HIS  69           HA       HIS  69   2.104   2.008 -10.465
  526    HD1  HIS  69           1HD      HIS  69   3.241   0.121  -9.761
  527    HD2  HIS  69           2HD      HIS  69   6.642   1.794 -11.465
  528    HE1  HIS  69           1HE      HIS  69   4.682  -1.825 -10.436
  529    HE2  HIS  69           2HE      HIS  69   6.693  -0.791 -11.545
  530    HB2  HIS  69           2HB      HIS  69   4.158   3.344 -11.131
  531    HB3  HIS  69           1HB      HIS  69   4.672   3.231  -9.452
  532    H    MET  70           H        MET  70   2.850   3.905  -7.607
  533    HA   MET  70           HA       MET  70   3.113   1.568  -5.923
  534    HB2  MET  70           2HB      MET  70   2.674   4.039  -4.462
  535    HB3  MET  70           1HB      MET  70   4.045   2.952  -4.414
  536    HG2  MET  70           2HG      MET  70   3.627   5.085  -6.489
  537    HG3  MET  70           1HG      MET  70   4.639   5.242  -5.058
  538    HE1  MET  70           3HE      MET  70   6.039   3.135  -4.430
  539    HE2  MET  70           1HE      MET  70   7.406   2.766  -5.482
  540    HE3  MET  70           2HE      MET  70   5.964   1.752  -5.520
  541    H    GLN  71           H        GLN  71   0.752   4.304  -5.950
  542    HA   GLN  71           HA       GLN  71  -0.984   3.236  -4.094
  543    HB2  GLN  71           2HB      GLN  71  -2.799   4.538  -5.451
  544    HB3  GLN  71           1HB      GLN  71  -1.565   5.403  -4.557
  545    HG2  GLN  71           2HG      GLN  71  -0.862   6.391  -6.406
  546    HG3  GLN  71           1HG      GLN  71  -0.717   4.854  -7.252
  547   HE21  GLN  71          1HE2      GLN  71  -2.357   7.757  -7.075
  548   HE22  GLN  71          2HE2      GLN  71  -3.689   7.372  -8.105
  549    H    ASN  72           H        ASN  72  -0.564   2.306  -7.413
  550    HA   ASN  72           HA       ASN  72  -3.054   0.844  -7.523
  551    HB2  ASN  72           2HB      ASN  72  -1.652   1.924  -9.486
  552    HB3  ASN  72           1HB      ASN  72  -0.842   0.360  -9.472
  553   HD21  ASN  72          1HD2      ASN  72  -3.837   2.035 -10.027
  554   HD22  ASN  72          2HD2      ASN  72  -4.634   0.749 -10.861
  555    H    VAL  73           H        VAL  73   0.403   0.035  -7.313
  556    HA   VAL  73           HA       VAL  73   0.340  -2.693  -7.385
  557    HB   VAL  73           HB       VAL  73   2.044  -0.802  -5.789
  558   HG11  VAL  73          1HG1      VAL  73   3.527  -2.725  -5.249
  559   HG12  VAL  73          2HG1      VAL  73   2.242  -3.810  -5.782
  560   HG13  VAL  73          3HG1      VAL  73   1.985  -2.752  -4.395
  561   HG21  VAL  73          3HG2      VAL  73   2.084  -1.453  -8.400
  562   HG22  VAL  73          1HG2      VAL  73   3.174  -2.682  -7.755
  563   HG23  VAL  73          2HG2      VAL  73   3.516  -0.972  -7.489
  564    H    VAL  74           H        VAL  74  -0.422  -0.620  -4.614
  565    HA   VAL  74           HA       VAL  74  -0.823  -2.790  -2.802
  566    HB   VAL  74           HB       VAL  74  -1.824   0.053  -2.624
  567   HG11  VAL  74          1HG1      VAL  74  -1.546  -1.901  -0.354
  568   HG12  VAL  74          2HG1      VAL  74  -3.060  -1.652  -1.224
  569   HG13  VAL  74          3HG1      VAL  74  -2.320  -0.319  -0.341
  570   HG21  VAL  74          3HG2      VAL  74   0.274   0.604  -2.141
  571   HG22  VAL  74          1HG2      VAL  74   0.785  -1.080  -2.275
  572   HG23  VAL  74          2HG2      VAL  74   0.200  -0.455  -0.734
  573    H    ALA  75           H        ALA  75  -3.071  -0.730  -4.688
  574    HA   ALA  75           HA       ALA  75  -5.487  -1.704  -3.820
  575    HB1  ALA  75           3HB      ALA  75  -6.341  -1.212  -6.112
  576    HB2  ALA  75           1HB      ALA  75  -4.677  -0.927  -6.621
  577    HB3  ALA  75           2HB      ALA  75  -5.416   0.106  -5.396
  578    H    ASP  76           H        ASP  76  -3.075  -3.223  -5.777
  579    HA   ASP  76           HA       ASP  76  -4.736  -5.370  -6.715
  580    HB2  ASP  76           2HB      ASP  76  -2.339  -4.388  -7.520
  581    HB3  ASP  76           1HB      ASP  76  -1.809  -5.785  -6.590
  582    H    HIS  77           H        HIS  77  -2.371  -4.958  -4.102
  583    HA   HIS  77           HA       HIS  77  -2.310  -7.609  -3.216
  584    HD1  HIS  77           1HD      HIS  77  -0.686  -6.484  -4.538
  585    HD2  HIS  77           2HD      HIS  77   0.923  -4.678  -1.159
  586    HE1  HIS  77           1HE      HIS  77   1.603  -5.701  -5.219
  587    HE2  HIS  77           2HE      HIS  77   2.520  -4.528  -3.186
  588    HB2  HIS  77           2HB      HIS  77  -2.010  -5.152  -1.476
  589    HB3  HIS  77           1HB      HIS  77  -1.393  -6.760  -1.146
  590    H    LEU  78           H        LEU  78  -4.508  -4.959  -2.328
  591    HA   LEU  78           HA       LEU  78  -5.899  -6.387  -0.324
  592    HG   LEU  78           HG       LEU  78  -5.054  -3.202  -0.598
  593    HB2  LEU  78           2HB      LEU  78  -6.723  -4.044  -2.044
  594    HB3  LEU  78           1HB      LEU  78  -7.686  -4.660  -0.719
  595   HD11  LEU  78          1HD1      LEU  78  -6.247  -1.694   0.815
  596   HD12  LEU  78          2HD1      LEU  78  -7.651  -2.760   0.859
  597   HD13  LEU  78          3HD1      LEU  78  -7.202  -1.953  -0.644
  598   HD21  LEU  78          3HD2      LEU  78  -4.772  -5.091   0.884
  599   HD22  LEU  78          1HD2      LEU  78  -6.361  -4.813   1.595
  600   HD23  LEU  78          2HD2      LEU  78  -5.068  -3.641   1.842
  601    H    GLN  79           H        GLN  79  -6.043  -6.356  -3.785
  602    HA   GLN  79           HA       GLN  79  -8.667  -7.458  -4.017
  603    HB2  GLN  79           2HB      GLN  79  -7.715  -6.183  -5.843
  604    HB3  GLN  79           1HB      GLN  79  -6.390  -7.326  -5.997
  605    HG2  GLN  79           2HG      GLN  79  -7.678  -8.898  -7.034
  606    HG3  GLN  79           1HG      GLN  79  -9.168  -8.339  -6.275
  607   HE21  GLN  79          1HE2      GLN  79  -8.884  -8.921  -9.010
  608   HE22  GLN  79          2HE2      GLN  79  -9.115  -7.457  -9.900
  609    H    ARG  80           H        ARG  80  -5.406  -8.884  -4.050
  610    HA   ARG  80           HA       ARG  80  -6.236 -11.499  -4.719
  611    HE   ARG  80           HE       ARG  80  -3.546 -13.708  -5.562
  612    HB2  ARG  80           2HB      ARG  80  -3.800 -10.605  -3.163
  613    HB3  ARG  80           1HB      ARG  80  -4.031 -12.199  -3.868
  614    HG2  ARG  80           2HG      ARG  80  -4.447 -10.320  -5.921
  615    HG3  ARG  80           1HG      ARG  80  -2.981  -9.839  -5.066
  616    HD2  ARG  80           2HD      ARG  80  -2.561 -11.395  -6.952
  617    HD3  ARG  80           1HD      ARG  80  -2.012 -12.013  -5.395
  618   HH11  ARG  80          1HH1      ARG  80  -4.306 -11.251  -7.921
  619   HH12  ARG  80          2HH1      ARG  80  -5.511 -12.209  -8.714
  620   HH21  ARG  80          1HH2      ARG  80  -5.130 -14.969  -6.603
  621   HH22  ARG  80          2HH2      ARG  80  -5.980 -14.319  -7.965
  622    H    MET  81           H        MET  81  -5.948  -9.753  -1.722
  623    HA   MET  81           HA       MET  81  -6.443 -12.080  -0.089
  624    HB2  MET  81           2HB      MET  81  -6.457 -10.508   1.793
  625    HB3  MET  81           1HB      MET  81  -5.039 -10.327   0.780
  626    HG2  MET  81           2HG      MET  81  -5.687  -8.155   1.332
  627    HG3  MET  81           1HG      MET  81  -6.229  -8.389  -0.326
  628    HE1  MET  81           3HE      MET  81  -8.257  -5.968   1.892
  629    HE2  MET  81           1HE      MET  81  -6.654  -6.616   2.233
  630    HE3  MET  81           2HE      MET  81  -8.017  -7.053   3.262
  631    H    ALA  82           H        ALA  82  -8.402  -9.960  -1.850
  632    HA   ALA  82           HA       ALA  82 -10.772 -10.932  -0.390
  633    HB1  ALA  82           3HB      ALA  82 -10.789  -8.764   0.385
  634    HB2  ALA  82           1HB      ALA  82 -11.771  -8.613  -1.072
  635    HB3  ALA  82           2HB      ALA  82 -10.080  -8.112  -1.092
  636    H    ASN  83           H        ASN  83 -11.058 -12.504  -2.003
  637    HA   ASN  83           HA       ASN  83 -11.304 -11.735  -4.770
  638    HB2  ASN  83           2HB      ASN  83 -10.501 -14.009  -3.795
  639    HB3  ASN  83           1HB      ASN  83 -12.218 -14.373  -3.664
  640   HD21  ASN  83          1HD2      ASN  83 -12.316 -15.940  -5.188
  641   HD22  ASN  83          2HD2      ASN  83 -12.031 -15.668  -6.869
  642    H    SER  84           H        SER  84 -13.046 -10.796  -5.575
  643    HA   SER  84           HA       SER  84 -15.616 -11.779  -5.527
  644    HG   SER  84           HG       SER  84 -16.702 -11.341  -2.331
  645    HB2  SER  84           2HB      SER  84 -14.987 -10.075  -3.177
  646    HB3  SER  84           1HB      SER  84 -16.520  -9.759  -3.991
  647    H    GLU  85           H        GLU  85 -13.613  -8.902  -5.535
  648    HA   GLU  85           HA       GLU  85 -14.662  -8.061  -8.061
  649    HB2  GLU  85           2HB      GLU  85 -15.595  -5.944  -7.393
  650    HB3  GLU  85           1HB      GLU  85 -16.402  -7.214  -6.485
  651    HG2  GLU  85           2HG      GLU  85 -14.118  -6.265  -5.027
  652    HG3  GLU  85           1HG      GLU  85 -15.154  -4.914  -5.488
  653    H    SER  86           H        SER  86 -13.599  -5.949  -8.756
  654    HA   SER  86           HA       SER  86 -10.806  -6.120  -8.171
  655    HG   SER  86           HG       SER  86 -11.708  -5.481 -11.436
  656    HB2  SER  86           2HB      SER  86 -11.977  -3.749  -9.577
  657    HB3  SER  86           1HB      SER  86 -10.493  -4.637  -9.926
  658    H    LEU  87           H        LEU  87 -11.229  -5.839  -5.832
  659    HA   LEU  87           HA       LEU  87 -11.642  -4.537  -3.929
  660    HG   LEU  87           HG       LEU  87  -8.239  -4.686  -3.007
  661    HB2  LEU  87           2HB      LEU  87  -9.036  -4.303  -5.078
  662    HB3  LEU  87           1HB      LEU  87  -9.461  -2.763  -4.352
  663   HD11  LEU  87          1HD1      LEU  87 -10.244  -2.663  -2.094
  664   HD12  LEU  87          2HD1      LEU  87  -8.483  -2.605  -2.012
  665   HD13  LEU  87          3HD1      LEU  87  -9.380  -3.672  -0.933
  666   HD21  LEU  87          3HD2      LEU  87 -11.116  -5.208  -2.297
  667   HD22  LEU  87          1HD2      LEU  87  -9.682  -5.987  -1.635
  668   HD23  LEU  87          2HD2      LEU  87 -10.144  -6.278  -3.309
  669    H    GLU  88           H        GLU  88 -13.273  -3.153  -3.664
  670    HA   GLU  88           HA       GLU  88 -13.565  -0.805  -5.279
  671    HB2  GLU  88           2HB      GLU  88 -15.491  -1.958  -4.186
  672    HB3  GLU  88           1HB      GLU  88 -14.857  -1.470  -2.620
  673    HG2  GLU  88           2HG      GLU  88 -15.028   0.920  -3.489
  674    HG3  GLU  88           1HG      GLU  88 -16.016   0.246  -4.786
  675    H    ILE  89           H        ILE  89 -11.793   0.505  -5.118
  676    HA   ILE  89           HA       ILE  89 -11.269   1.619  -2.460
  677    HB   ILE  89           HB       ILE  89  -8.936   1.511  -2.650
  678   HG12  ILE  89          2HG1      ILE  89  -8.989   2.207  -5.165
  679   HG13  ILE  89          1HG1      ILE  89  -7.653   1.235  -4.577
  680   HG21  ILE  89          1HG2      ILE  89  -9.726  -0.633  -2.088
  681   HG22  ILE  89          2HG2      ILE  89  -8.440  -0.868  -3.270
  682   HG23  ILE  89          3HG2      ILE  89 -10.127  -1.003  -3.763
  683   HD11  ILE  89          3HD1      ILE  89 -10.059   0.170  -6.031
  684   HD12  ILE  89          1HD1      ILE  89  -8.666  -0.764  -5.484
  685   HD13  ILE  89          2HD1      ILE  89  -8.470   0.462  -6.738
  686    H    ALA  90           H        ALA  90 -11.294   3.849  -2.411
  687    HA   ALA  90           HA       ALA  90 -11.492   5.181  -5.009
  688    HB1  ALA  90           3HB      ALA  90 -13.167   5.646  -3.157
  689    HB2  ALA  90           1HB      ALA  90 -12.413   7.058  -3.897
  690    HB3  ALA  90           2HB      ALA  90 -11.865   6.495  -2.320
  691    H    TRP  91           H        TRP  91  -9.644   5.755  -5.872
  692    HA   TRP  91           HA       TRP  91  -7.399   6.511  -4.164
  693    HD1  TRP  91           HD       TRP  91  -8.693   3.844  -7.347
  694    HE1  TRP  91           1HE      TRP  91  -9.529   4.372  -9.722
  695    HE3  TRP  91           3HE      TRP  91  -6.517   8.428  -7.974
  696    HZ2  TRP  91           2HZ      TRP  91  -9.297   6.455 -11.613
  697    HZ3  TRP  91           3HZ      TRP  91  -6.873   9.622 -10.095
  698    HH2  TRP  91           HH       TRP  91  -8.234   8.655 -11.876
  699    HB2  TRP  91           2HB      TRP  91  -6.112   6.443  -6.338
  700    HB3  TRP  91           1HB      TRP  91  -6.807   4.908  -5.826
  701    H    GLN  92           H        GLN  92  -6.657   8.523  -3.977
  702    HA   GLN  92           HA       GLN  92  -8.121  10.652  -5.313
  703    HB2  GLN  92           2HB      GLN  92  -6.032  10.711  -3.128
  704    HB3  GLN  92           1HB      GLN  92  -6.828  12.139  -3.776
  705    HG2  GLN  92           2HG      GLN  92  -8.921  11.487  -2.912
  706    HG3  GLN  92           1HG      GLN  92  -8.351   9.856  -2.560
  707   HE21  GLN  92          1HE2      GLN  92  -8.618   9.750  -0.415
  708   HE22  GLN  92          2HE2      GLN  92  -7.874  10.812   0.726
  709    HA   PRO  93           HA       PRO  93  -5.318  11.786  -8.501
  710    HB2  PRO  93           2HB      PRO  93  -5.114  14.429  -7.141
  711    HB3  PRO  93           1HB      PRO  93  -5.444  14.065  -8.839
  712    HG2  PRO  93           2HG      PRO  93  -7.413  14.801  -7.201
  713    HG3  PRO  93           1HG      PRO  93  -7.670  13.556  -8.437
  714    HD2  PRO  93           2HD      PRO  93  -7.376  13.269  -5.493
  715    HD3  PRO  93           1HD      PRO  93  -8.302  12.281  -6.640
  716    H    ALA  94           H        ALA  94  -4.436  12.871  -5.243
  717    HA   ALA  94           HA       ALA  94  -2.469  12.284  -4.116
  718    HB1  ALA  94           3HB      ALA  94  -0.601  11.348  -5.106
  719    HB2  ALA  94           1HB      ALA  94  -0.869  12.194  -6.628
  720    HB3  ALA  94           2HB      ALA  94  -1.878  10.815  -6.204
  721    H    GLU  95           H        GLU  95  -3.564  14.800  -4.727
  722    HA   GLU  95           HA       GLU  95  -1.149  16.426  -4.519
  723    HB2  GLU  95           2HB      GLU  95  -2.487  16.305  -6.914
  724    HB3  GLU  95           1HB      GLU  95  -3.221  17.709  -6.153
  725    HG2  GLU  95           2HG      GLU  95  -0.490  18.016  -5.726
  726    HG3  GLU  95           1HG      GLU  95  -0.630  17.420  -7.380
  727    H    SER  96           H        SER  96  -1.434  18.382  -3.400
  728    HA   SER  96           HA       SER  96  -3.765  18.387  -1.653
  729    HG   SER  96           HG       SER  96  -2.179  19.297   0.863
  730    HB2  SER  96           2HB      SER  96  -1.277  18.661  -0.917
  731    HB3  SER  96           1HB      SER  96  -1.488  20.333  -1.436
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1   7.010  13.316  -5.156
    2    HB2  MET   1           2HB      MET   1   7.613  13.621  -2.830
    3    HB3  MET   1           1HB      MET   1   8.930  14.148  -3.873
    4    HG2  MET   1           2HG      MET   1   7.093  16.296  -3.168
    5    HG3  MET   1           1HG      MET   1   7.866  15.552  -1.773
    6    HE1  MET   1           3HE      MET   1   9.897  16.821  -0.837
    7    HE2  MET   1           1HE      MET   1  11.380  16.733  -1.787
    8    HE3  MET   1           2HE      MET   1  10.429  15.277  -1.501
    9    H    PHE   2           H        PHE   2   4.914  13.332  -5.709
   10    HA   PHE   2           HA       PHE   2   3.067  15.115  -4.290
   11    HD1  PHE   2           2HD      PHE   2   3.551  16.505  -6.706
   12    HD2  PHE   2           1HD      PHE   2   3.064  12.537  -8.171
   13    HE1  PHE   2           2HE      PHE   2   4.869  17.083  -8.701
   14    HE2  PHE   2           1HE      PHE   2   4.371  13.112 -10.167
   15    HZ   PHE   2           HZ       PHE   2   5.280  15.384 -10.437
   16    HB2  PHE   2           2HB      PHE   2   1.997  13.148  -6.234
   17    HB3  PHE   2           1HB      PHE   2   1.595  14.847  -6.023
   18    H    ARG   3           H        ARG   3   0.919  13.921  -3.560
   19    HA   ARG   3           HA       ARG   3   1.486  11.206  -2.706
   20    HE   ARG   3           HE       ARG   3   4.565  10.795   1.518
   21    HB2  ARG   3           2HB      ARG   3   2.026  13.319  -0.940
   22    HB3  ARG   3           1HB      ARG   3   0.519  12.606  -0.376
   23    HG2  ARG   3           2HG      ARG   3   1.791  11.117   0.662
   24    HG3  ARG   3           1HG      ARG   3   2.070  10.413  -0.915
   25    HD2  ARG   3           2HD      ARG   3   4.230  10.889  -0.752
   26    HD3  ARG   3           1HD      ARG   3   3.850  12.602  -0.608
   27   HH11  ARG   3          1HH1      ARG   3   3.016  13.817   0.708
   28   HH12  ARG   3          2HH1      ARG   3   3.231  14.492   2.288
   29   HH21  ARG   3          1HH2      ARG   3   4.846  11.682   3.595
   30   HH22  ARG   3          2HH2      ARG   3   4.270  13.281   3.926
   31    H    SER   4           H        SER   4  -0.232   9.986  -2.864
   32    HA   SER   4           HA       SER   4  -2.923  11.170  -2.748
   33    HG   SER   4           HG       SER   4  -4.459   9.028  -4.315
   34    HB2  SER   4           2HB      SER   4  -2.915  10.365  -4.916
   35    HB3  SER   4           1HB      SER   4  -1.690   9.143  -4.567
   36    H    THR   5           H        THR   5  -4.612   9.582  -1.952
   37    HA   THR   5           HA       THR   5  -3.501   7.462  -0.308
   38    HB   THR   5           HB       THR   5  -4.493   8.190   1.754
   39    HG1  THR   5           1HG      THR   5  -6.339   9.192   1.014
   40   HG21  THR   5          3HG2      THR   5  -2.297   9.351   0.949
   41   HG22  THR   5          1HG2      THR   5  -3.150   9.932   2.377
   42   HG23  THR   5          2HG2      THR   5  -3.332  10.776   0.841
   43    H    SER   6           H        SER   6  -4.681   5.693  -0.346
   44    HA   SER   6           HA       SER   6  -7.497   5.924  -1.205
   45    HG   SER   6           HG       SER   6  -7.504   3.304  -3.202
   46    HB2  SER   6           2HB      SER   6  -5.921   4.640  -2.711
   47    HB3  SER   6           1HB      SER   6  -5.748   3.464  -1.408
   48    H    HIS   7           H        HIS   7  -9.089   5.141   0.077
   49    HA   HIS   7           HA       HIS   7  -8.272   3.724   2.539
   50    HD1  HIS   7           1HD      HIS   7  -9.648   6.140   5.406
   51    HD2  HIS   7           2HD      HIS   7 -11.543   2.921   3.586
   52    HE1  HIS   7           1HE      HIS   7 -10.836   4.924   7.259
   53    HE2  HIS   7           2HE      HIS   7 -11.902   2.931   6.146
   54    HB2  HIS   7           2HB      HIS   7  -9.096   5.990   3.004
   55    HB3  HIS   7           1HB      HIS   7 -10.602   5.621   2.171
   56    H    VAL   8           H        VAL   8  -9.196   1.791   2.977
   57    HA   VAL   8           HA       VAL   8 -11.675   1.045   1.597
   58    HB   VAL   8           HB       VAL   8  -9.505  -1.005   1.735
   59   HG11  VAL   8          1HG1      VAL   8 -11.861  -1.542   1.097
   60   HG12  VAL   8          2HG1      VAL   8 -10.654  -1.987  -0.108
   61   HG13  VAL   8          3HG1      VAL   8 -11.639  -0.543  -0.340
   62   HG21  VAL   8          3HG2      VAL   8  -9.738   0.972  -0.532
   63   HG22  VAL   8          1HG2      VAL   8  -8.621  -0.388  -0.420
   64   HG23  VAL   8          2HG2      VAL   8  -8.461   0.977   0.684
   65    H    ARG   9           H        ARG   9 -12.831  -0.726   2.613
   66    HA   ARG   9           HA       ARG   9 -12.089  -1.000   5.442
   67    HE   ARG   9           HE       ARG   9 -14.522   2.926   6.452
   68    HB2  ARG   9           2HB      ARG   9 -14.684  -1.066   4.001
   69    HB3  ARG   9           1HB      ARG   9 -14.519  -2.154   5.370
   70    HG2  ARG   9           2HG      ARG   9 -15.489  -0.139   6.160
   71    HG3  ARG   9           1HG      ARG   9 -13.827  -0.200   6.752
   72    HD2  ARG   9           2HD      ARG   9 -13.125   1.488   5.353
   73    HD3  ARG   9           1HD      ARG   9 -14.403   1.187   4.176
   74   HH11  ARG   9          1HH1      ARG   9 -16.419   0.959   4.281
   75   HH12  ARG   9          2HH1      ARG   9 -17.875   1.861   4.536
   76   HH21  ARG   9          1HH2      ARG   9 -16.436   4.113   6.789
   77   HH22  ARG   9          2HH2      ARG   9 -17.884   3.652   5.960
   78    H    THR  10           H        THR  10 -10.759  -2.685   5.725
   79    HA   THR  10           HA       THR  10 -11.584  -5.288   4.628
   80    HB   THR  10           HB       THR  10  -9.347  -3.871   3.802
   81    HG1  THR  10           1HG      THR  10 -10.447  -5.602   2.736
   82   HG21  THR  10          3HG2      THR  10  -7.430  -4.768   4.609
   83   HG22  THR  10          1HG2      THR  10  -8.219  -6.251   5.149
   84   HG23  THR  10          2HG2      THR  10  -8.405  -4.765   6.086
   85    H    GLU  11           H        GLU  11 -10.826  -7.169   5.853
   86    HA   GLU  11           HA       GLU  11 -10.483  -6.509   8.702
   87    HB2  GLU  11           2HB      GLU  11 -12.187  -8.330   7.335
   88    HB3  GLU  11           1HB      GLU  11 -11.083  -9.271   8.329
   89    HG2  GLU  11           2HG      GLU  11 -12.149  -8.711  10.187
   90    HG3  GLU  11           1HG      GLU  11 -12.103  -6.997   9.772
   91    H    SER  12           H        SER  12  -8.884  -7.516   9.967
   92    HA   SER  12           HA       SER  12  -6.844  -8.386  10.431
   93    HG   SER  12           HG       SER  12  -5.467 -10.500   9.947
   94    HB2  SER  12           2HB      SER  12  -7.760 -10.517   9.960
   95    HB3  SER  12           1HB      SER  12  -7.707 -10.244   8.219
   96    H    ALA  13           H        ALA  13  -7.142  -6.240   8.457
   97    HA   ALA  13           HA       ALA  13  -5.448  -6.325   6.284
   98    HB1  ALA  13           3HB      ALA  13  -5.311  -3.969   6.396
   99    HB2  ALA  13           1HB      ALA  13  -5.647  -3.990   8.118
  100    HB3  ALA  13           2HB      ALA  13  -6.911  -4.423   6.979
  101    H    ALA  14           H        ALA  14  -4.503  -5.311   9.552
  102    HA   ALA  14           HA       ALA  14  -1.927  -4.576   9.195
  103    HB1  ALA  14           3HB      ALA  14  -2.940  -6.259  11.474
  104    HB2  ALA  14           1HB      ALA  14  -3.054  -4.505  11.326
  105    HB3  ALA  14           2HB      ALA  14  -1.475  -5.276  11.484
  106    H    ARG  15           H        ARG  15  -3.012  -7.894   8.891
  107    HA   ARG  15           HA       ARG  15  -0.339  -8.971   9.071
  108    HE   ARG  15           HE       ARG  15   1.197 -13.264   8.443
  109    HB2  ARG  15           2HB      ARG  15  -2.590 -10.138   9.626
  110    HB3  ARG  15           1HB      ARG  15  -2.681 -10.430   7.900
  111    HG2  ARG  15           2HG      ARG  15  -1.075 -11.745   9.946
  112    HG3  ARG  15           1HG      ARG  15  -1.645 -12.336   8.392
  113    HD2  ARG  15           2HD      ARG  15   0.231 -11.508   7.254
  114    HD3  ARG  15           1HD      ARG  15   0.652 -10.407   8.562
  115   HH11  ARG  15          1HH1      ARG  15   1.312 -10.299  10.289
  116   HH12  ARG  15          2HH1      ARG  15   2.490 -10.897  11.405
  117   HH21  ARG  15          1HH2      ARG  15   2.744 -14.046   9.915
  118   HH22  ARG  15          2HH2      ARG  15   3.301 -13.022  11.196
  119    H    TYR  16           H        TYR  16  -2.585  -8.159   6.475
  120    HA   TYR  16           HA       TYR  16  -1.001  -9.339   4.425
  121    HD1  TYR  16           2HD      TYR  16  -2.626 -10.730   4.739
  122    HD2  TYR  16           1HD      TYR  16  -5.282  -7.656   3.442
  123    HE1  TYR  16           2HE      TYR  16  -4.523 -12.241   5.043
  124    HE2  TYR  16           1HE      TYR  16  -7.184  -9.173   3.751
  125    HH   TYR  16           HH       TYR  16  -7.125 -12.208   3.811
  126    HB2  TYR  16           2HB      TYR  16  -3.013  -7.098   4.140
  127    HB3  TYR  16           1HB      TYR  16  -2.378  -8.093   2.839
  128    H    VAL  17           H        VAL  17  -0.771  -6.361   6.168
  129    HA   VAL  17           HA       VAL  17   0.961  -5.103   4.213
  130    HB   VAL  17           HB       VAL  17   0.101  -4.352   7.002
  131   HG11  VAL  17          1HG1      VAL  17   1.552  -2.197   6.151
  132   HG12  VAL  17          2HG1      VAL  17   2.574  -3.547   5.661
  133   HG13  VAL  17          3HG1      VAL  17   2.089  -3.369   7.351
  134   HG21  VAL  17          3HG2      VAL  17  -1.356  -3.793   5.091
  135   HG22  VAL  17          1HG2      VAL  17  -0.039  -2.834   4.411
  136   HG23  VAL  17          2HG2      VAL  17  -0.754  -2.372   5.954
  137    H    ASN  18           H        ASN  18   1.279  -6.649   7.395
  138    HA   ASN  18           HA       ASN  18   4.091  -6.377   7.561
  139    HB2  ASN  18           2HB      ASN  18   2.332  -8.409   8.942
  140    HB3  ASN  18           1HB      ASN  18   3.942  -7.902   9.442
  141   HD21  ASN  18          1HD2      ASN  18   1.890  -7.771  11.203
  142   HD22  ASN  18          2HD2      ASN  18   1.466  -6.124  11.509
  143    H    ARG  19           H        ARG  19   2.041  -8.730   5.998
  144    HA   ARG  19           HA       ARG  19   4.091 -10.718   5.811
  145    HE   ARG  19           HE       ARG  19  -0.002 -12.659   5.345
  146    HB2  ARG  19           2HB      ARG  19   1.471 -10.948   5.799
  147    HB3  ARG  19           1HB      ARG  19   1.667 -10.725   4.066
  148    HG2  ARG  19           2HG      ARG  19   2.134 -12.869   3.869
  149    HG3  ARG  19           1HG      ARG  19   3.569 -12.622   4.856
  150    HD2  ARG  19           2HD      ARG  19   2.232 -14.384   5.812
  151    HD3  ARG  19           1HD      ARG  19   2.220 -12.984   6.880
  152   HH11  ARG  19          1HH1      ARG  19   1.204 -15.245   7.354
  153   HH12  ARG  19          2HH1      ARG  19  -0.373 -15.826   7.770
  154   HH21  ARG  19          1HH2      ARG  19  -2.078 -13.422   5.890
  155   HH22  ARG  19          2HH2      ARG  19  -2.237 -14.792   6.939
  156    H    LEU  20           H        LEU  20   3.299  -7.935   3.964
  157    HA   LEU  20           HA       LEU  20   4.219  -8.880   1.444
  158    HG   LEU  20           HG       LEU  20   1.799  -6.859   2.474
  159    HB2  LEU  20           2HB      LEU  20   4.005  -6.059   2.470
  160    HB3  LEU  20           1HB      LEU  20   4.263  -6.510   0.797
  161   HD11  LEU  20          1HD1      LEU  20   2.227  -5.642  -0.246
  162   HD12  LEU  20          2HD1      LEU  20   2.225  -4.734   1.265
  163   HD13  LEU  20          3HD1      LEU  20   0.762  -5.567   0.736
  164   HD21  LEU  20          3HD2      LEU  20   0.808  -8.018   0.479
  165   HD22  LEU  20          1HD2      LEU  20   1.986  -8.976   1.372
  166   HD23  LEU  20          2HD2      LEU  20   2.441  -8.212  -0.151
  167    H    CYS  21           H        CYS  21   5.754  -6.930   3.988
  168    HA   CYS  21           HA       CYS  21   8.138  -6.349   2.725
  169    HG   CYS  21           HG       CYS  21   8.261  -7.334   6.934
  170    HB2  CYS  21           2HB      CYS  21   9.137  -6.174   4.967
  171    HB3  CYS  21           1HB      CYS  21   7.541  -5.430   4.919
  172    H    LYS  22           H        LYS  22   7.217  -9.317   4.375
  173    HA   LYS  22           HA       LYS  22   9.831 -10.487   4.081
  174    HB2  LYS  22           2HB      LYS  22   7.210 -11.817   4.800
  175    HB3  LYS  22           1HB      LYS  22   8.813 -12.511   4.996
  176    HG2  LYS  22           2HG      LYS  22   9.126 -11.490   6.958
  177    HG3  LYS  22           1HG      LYS  22   8.574  -9.944   6.326
  178    HD2  LYS  22           2HD      LYS  22   7.167 -10.815   8.191
  179    HD3  LYS  22           1HD      LYS  22   6.272 -10.513   6.704
  180    HE2  LYS  22           2HE      LYS  22   7.256 -13.245   6.824
  181    HE3  LYS  22           1HE      LYS  22   6.255 -12.837   8.217
  182    HZ1  LYS  22           3HZ      LYS  22   4.445 -12.369   6.873
  183    HZ2  LYS  22           1HZ      LYS  22   5.120 -13.736   6.139
  184    HZ3  LYS  22           2HZ      LYS  22   5.380 -12.202   5.474
  185    H    HIS  23           H        HIS  23   7.012 -10.198   2.158
  186    HA   HIS  23           HA       HIS  23   7.601 -12.494   0.496
  187    HD1  HIS  23           1HD      HIS  23   5.779 -12.393   2.776
  188    HD2  HIS  23           2HD      HIS  23   3.685 -13.258  -0.709
  189    HE1  HIS  23           1HE      HIS  23   4.216 -14.272   3.378
  190    HE2  HIS  23           2HE      HIS  23   3.021 -14.833   1.232
  191    HB2  HIS  23           2HB      HIS  23   5.446 -10.417   0.514
  192    HB3  HIS  23           1HB      HIS  23   5.681 -11.434  -0.902
  193    H    TRP  24           H        TRP  24   7.246  -8.983  -0.226
  194    HA   TRP  24           HA       TRP  24   8.716  -9.380  -2.690
  195    HD1  TRP  24           HD       TRP  24   5.402  -8.817  -1.239
  196    HE1  TRP  24           1HE      TRP  24   3.516  -9.121  -2.965
  197    HE3  TRP  24           3HE      TRP  24   7.663  -6.687  -5.301
  198    HZ2  TRP  24           2HZ      TRP  24   3.049  -8.537  -5.686
  199    HZ3  TRP  24           3HZ      TRP  24   6.428  -6.600  -7.428
  200    HH2  TRP  24           HH       TRP  24   4.169  -7.507  -7.614
  201    HB2  TRP  24           2HB      TRP  24   7.559  -6.897  -1.414
  202    HB3  TRP  24           1HB      TRP  24   8.324  -6.943  -2.999
  203    H    GLY  25           H        GLY  25   9.599  -8.792   0.541
  204    HA2  GLY  25           2HA      GLY  25  11.779  -7.006   0.097
  205    HA3  GLY  25           1HA      GLY  25  11.536  -8.011   1.513
  206    H    HIS  26           H        HIS  26  12.387  -8.381  -1.922
  207    HA   HIS  26           HA       HIS  26  14.332 -10.434  -1.111
  208    HD1  HIS  26           1HD      HIS  26  12.747 -11.621  -0.472
  209    HD2  HIS  26           2HD      HIS  26  12.482 -13.182  -4.314
  210    HE1  HIS  26           1HE      HIS  26  11.774 -13.923  -0.196
  211    HE2  HIS  26           2HE      HIS  26  11.543 -14.815  -2.541
  212    HB2  HIS  26           2HB      HIS  26  12.615 -10.099  -3.527
  213    HB3  HIS  26           1HB      HIS  26  14.185 -10.870  -3.727
  214    H    LYS  27           H        LYS  27  13.891  -7.384  -2.735
  215    HA   LYS  27           HA       LYS  27  16.773  -7.008  -2.793
  216    HB2  LYS  27           2HB      LYS  27  16.504  -8.071  -4.918
  217    HB3  LYS  27           1HB      LYS  27  15.090  -7.105  -5.300
  218    HG2  LYS  27           2HG      LYS  27  17.482  -5.502  -4.822
  219    HG3  LYS  27           1HG      LYS  27  17.644  -6.634  -6.164
  220    HD2  LYS  27           2HD      LYS  27  16.244  -5.468  -7.459
  221    HD3  LYS  27           1HD      LYS  27  15.077  -5.267  -6.153
  222    HE2  LYS  27           2HE      LYS  27  15.862  -3.234  -5.590
  223    HE3  LYS  27           1HE      LYS  27  17.540  -3.679  -5.894
  224    HZ1  LYS  27           3HZ      LYS  27  17.433  -2.982  -8.020
  225    HZ2  LYS  27           1HZ      LYS  27  16.175  -2.012  -7.437
  226    HZ3  LYS  27           2HZ      LYS  27  15.826  -3.463  -8.232
  227    H    PHE  28           H        PHE  28  14.252  -5.851  -1.566
  228    HA   PHE  28           HA       PHE  28  14.906  -3.077  -2.203
  229    HD1  PHE  28           2HD      PHE  28  13.684  -1.332  -3.904
  230    HD2  PHE  28           1HD      PHE  28  12.248  -5.310  -4.365
  231    HE1  PHE  28           2HE      PHE  28  13.903  -1.123  -6.346
  232    HE2  PHE  28           1HE      PHE  28  12.465  -5.111  -6.808
  233    HZ   PHE  28           HZ       PHE  28  13.293  -3.015  -7.802
  234    HB2  PHE  28           2HB      PHE  28  12.142  -4.266  -2.269
  235    HB3  PHE  28           1HB      PHE  28  12.425  -2.535  -2.099
  236    H    GLU  29           H        GLU  29  14.001  -1.520  -0.604
  237    HA   GLU  29           HA       GLU  29  14.504  -2.589   2.043
  238    HB2  GLU  29           2HB      GLU  29  14.252  -0.208   2.778
  239    HB3  GLU  29           1HB      GLU  29  15.507  -0.471   1.576
  240    HG2  GLU  29           2HG      GLU  29  14.210   0.501  -0.133
  241    HG3  GLU  29           1HG      GLU  29  12.752   0.468   0.854
  242    H    VAL  30           H        VAL  30  12.884  -3.742   2.863
  243    HA   VAL  30           HA       VAL  30  10.194  -2.549   2.821
  244    HB   VAL  30           HB       VAL  30   9.587  -5.065   3.415
  245   HG11  VAL  30          1HG1      VAL  30  10.071  -3.842   0.724
  246   HG12  VAL  30          2HG1      VAL  30   8.545  -4.107   1.571
  247   HG13  VAL  30          3HG1      VAL  30   9.421  -5.472   0.887
  248   HG21  VAL  30          3HG2      VAL  30  10.981  -6.698   2.571
  249   HG22  VAL  30          1HG2      VAL  30  12.127  -5.570   3.295
  250   HG23  VAL  30          2HG2      VAL  30  11.870  -5.564   1.548
  251    H    GLU  31           H        GLU  31   9.716  -1.638   4.720
  252    HA   GLU  31           HA       GLU  31  10.848  -2.724   7.182
  253    HB2  GLU  31           2HB      GLU  31  10.347  -0.136   6.319
  254    HB3  GLU  31           1HB      GLU  31   9.053  -0.438   7.470
  255    HG2  GLU  31           2HG      GLU  31  10.679  -1.020   9.175
  256    HG3  GLU  31           1HG      GLU  31  11.992  -0.789   8.020
  257    H    LEU  32           H        LEU  32   9.449  -3.116   9.050
  258    HA   LEU  32           HA       LEU  32   6.659  -3.700   8.353
  259    HG   LEU  32           HG       LEU  32   5.914  -6.334   8.239
  260    HB2  LEU  32           2HB      LEU  32   8.189  -5.708   8.101
  261    HB3  LEU  32           1HB      LEU  32   8.376  -5.673   9.840
  262   HD11  LEU  32          1HD1      LEU  32   7.851  -7.761   9.898
  263   HD12  LEU  32          2HD1      LEU  32   6.783  -8.353   8.626
  264   HD13  LEU  32          3HD1      LEU  32   6.166  -8.136  10.264
  265   HD21  LEU  32          3HD2      LEU  32   4.778  -6.506  10.505
  266   HD22  LEU  32          1HD2      LEU  32   5.012  -4.879   9.868
  267   HD23  LEU  32          2HD2      LEU  32   6.082  -5.499  11.126
  268    H    THR  33           H        THR  33   5.530  -2.484   9.695
  269    HA   THR  33           HA       THR  33   6.173  -2.636  12.588
  270    HB   THR  33           HB       THR  33   5.008  -0.281  12.583
  271    HG1  THR  33           1HG      THR  33   4.590  -0.432  10.271
  272   HG21  THR  33          3HG2      THR  33   7.390  -0.708  13.175
  273   HG22  THR  33          1HG2      THR  33   7.080   0.866  12.441
  274   HG23  THR  33          2HG2      THR  33   7.798  -0.429  11.482
  275    HA   PRO  34           HA       PRO  34   1.975  -4.000  12.878
  276    HB2  PRO  34           2HB      PRO  34   1.300  -3.194  15.375
  277    HB3  PRO  34           1HB      PRO  34   2.391  -4.542  15.055
  278    HG2  PRO  34           2HG      PRO  34   3.030  -1.739  15.854
  279    HG3  PRO  34           1HG      PRO  34   3.793  -3.253  16.371
  280    HD2  PRO  34           2HD      PRO  34   4.847  -1.570  14.477
  281    HD3  PRO  34           1HD      PRO  34   5.182  -3.311  14.549
  282    H    GLU  35           H        GLU  35   2.138  -1.776  11.379
  283    HA   GLU  35           HA       GLU  35  -0.373  -0.478  11.858
  284    HB2  GLU  35           2HB      GLU  35   2.214   1.086  11.961
  285    HB3  GLU  35           1HB      GLU  35   0.631   1.824  11.752
  286    HG2  GLU  35           2HG      GLU  35   1.559   0.237  14.132
  287    HG3  GLU  35           1HG      GLU  35   1.370   1.985  14.047
  288    H    ARG  36           H        ARG  36   2.597  -0.729   9.945
  289    HA   ARG  36           HA       ARG  36   1.173  -0.835   7.512
  290    HE   ARG  36           HE       ARG  36   4.598   3.724   7.716
  291    HB2  ARG  36           2HB      ARG  36   2.304   1.249   6.553
  292    HB3  ARG  36           1HB      ARG  36   0.925   1.509   7.604
  293    HG2  ARG  36           2HG      ARG  36   2.546   1.865   9.485
  294    HG3  ARG  36           1HG      ARG  36   3.834   1.832   8.280
  295    HD2  ARG  36           2HD      ARG  36   1.936   3.614   7.276
  296    HD3  ARG  36           1HD      ARG  36   2.039   3.971   9.000
  297   HH11  ARG  36          1HH1      ARG  36   1.972   5.897   8.468
  298   HH12  ARG  36          2HH1      ARG  36   2.952   7.319   8.359
  299   HH21  ARG  36          1HH2      ARG  36   5.889   5.595   7.572
  300   HH22  ARG  36          2HH2      ARG  36   5.176   7.149   7.849
  301    H    GLY  37           H        GLY  37   2.649  -0.712   5.612
  302    HA2  GLY  37           2HA      GLY  37   5.258  -1.907   6.309
  303    HA3  GLY  37           1HA      GLY  37   4.328  -2.326   4.869
  304    H    PHE  38           H        PHE  38   7.087  -1.211   5.064
  305    HA   PHE  38           HA       PHE  38   6.619   1.219   3.456
  306    HD1  PHE  38           2HD      PHE  38   7.307   3.608   3.692
  307    HD2  PHE  38           1HD      PHE  38  10.854   1.581   4.899
  308    HE1  PHE  38           2HE      PHE  38   8.665   5.448   2.793
  309    HE2  PHE  38           1HE      PHE  38  12.214   3.416   3.995
  310    HZ   PHE  38           HZ       PHE  38  11.121   5.351   2.934
  311    HB2  PHE  38           2HB      PHE  38   7.473   1.807   5.663
  312    HB3  PHE  38           1HB      PHE  38   8.812   0.686   5.471
  313    H    ILE  39           H        ILE  39   7.147   0.799   1.429
  314    HA   ILE  39           HA       ILE  39   9.581  -0.809   0.934
  315    HB   ILE  39           HB       ILE  39   7.272  -0.923  -0.980
  316   HG12  ILE  39          2HG1      ILE  39   7.611  -2.511   1.559
  317   HG13  ILE  39          1HG1      ILE  39   6.152  -1.778   0.904
  318   HG21  ILE  39          1HG2      ILE  39   8.580  -2.319  -2.114
  319   HG22  ILE  39          2HG2      ILE  39   8.915  -3.288  -0.682
  320   HG23  ILE  39          3HG2      ILE  39   9.886  -1.858  -1.024
  321   HD11  ILE  39          3HD1      ILE  39   6.011  -3.481  -0.794
  322   HD12  ILE  39          1HD1      ILE  39   6.124  -4.224   0.802
  323   HD13  ILE  39          2HD1      ILE  39   7.535  -4.184  -0.254
  324    H    ASP  40           H        ASP  40  11.032   0.631   0.110
  325    HA   ASP  40           HA       ASP  40  10.019   2.656  -1.759
  326    HB2  ASP  40           2HB      ASP  40  11.298   4.117  -0.657
  327    HB3  ASP  40           1HB      ASP  40  11.922   2.847   0.380
  328    H    PHE  41           H        PHE  41  10.566   2.642  -3.808
  329    HA   PHE  41           HA       PHE  41  12.262   0.456  -4.755
  330    HD1  PHE  41           1HD      PHE  41  11.477  -1.171  -6.795
  331    HD2  PHE  41           2HD      PHE  41   8.258   1.128  -5.229
  332    HE1  PHE  41           1HE      PHE  41  10.087  -3.198  -6.695
  333    HE2  PHE  41           2HE      PHE  41   6.861  -0.895  -5.124
  334    HZ   PHE  41           HZ       PHE  41   7.775  -3.061  -5.858
  335    HB2  PHE  41           2HB      PHE  41  10.161   2.204  -6.012
  336    HB3  PHE  41           1HB      PHE  41  11.316   1.364  -7.037
  337    H    GLY  42           H        GLY  42  12.857   3.439  -3.745
  338    HA2  GLY  42           2HA      GLY  42  15.144   4.236  -4.138
  339    HA3  GLY  42           1HA      GLY  42  14.859   3.970  -5.852
  340    H    ASP  43           H        ASP  43  13.566   5.435  -7.010
  341    HA   ASP  43           HA       ASP  43  13.412   8.082  -5.794
  342    HB2  ASP  43           2HB      ASP  43  14.184   7.278  -8.290
  343    HB3  ASP  43           1HB      ASP  43  12.516   7.758  -8.585
  344    H    SER  44           H        SER  44  11.650   6.474  -4.613
  345    HA   SER  44           HA       SER  44   9.224   7.736  -4.698
  346    HG   SER  44           HG       SER  44   7.358   5.011  -5.582
  347    HB2  SER  44           2HB      SER  44   8.006   6.877  -6.386
  348    HB3  SER  44           1HB      SER  44   9.473   6.132  -6.990
  349    H    ASN  45           H        ASN  45   7.386   5.957  -3.824
  350    HA   ASN  45           HA       ASN  45   8.537   3.872  -2.234
  351    HB2  ASN  45           2HB      ASN  45   7.261   5.946  -0.508
  352    HB3  ASN  45           1HB      ASN  45   8.491   4.758  -0.104
  353   HD21  ASN  45          1HD2      ASN  45  10.397   5.562   0.323
  354   HD22  ASN  45          2HD2      ASN  45  11.049   7.038  -0.294
  355    H    CYS  46           H        CYS  46   6.826   2.931  -0.716
  356    HA   CYS  46           HA       CYS  46   4.096   3.586  -1.417
  357    HG   CYS  46           HG       CYS  46   2.524   1.533  -3.275
  358    HB2  CYS  46           2HB      CYS  46   4.916   2.027  -3.207
  359    HB3  CYS  46           1HB      CYS  46   5.136   0.803  -1.960
  360    H    GLU  47           H        GLU  47   3.468   3.885   0.640
  361    HA   GLU  47           HA       GLU  47   4.110   1.836   2.637
  362    HB2  GLU  47           2HB      GLU  47   4.456   4.469   2.839
  363    HB3  GLU  47           1HB      GLU  47   2.775   4.415   3.339
  364    HG2  GLU  47           2HG      GLU  47   3.249   3.299   5.293
  365    HG3  GLU  47           1HG      GLU  47   4.747   2.611   4.669
  366    H    LEU  48           H        LEU  48   2.419   0.964   3.979
  367    HA   LEU  48           HA       LEU  48  -0.298   1.526   3.063
  368    HG   LEU  48           HG       LEU  48   1.588  -1.724   3.858
  369    HB2  LEU  48           2HB      LEU  48  -0.701  -1.032   3.225
  370    HB3  LEU  48           1HB      LEU  48  -0.075  -0.329   1.748
  371   HD11  LEU  48          1HD1      LEU  48   1.342  -2.852   1.153
  372   HD12  LEU  48          2HD1      LEU  48  -0.113  -2.941   2.144
  373   HD13  LEU  48          3HD1      LEU  48   1.393  -3.652   2.722
  374   HD21  LEU  48          3HD2      LEU  48   3.241  -0.543   2.896
  375   HD22  LEU  48          1HD2      LEU  48   2.252  -0.102   1.504
  376   HD23  LEU  48          2HD2      LEU  48   3.054  -1.672   1.556
  377    H    LEU  49           H        LEU  49  -1.598   1.887   4.672
  378    HA   LEU  49           HA       LEU  49  -0.812   1.026   7.367
  379    HG   LEU  49           HG       LEU  49  -2.187   1.806   9.155
  380    HB2  LEU  49           2HB      LEU  49  -1.712   3.386   6.741
  381    HB3  LEU  49           1HB      LEU  49  -3.280   2.600   6.740
  382   HD11  LEU  49          1HD1      LEU  49  -1.772   4.373   9.923
  383   HD12  LEU  49          2HD1      LEU  49  -1.026   4.370   8.326
  384   HD13  LEU  49          3HD1      LEU  49  -0.493   3.219   9.550
  385   HD21  LEU  49          3HD2      LEU  49  -4.067   4.058   8.458
  386   HD22  LEU  49          1HD2      LEU  49  -3.793   3.482  10.103
  387   HD23  LEU  49          2HD2      LEU  49  -4.482   2.400   8.892
  388    H    ALA  50           H        ALA  50  -1.758  -0.636   8.410
  389    HA   ALA  50           HA       ALA  50  -4.304  -1.625   7.367
  390    HB1  ALA  50           3HB      ALA  50  -3.436  -3.917   7.317
  391    HB2  ALA  50           1HB      ALA  50  -1.822  -3.291   7.638
  392    HB3  ALA  50           2HB      ALA  50  -2.669  -2.854   6.153
  393    H    HIS  51           H        HIS  51  -5.646  -1.645   8.981
  394    HA   HIS  51           HA       HIS  51  -4.730  -2.552  11.596
  395    HD1  HIS  51           1HD      HIS  51  -7.752  -0.056  13.717
  396    HD2  HIS  51           2HD      HIS  51  -3.824  -1.352  13.297
  397    HE1  HIS  51           1HE      HIS  51  -6.720   0.173  15.998
  398    HE2  HIS  51           2HE      HIS  51  -4.369  -0.694  15.737
  399    HB2  HIS  51           2HB      HIS  51  -5.925  -0.148  11.003
  400    HB3  HIS  51           1HB      HIS  51  -7.311  -1.121  11.473
  401    HA   PRO  52           HA       PRO  52  -7.261  -6.133  11.733
  402    HB2  PRO  52           2HB      PRO  52  -9.001  -4.761  13.740
  403    HB3  PRO  52           1HB      PRO  52  -8.286  -6.378  13.783
  404    HG2  PRO  52           2HG      PRO  52  -7.194  -4.412  15.176
  405    HG3  PRO  52           1HG      PRO  52  -6.168  -5.569  14.311
  406    HD2  PRO  52           2HD      PRO  52  -6.838  -2.748  13.616
  407    HD3  PRO  52           1HD      PRO  52  -5.333  -3.643  13.348
  408    H    ASP  53           H        ASP  53  -8.928  -3.089  11.148
  409    HA   ASP  53           HA       ASP  53 -10.851  -4.607   9.562
  410    HB2  ASP  53           2HB      ASP  53 -11.694  -3.925  11.949
  411    HB3  ASP  53           1HB      ASP  53 -11.914  -2.345  11.205
  412    H    HIS  54           H        HIS  54  -8.646  -2.173   9.476
  413    HA   HIS  54           HA       HIS  54  -9.948  -1.158   7.098
  414    HD1  HIS  54           1HD      HIS  54  -7.315   1.982   8.726
  415    HD2  HIS  54           2HD      HIS  54  -9.931   0.155  11.386
  416    HE1  HIS  54           1HE      HIS  54  -6.400   2.479  11.014
  417    HE2  HIS  54           2HE      HIS  54  -8.091   1.502  12.605
  418    HB2  HIS  54           2HB      HIS  54  -9.511   1.217   7.655
  419    HB3  HIS  54           1HB      HIS  54 -10.710   0.462   8.690
  420    H    VAL  55           H        VAL  55  -8.500   0.038   5.634
  421    HA   VAL  55           HA       VAL  55  -5.667  -0.284   6.227
  422    HB   VAL  55           HB       VAL  55  -6.757  -2.265   4.893
  423   HG11  VAL  55          1HG1      VAL  55  -7.601  -0.487   3.171
  424   HG12  VAL  55          2HG1      VAL  55  -7.039  -2.067   2.633
  425   HG13  VAL  55          3HG1      VAL  55  -5.977  -0.665   2.512
  426   HG21  VAL  55          3HG2      VAL  55  -4.637  -2.735   3.864
  427   HG22  VAL  55          1HG2      VAL  55  -4.369  -1.987   5.437
  428   HG23  VAL  55          2HG2      VAL  55  -4.173  -1.035   3.965
  429    H    LEU  56           H        LEU  56  -4.405   1.258   5.372
  430    HA   LEU  56           HA       LEU  56  -5.660   3.223   3.571
  431    HG   LEU  56           HG       LEU  56  -6.391   4.855   5.493
  432    HB2  LEU  56           2HB      LEU  56  -4.384   3.589   6.129
  433    HB3  LEU  56           1HB      LEU  56  -3.454   4.422   4.906
  434   HD11  LEU  56          1HD1      LEU  56  -4.658   5.606   7.211
  435   HD12  LEU  56          2HD1      LEU  56  -5.809   6.807   6.625
  436   HD13  LEU  56          3HD1      LEU  56  -4.159   6.789   6.001
  437   HD21  LEU  56          3HD2      LEU  56  -5.768   6.999   4.106
  438   HD22  LEU  56          1HD2      LEU  56  -6.255   5.514   3.294
  439   HD23  LEU  56          2HD2      LEU  56  -4.546   5.937   3.412
  440    H    MET  57           H        MET  57  -4.409   4.036   1.880
  441    HA   MET  57           HA       MET  57  -1.834   2.684   1.452
  442    HB2  MET  57           2HB      MET  57  -3.766   3.227  -0.783
  443    HB3  MET  57           1HB      MET  57  -2.364   2.163  -0.781
  444    HG2  MET  57           2HG      MET  57  -3.494   0.694   0.841
  445    HG3  MET  57           1HG      MET  57  -4.912   1.742   0.763
  446    HE1  MET  57           3HE      MET  57  -6.455   1.662  -2.221
  447    HE2  MET  57           1HE      MET  57  -6.580   1.652  -0.462
  448    HE3  MET  57           2HE      MET  57  -7.038   0.223  -1.388
  449    H    ILE  58           H        ILE  58  -0.255   4.180   1.432
  450    HA   ILE  58           HA       ILE  58  -0.795   6.722   0.055
  451    HB   ILE  58           HB       ILE  58   1.011   6.355   2.450
  452   HG12  ILE  58          2HG1      ILE  58  -1.843   6.657   2.346
  453   HG13  ILE  58          1HG1      ILE  58  -0.807   6.503   3.751
  454   HG21  ILE  58          1HG2      ILE  58   0.093   8.847   1.028
  455   HG22  ILE  58          2HG2      ILE  58   1.702   8.125   0.931
  456   HG23  ILE  58          3HG2      ILE  58   1.124   8.789   2.458
  457   HD11  ILE  58          3HD1      ILE  58  -0.678   8.783   4.071
  458   HD12  ILE  58          1HD1      ILE  58  -2.337   8.567   3.516
  459   HD13  ILE  58          2HD1      ILE  58  -1.102   9.153   2.400
  460    H    LEU  59           H        LEU  59   0.751   7.427  -1.359
  461    HA   LEU  59           HA       LEU  59   3.194   5.794  -1.572
  462    HG   LEU  59           HG       LEU  59   1.421   6.922  -5.287
  463    HB2  LEU  59           2HB      LEU  59   3.093   5.788  -3.900
  464    HB3  LEU  59           1HB      LEU  59   1.453   5.451  -3.395
  465   HD11  LEU  59          1HD1      LEU  59   0.734   8.458  -2.806
  466   HD12  LEU  59          2HD1      LEU  59  -0.279   7.227  -3.560
  467   HD13  LEU  59          3HD1      LEU  59   0.084   8.723  -4.420
  468   HD21  LEU  59          3HD2      LEU  59   2.726   8.703  -5.639
  469   HD22  LEU  59          1HD2      LEU  59   3.747   7.994  -4.392
  470   HD23  LEU  59          2HD2      LEU  59   2.593   9.259  -3.978
  471    H    ASN  60           H        ASN  60   5.098   6.830  -2.118
  472    HA   ASN  60           HA       ASN  60   4.988   9.776  -2.158
  473    HB2  ASN  60           2HB      ASN  60   7.164   8.072  -0.913
  474    HB3  ASN  60           1HB      ASN  60   7.117   9.833  -0.951
  475   HD21  ASN  60          1HD2      ASN  60   7.408   9.356   1.410
  476   HD22  ASN  60          2HD2      ASN  60   5.972   9.199   2.359
  477    H    SER  61           H        SER  61   5.255  10.179  -4.281
  478    HA   SER  61           HA       SER  61   7.736   9.157  -5.516
  479    HG   SER  61           HG       SER  61   5.823   7.100  -5.325
  480    HB2  SER  61           2HB      SER  61   5.367   9.102  -7.284
  481    HB3  SER  61           1HB      SER  61   6.745   8.010  -7.215
  482    HA   PRO  62           HA       PRO  62   8.004  13.330  -7.032
  483    HB2  PRO  62           2HB      PRO  62  10.015  12.959  -8.773
  484    HB3  PRO  62           1HB      PRO  62  10.242  12.956  -7.023
  485    HG2  PRO  62           2HG      PRO  62   9.949  10.617  -8.876
  486    HG3  PRO  62           1HG      PRO  62  11.153  10.881  -7.598
  487    HD2  PRO  62           2HD      PRO  62   8.983   9.357  -7.205
  488    HD3  PRO  62           1HD      PRO  62   9.654  10.369  -5.915
  489    H    ASP  63           H        ASP  63   6.920  10.679  -8.897
  490    HA   ASP  63           HA       ASP  63   5.975  12.569 -10.915
  491    HB2  ASP  63           2HB      ASP  63   7.844  11.771 -12.080
  492    HB3  ASP  63           1HB      ASP  63   7.658  10.137 -11.457
  493    H    GLU  64           H        GLU  64   3.971  11.965 -11.889
  494    HA   GLU  64           HA       GLU  64   2.283  10.382 -10.247
  495    HB2  GLU  64           2HB      GLU  64   1.912  11.611 -12.950
  496    HB3  GLU  64           1HB      GLU  64   0.818  10.327 -12.470
  497    HG2  GLU  64           2HG      GLU  64  -0.331  12.094 -11.655
  498    HG3  GLU  64           1HG      GLU  64   0.671  11.728 -10.245
  499    H    ASP  65           H        ASP  65   3.973   9.481 -13.282
  500    HA   ASP  65           HA       ASP  65   2.877   6.992 -13.728
  501    HB2  ASP  65           2HB      ASP  65   4.728   8.129 -15.042
  502    HB3  ASP  65           1HB      ASP  65   5.844   7.552 -13.807
  503    H    SER  66           H        SER  66   5.639   7.777 -11.657
  504    HA   SER  66           HA       SER  66   5.902   5.257 -10.423
  505    HG   SER  66           HG       SER  66   8.656   7.463 -10.228
  506    HB2  SER  66           2HB      SER  66   6.669   8.041  -9.541
  507    HB3  SER  66           1HB      SER  66   7.063   6.602  -8.599
  508    H    LEU  67           H        LEU  67   4.487   8.254  -9.292
  509    HA   LEU  67           HA       LEU  67   3.340   7.667  -6.930
  510    HG   LEU  67           HG       LEU  67   1.114   9.387  -6.533
  511    HB2  LEU  67           2HB      LEU  67   3.201   9.855  -7.786
  512    HB3  LEU  67           1HB      LEU  67   2.402   9.330  -9.239
  513   HD11  LEU  67          1HD1      LEU  67  -0.125  11.263  -8.071
  514   HD12  LEU  67          2HD1      LEU  67   1.573  11.455  -8.501
  515   HD13  LEU  67          3HD1      LEU  67   1.071  11.580  -6.815
  516   HD21  LEU  67          3HD2      LEU  67  -0.184   7.882  -7.692
  517   HD22  LEU  67          1HD2      LEU  67   0.162   8.637  -9.248
  518   HD23  LEU  67          2HD2      LEU  67  -0.955   9.407  -8.123
  519    H    ALA  68           H        ALA  68   1.537   7.263 -10.000
  520    HA   ALA  68           HA       ALA  68  -0.595   5.869  -8.757
  521    HB1  ALA  68           3HB      ALA  68  -0.973   5.106 -11.239
  522    HB2  ALA  68           1HB      ALA  68   0.273   6.305 -11.587
  523    HB3  ALA  68           2HB      ALA  68  -1.217   6.790 -10.778
  524    H    HIS  69           H        HIS  69   2.400   4.838 -10.305
  525    HA   HIS  69           HA       HIS  69   1.918   2.112 -10.552
  526    HD1  HIS  69           1HD      HIS  69   3.036   0.212  -9.896
  527    HD2  HIS  69           2HD      HIS  69   6.471   1.786 -11.626
  528    HE1  HIS  69           1HE      HIS  69   4.450  -1.774 -10.512
  529    HE2  HIS  69           2HE      HIS  69   6.484  -0.800 -11.635
  530    HB2  HIS  69           2HB      HIS  69   3.955   3.361 -11.361
  531    HB3  HIS  69           1HB      HIS  69   4.551   3.330  -9.706
  532    H    MET  70           H        MET  70   2.884   4.027  -7.777
  533    HA   MET  70           HA       MET  70   3.198   1.747  -6.042
  534    HB2  MET  70           2HB      MET  70   2.988   4.659  -5.289
  535    HB3  MET  70           1HB      MET  70   3.674   3.376  -4.307
  536    HG2  MET  70           2HG      MET  70   4.780   4.485  -6.864
  537    HG3  MET  70           1HG      MET  70   5.435   4.673  -5.242
  538    HE1  MET  70           3HE      MET  70   6.668   3.925  -7.874
  539    HE2  MET  70           1HE      MET  70   6.173   2.347  -8.485
  540    HE3  MET  70           2HE      MET  70   7.715   2.525  -7.647
  541    H    GLN  71           H        GLN  71   0.851   4.496  -6.042
  542    HA   GLN  71           HA       GLN  71  -0.794   3.457  -4.068
  543    HB2  GLN  71           2HB      GLN  71  -2.650   4.813  -5.297
  544    HB3  GLN  71           1HB      GLN  71  -1.340   5.646  -4.487
  545    HG2  GLN  71           2HG      GLN  71  -0.752   6.632  -6.374
  546    HG3  GLN  71           1HG      GLN  71  -0.678   5.097  -7.230
  547   HE21  GLN  71          1HE2      GLN  71  -2.261   4.574  -8.619
  548   HE22  GLN  71          2HE2      GLN  71  -3.660   5.541  -8.920
  549    H    ASN  72           H        ASN  72  -0.603   2.562  -7.428
  550    HA   ASN  72           HA       ASN  72  -3.132   1.167  -7.389
  551    HB2  ASN  72           2HB      ASN  72  -1.851   2.245  -9.427
  552    HB3  ASN  72           1HB      ASN  72  -1.075   0.665  -9.496
  553   HD21  ASN  72          1HD2      ASN  72  -3.827   2.485 -10.253
  554   HD22  ASN  72          2HD2      ASN  72  -4.800   1.203 -10.878
  555    H    VAL  73           H        VAL  73   0.305   0.263  -7.394
  556    HA   VAL  73           HA       VAL  73   0.187  -2.452  -7.546
  557    HB   VAL  73           HB       VAL  73   1.987  -0.620  -6.005
  558   HG11  VAL  73          1HG1      VAL  73   3.424  -2.574  -5.442
  559   HG12  VAL  73          2HG1      VAL  73   2.086  -3.632  -5.896
  560   HG13  VAL  73          3HG1      VAL  73   1.909  -2.515  -4.541
  561   HG21  VAL  73          3HG2      VAL  73   1.942  -1.354  -8.591
  562   HG22  VAL  73          1HG2      VAL  73   3.002  -2.602  -7.936
  563   HG23  VAL  73          2HG2      VAL  73   3.412  -0.899  -7.729
  564    H    VAL  74           H        VAL  74  -0.485  -0.466  -4.701
  565    HA   VAL  74           HA       VAL  74  -0.866  -2.694  -2.949
  566    HB   VAL  74           HB       VAL  74  -1.821   0.149  -2.627
  567   HG11  VAL  74          1HG1      VAL  74  -2.253  -0.297  -0.362
  568   HG12  VAL  74          2HG1      VAL  74  -1.414  -1.844  -0.417
  569   HG13  VAL  74          3HG1      VAL  74  -2.965  -1.654  -1.232
  570   HG21  VAL  74          3HG2      VAL  74   0.279  -0.398  -0.853
  571   HG22  VAL  74          1HG2      VAL  74   0.309   0.665  -2.258
  572   HG23  VAL  74          2HG2      VAL  74   0.797  -1.023  -2.418
  573    H    ALA  75           H        ALA  75  -3.121  -0.529  -4.699
  574    HA   ALA  75           HA       ALA  75  -5.536  -1.446  -3.788
  575    HB1  ALA  75           3HB      ALA  75  -4.740  -0.618  -6.574
  576    HB2  ALA  75           1HB      ALA  75  -5.512   0.364  -5.329
  577    HB3  ALA  75           2HB      ALA  75  -6.406  -0.945  -6.100
  578    H    ASP  76           H        ASP  76  -3.227  -3.033  -5.816
  579    HA   ASP  76           HA       ASP  76  -5.002  -5.112  -6.712
  580    HB2  ASP  76           2HB      ASP  76  -2.640  -4.181  -7.644
  581    HB3  ASP  76           1HB      ASP  76  -2.082  -5.595  -6.755
  582    H    HIS  77           H        HIS  77  -2.509  -4.793  -4.209
  583    HA   HIS  77           HA       HIS  77  -2.436  -7.457  -3.384
  584    HD1  HIS  77           1HD      HIS  77  -0.867  -6.316  -4.741
  585    HD2  HIS  77           2HD      HIS  77   0.928  -4.687  -1.368
  586    HE1  HIS  77           1HE      HIS  77   1.424  -5.592  -5.482
  587    HE2  HIS  77           2HE      HIS  77   2.523  -4.687  -3.403
  588    HB2  HIS  77           2HB      HIS  77  -2.048  -5.040  -1.614
  589    HB3  HIS  77           1HB      HIS  77  -1.454  -6.664  -1.318
  590    H    LEU  78           H        LEU  78  -4.584  -4.832  -2.363
  591    HA   LEU  78           HA       LEU  78  -5.886  -6.245  -0.302
  592    HG   LEU  78           HG       LEU  78  -5.025  -3.113  -0.663
  593    HB2  LEU  78           2HB      LEU  78  -6.809  -3.936  -2.011
  594    HB3  LEU  78           1HB      LEU  78  -7.687  -4.530  -0.618
  595   HD11  LEU  78          1HD1      LEU  78  -6.148  -1.512   0.726
  596   HD12  LEU  78          2HD1      LEU  78  -7.593  -2.521   0.793
  597   HD13  LEU  78          3HD1      LEU  78  -7.105  -1.779  -0.730
  598   HD21  LEU  78          3HD2      LEU  78  -6.337  -4.558   1.639
  599   HD22  LEU  78          1HD2      LEU  78  -4.982  -3.442   1.787
  600   HD23  LEU  78          2HD2      LEU  78  -4.787  -4.951   0.896
  601    H    GLN  79           H        GLN  79  -6.157  -6.426  -3.738
  602    HA   GLN  79           HA       GLN  79  -8.848  -7.415  -3.757
  603    HB2  GLN  79           2HB      GLN  79  -8.194  -6.260  -5.699
  604    HB3  GLN  79           1HB      GLN  79  -6.721  -7.194  -5.864
  605    HG2  GLN  79           2HG      GLN  79  -8.051  -9.179  -6.414
  606    HG3  GLN  79           1HG      GLN  79  -9.520  -8.213  -6.279
  607   HE21  GLN  79          1HE2      GLN  79  -8.904  -5.927  -7.537
  608   HE22  GLN  79          2HE2      GLN  79  -8.538  -6.218  -9.201
  609    H    ARG  80           H        ARG  80  -5.668  -9.017  -4.310
  610    HA   ARG  80           HA       ARG  80  -6.816 -11.572  -4.631
  611    HE   ARG  80           HE       ARG  80  -2.506 -12.563  -4.659
  612    HB2  ARG  80           2HB      ARG  80  -4.438 -12.357  -3.941
  613    HB3  ARG  80           1HB      ARG  80  -4.661 -11.495  -5.455
  614    HG2  ARG  80           2HG      ARG  80  -3.281  -9.893  -4.831
  615    HG3  ARG  80           1HG      ARG  80  -4.129  -9.658  -3.302
  616    HD2  ARG  80           2HD      ARG  80  -1.730 -10.306  -3.060
  617    HD3  ARG  80           1HD      ARG  80  -2.860 -11.391  -2.253
  618   HH11  ARG  80          1HH1      ARG  80  -0.283 -11.405  -2.231
  619   HH12  ARG  80          2HH1      ARG  80   0.938 -12.571  -2.614
  620   HH21  ARG  80          1HH2      ARG  80  -0.901 -14.098  -5.165
  621   HH22  ARG  80          2HH2      ARG  80   0.588 -14.099  -4.280
  622    H    MET  81           H        MET  81  -5.909  -9.724  -1.822
  623    HA   MET  81           HA       MET  81  -6.086 -11.968  -0.036
  624    HB2  MET  81           2HB      MET  81  -5.824 -10.331   1.754
  625    HB3  MET  81           1HB      MET  81  -4.621 -10.108   0.501
  626    HG2  MET  81           2HG      MET  81  -5.315  -7.962   1.168
  627    HG3  MET  81           1HG      MET  81  -6.038  -8.254  -0.409
  628    HE1  MET  81           3HE      MET  81  -7.893  -5.887   1.950
  629    HE2  MET  81           1HE      MET  81  -6.250  -6.478   2.196
  630    HE3  MET  81           2HE      MET  81  -7.524  -6.914   3.336
  631    H    ALA  82           H        ALA  82  -8.350  -9.947  -1.559
  632    HA   ALA  82           HA       ALA  82 -10.378 -10.493   0.515
  633    HB1  ALA  82           3HB      ALA  82  -9.930  -8.134  -0.483
  634    HB2  ALA  82           1HB      ALA  82 -11.589  -8.673  -0.233
  635    HB3  ALA  82           2HB      ALA  82 -10.879  -8.726  -1.847
  636    H    ASN  83           H        ASN  83  -9.792 -10.775  -2.975
  637    HA   ASN  83           HA       ASN  83 -10.695 -12.113  -4.576
  638    HB2  ASN  83           2HB      ASN  83  -9.887 -13.805  -2.804
  639    HB3  ASN  83           1HB      ASN  83 -11.590 -13.977  -2.389
  640   HD21  ASN  83          1HD2      ASN  83 -13.051 -14.567  -4.158
  641   HD22  ASN  83          2HD2      ASN  83 -12.467 -15.629  -5.388
  642    H    SER  84           H        SER  84 -12.375 -11.023  -5.437
  643    HA   SER  84           HA       SER  84 -14.955 -11.936  -5.298
  644    HG   SER  84           HG       SER  84 -17.046 -10.236  -3.619
  645    HB2  SER  84           2HB      SER  84 -15.300 -11.243  -3.070
  646    HB3  SER  84           1HB      SER  84 -14.433  -9.727  -3.315
  647    H    GLU  85           H        GLU  85 -14.049  -8.524  -4.990
  648    HA   GLU  85           HA       GLU  85 -14.653  -8.168  -7.854
  649    HB2  GLU  85           2HB      GLU  85 -15.668  -6.039  -7.365
  650    HB3  GLU  85           1HB      GLU  85 -16.428  -7.258  -6.352
  651    HG2  GLU  85           2HG      GLU  85 -14.194  -6.126  -4.967
  652    HG3  GLU  85           1HG      GLU  85 -15.240  -4.837  -5.561
  653    H    SER  86           H        SER  86 -13.733  -5.936  -8.614
  654    HA   SER  86           HA       SER  86 -10.914  -6.026  -8.137
  655    HG   SER  86           HG       SER  86 -10.564  -4.924 -11.127
  656    HB2  SER  86           2HB      SER  86 -12.747  -4.484  -9.894
  657    HB3  SER  86           1HB      SER  86 -11.206  -3.721  -9.507
  658    H    LEU  87           H        LEU  87 -11.272  -5.757  -5.786
  659    HA   LEU  87           HA       LEU  87 -11.700  -4.442  -3.880
  660    HG   LEU  87           HG       LEU  87  -8.304  -4.658  -2.966
  661    HB2  LEU  87           2HB      LEU  87  -9.089  -4.233  -5.032
  662    HB3  LEU  87           1HB      LEU  87  -9.502  -2.691  -4.310
  663   HD11  LEU  87          1HD1      LEU  87  -9.380  -3.567  -0.892
  664   HD12  LEU  87          2HD1      LEU  87 -10.204  -2.533  -2.060
  665   HD13  LEU  87          3HD1      LEU  87  -8.442  -2.557  -1.992
  666   HD21  LEU  87          3HD2      LEU  87 -11.198  -5.041  -2.226
  667   HD22  LEU  87          1HD2      LEU  87  -9.798  -5.866  -1.550
  668   HD23  LEU  87          2HD2      LEU  87 -10.277  -6.172  -3.217
  669    H    GLU  88           H        GLU  88 -13.326  -3.051  -3.628
  670    HA   GLU  88           HA       GLU  88 -13.614  -0.709  -5.246
  671    HB2  GLU  88           2HB      GLU  88 -15.540  -1.830  -4.135
  672    HB3  GLU  88           1HB      GLU  88 -14.880  -1.367  -2.572
  673    HG2  GLU  88           2HG      GLU  88 -15.009   1.042  -3.508
  674    HG3  GLU  88           1HG      GLU  88 -16.125   0.344  -4.680
  675    H    ILE  89           H        ILE  89 -11.836   0.598  -5.114
  676    HA   ILE  89           HA       ILE  89 -11.273   1.724  -2.468
  677    HB   ILE  89           HB       ILE  89  -8.932   1.616  -2.713
  678   HG12  ILE  89          2HG1      ILE  89  -9.041   2.226  -5.244
  679   HG13  ILE  89          1HG1      ILE  89  -7.704   1.250  -4.663
  680   HG21  ILE  89          1HG2      ILE  89  -8.472  -0.786  -3.251
  681   HG22  ILE  89          2HG2      ILE  89 -10.169  -0.926  -3.709
  682   HG23  ILE  89          3HG2      ILE  89  -9.735  -0.500  -2.055
  683   HD11  ILE  89          3HD1      ILE  89  -8.570   0.408  -6.765
  684   HD12  ILE  89          1HD1      ILE  89 -10.164   0.204  -6.040
  685   HD13  ILE  89          2HD1      ILE  89  -8.803  -0.762  -5.465
  686    H    ALA  90           H        ALA  90 -11.283   3.953  -2.429
  687    HA   ALA  90           HA       ALA  90 -11.467   5.280  -5.034
  688    HB1  ALA  90           3HB      ALA  90 -11.844   6.611  -2.357
  689    HB2  ALA  90           1HB      ALA  90 -13.149   5.755  -3.183
  690    HB3  ALA  90           2HB      ALA  90 -12.394   7.156  -3.940
  691    H    TRP  91           H        TRP  91  -9.605   5.840  -5.881
  692    HA   TRP  91           HA       TRP  91  -7.368   6.563  -4.155
  693    HD1  TRP  91           HD       TRP  91  -9.052   4.553  -7.614
  694    HE1  TRP  91           1HE      TRP  91  -9.470   5.392 -10.011
  695    HE3  TRP  91           3HE      TRP  91  -5.619   8.338  -7.759
  696    HZ2  TRP  91           2HZ      TRP  91  -8.475   7.393 -11.735
  697    HZ3  TRP  91           3HZ      TRP  91  -5.414   9.667  -9.819
  698    HH2  TRP  91           HH       TRP  91  -6.814   9.203 -11.766
  699    HB2  TRP  91           2HB      TRP  91  -6.005   6.420  -6.192
  700    HB3  TRP  91           1HB      TRP  91  -6.941   4.948  -5.944
  701    H    GLN  92           H        GLN  92  -6.580   8.554  -3.942
  702    HA   GLN  92           HA       GLN  92  -8.038  10.735  -5.200
  703    HB2  GLN  92           2HB      GLN  92  -5.909  10.706  -3.054
  704    HB3  GLN  92           1HB      GLN  92  -6.683  12.165  -3.656
  705    HG2  GLN  92           2HG      GLN  92  -8.796  11.496  -2.802
  706    HG3  GLN  92           1HG      GLN  92  -8.198   9.880  -2.425
  707   HE21  GLN  92          1HE2      GLN  92  -8.735  10.021  -0.266
  708   HE22  GLN  92          2HE2      GLN  92  -7.883  11.034   0.844
  709    HA   PRO  93           HA       PRO  93  -5.293  11.860  -8.439
  710    HB2  PRO  93           2HB      PRO  93  -5.105  14.511  -7.096
  711    HB3  PRO  93           1HB      PRO  93  -5.456  14.132  -8.786
  712    HG2  PRO  93           2HG      PRO  93  -7.410  14.851  -7.121
  713    HG3  PRO  93           1HG      PRO  93  -7.668  13.594  -8.345
  714    HD2  PRO  93           2HD      PRO  93  -7.319  13.332  -5.404
  715    HD3  PRO  93           1HD      PRO  93  -8.254  12.325  -6.527
  716    H    ALA  94           H        ALA  94  -4.366  12.980  -5.202
  717    HA   ALA  94           HA       ALA  94  -2.364  12.422  -4.110
  718    HB1  ALA  94           3HB      ALA  94  -0.517  11.511  -5.136
  719    HB2  ALA  94           1HB      ALA  94  -0.798  12.381  -6.641
  720    HB3  ALA  94           2HB      ALA  94  -1.792  10.985  -6.236
  721    H    GLU  95           H        GLU  95  -3.539  14.923  -4.769
  722    HA   GLU  95           HA       GLU  95  -1.134  16.597  -4.667
  723    HB2  GLU  95           2HB      GLU  95  -3.469  16.903  -6.529
  724    HB3  GLU  95           1HB      GLU  95  -2.553  18.313  -6.016
  725    HG2  GLU  95           2HG      GLU  95  -0.558  17.478  -6.997
  726    HG3  GLU  95           1HG      GLU  95  -1.296  15.905  -7.299
  727    H    SER  96           H        SER  96  -2.587  15.741  -2.477
  728    HA   SER  96           HA       SER  96  -3.677  18.289  -1.526
  729    HG   SER  96           HG       SER  96  -4.367  14.878  -0.904
  730    HB2  SER  96           2HB      SER  96  -5.442  16.926  -0.265
  731    HB3  SER  96           1HB      SER  96  -5.686  17.127  -2.001
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1   6.796  13.196  -4.952
    2    HB2  MET   1           2HB      MET   1   7.359  12.847  -2.646
    3    HB3  MET   1           1HB      MET   1   8.729  13.596  -3.457
    4    HG2  MET   1           2HG      MET   1   8.684  15.377  -2.121
    5    HG3  MET   1           1HG      MET   1   6.936  15.540  -2.244
    6    HE1  MET   1           3HE      MET   1   9.490  15.469   0.227
    7    HE2  MET   1           1HE      MET   1   9.921  13.868  -0.374
    8    HE3  MET   1           2HE      MET   1   9.285  14.055   1.260
    9    H    PHE   2           H        PHE   2   4.750  13.530  -5.557
   10    HA   PHE   2           HA       PHE   2   2.936  15.167  -3.994
   11    HD1  PHE   2           2HD      PHE   2   3.475  16.619  -6.280
   12    HD2  PHE   2           1HD      PHE   2   2.848  12.781  -8.020
   13    HE1  PHE   2           2HE      PHE   2   4.799  17.294  -8.240
   14    HE2  PHE   2           1HE      PHE   2   4.164  13.456  -9.982
   15    HZ   PHE   2           HZ       PHE   2   5.144  15.712 -10.095
   16    HB2  PHE   2           2HB      PHE   2   1.861  13.263  -6.013
   17    HB3  PHE   2           1HB      PHE   2   1.440  14.946  -5.731
   18    H    ARG   3           H        ARG   3   0.748  13.998  -3.294
   19    HA   ARG   3           HA       ARG   3   1.287  11.255  -2.507
   20    HE   ARG   3           HE       ARG   3   4.402  10.631   1.614
   21    HB2  ARG   3           2HB      ARG   3   1.806  13.331  -0.682
   22    HB3  ARG   3           1HB      ARG   3   0.304  12.583  -0.148
   23    HG2  ARG   3           2HG      ARG   3   1.590  11.076   0.849
   24    HG3  ARG   3           1HG      ARG   3   1.882  10.429  -0.750
   25    HD2  ARG   3           2HD      ARG   3   4.030  10.970  -0.624
   26    HD3  ARG   3           1HD      ARG   3   3.625  12.651  -0.286
   27   HH11  ARG   3          1HH1      ARG   3   2.780  13.690   1.169
   28   HH12  ARG   3          2HH1      ARG   3   3.004  14.189   2.812
   29   HH21  ARG   3          1HH2      ARG   3   4.696  11.286   3.775
   30   HH22  ARG   3          2HH2      ARG   3   4.092  12.826   4.291
   31    H    SER   4           H        SER   4  -0.421  10.042  -2.711
   32    HA   SER   4           HA       SER   4  -3.120  11.210  -2.602
   33    HG   SER   4           HG       SER   4  -4.478   8.870  -4.557
   34    HB2  SER   4           2HB      SER   4  -3.109  10.426  -4.773
   35    HB3  SER   4           1HB      SER   4  -1.836   9.245  -4.447
   36    H    THR   5           H        THR   5  -4.805   9.552  -1.867
   37    HA   THR   5           HA       THR   5  -3.667   7.453  -0.217
   38    HB   THR   5           HB       THR   5  -4.723   8.130   1.832
   39    HG1  THR   5           1HG      THR   5  -5.697  10.412   0.470
   40   HG21  THR   5          3HG2      THR   5  -2.542   9.350   1.092
   41   HG22  THR   5          1HG2      THR   5  -3.444   9.907   2.497
   42   HG23  THR   5          2HG2      THR   5  -3.604  10.751   0.960
   43    H    SER   6           H        SER   6  -4.777   5.651  -0.334
   44    HA   SER   6           HA       SER   6  -7.586   5.795  -1.227
   45    HG   SER   6           HG       SER   6  -7.485   3.123  -3.168
   46    HB2  SER   6           2HB      SER   6  -5.997   4.578  -2.726
   47    HB3  SER   6           1HB      SER   6  -5.698   3.435  -1.417
   48    H    HIS   7           H        HIS   7  -9.153   5.116   0.116
   49    HA   HIS   7           HA       HIS   7  -8.347   3.657   2.554
   50    HD1  HIS   7           1HD      HIS   7 -10.070   6.750   5.054
   51    HD2  HIS   7           2HD      HIS   7 -10.120   2.645   4.408
   52    HE1  HIS   7           1HE      HIS   7 -10.325   5.712   7.330
   53    HE2  HIS   7           2HE      HIS   7 -10.445   3.233   6.904
   54    HB2  HIS   7           2HB      HIS   7  -9.327   6.061   2.692
   55    HB3  HIS   7           1HB      HIS   7 -10.866   5.281   2.353
   56    H    VAL   8           H        VAL   8  -9.234   1.701   2.948
   57    HA   VAL   8           HA       VAL   8 -11.731   0.960   1.596
   58    HB   VAL   8           HB       VAL   8  -9.483  -1.025   1.673
   59   HG11  VAL   8          1HG1      VAL   8 -10.694  -2.093  -0.099
   60   HG12  VAL   8          2HG1      VAL   8 -11.799  -0.727  -0.232
   61   HG13  VAL   8          3HG1      VAL   8 -11.817  -1.738   1.212
   62   HG21  VAL   8          3HG2      VAL   8  -8.676   1.035   0.503
   63   HG22  VAL   8          1HG2      VAL   8  -9.981   0.814  -0.661
   64   HG23  VAL   8          2HG2      VAL   8  -8.723  -0.410  -0.503
   65    H    ARG   9           H        ARG   9 -12.864  -0.822   2.614
   66    HA   ARG   9           HA       ARG   9 -12.084  -1.107   5.428
   67    HE   ARG   9           HE       ARG   9 -15.467   0.542   3.583
   68    HB2  ARG   9           2HB      ARG   9 -14.700  -1.248   4.015
   69    HB3  ARG   9           1HB      ARG   9 -14.490  -2.243   5.447
   70    HG2  ARG   9           2HG      ARG   9 -15.482  -0.173   6.100
   71    HG3  ARG   9           1HG      ARG   9 -13.823  -0.216   6.703
   72    HD2  ARG   9           2HD      ARG   9 -14.514   1.968   5.700
   73    HD3  ARG   9           1HD      ARG   9 -13.075   1.248   4.981
   74   HH11  ARG   9          1HH1      ARG   9 -13.060   3.040   3.965
   75   HH12  ARG   9          2HH1      ARG   9 -13.304   3.692   2.379
   76   HH21  ARG   9          1HH2      ARG   9 -15.789   1.399   1.497
   77   HH22  ARG   9          2HH2      ARG   9 -14.854   2.761   0.978
   78    H    THR  10           H        THR  10 -10.752  -2.783   5.715
   79    HA   THR  10           HA       THR  10 -11.555  -5.391   4.618
   80    HB   THR  10           HB       THR  10  -9.300  -3.941   3.845
   81    HG1  THR  10           1HG      THR  10 -10.477  -5.683   2.775
   82   HG21  THR  10          3HG2      THR  10  -8.412  -4.980   6.116
   83   HG22  THR  10          1HG2      THR  10  -7.408  -4.854   4.666
   84   HG23  THR  10          2HG2      THR  10  -8.187  -6.386   5.069
   85    H    GLU  11           H        GLU  11 -10.794  -7.263   5.852
   86    HA   GLU  11           HA       GLU  11 -10.475  -6.593   8.700
   87    HB2  GLU  11           2HB      GLU  11 -12.153  -8.435   7.328
   88    HB3  GLU  11           1HB      GLU  11 -11.047  -9.360   8.335
   89    HG2  GLU  11           2HG      GLU  11 -12.126  -8.796  10.184
   90    HG3  GLU  11           1HG      GLU  11 -12.100  -7.086   9.755
   91    H    SER  12           H        SER  12  -8.870  -7.559   9.969
   92    HA   SER  12           HA       SER  12  -6.834  -8.425  10.456
   93    HG   SER  12           HG       SER  12  -5.486 -10.681   8.336
   94    HB2  SER  12           2HB      SER  12  -7.775 -10.554   9.924
   95    HB3  SER  12           1HB      SER  12  -7.586 -10.275   8.191
   96    H    ALA  13           H        ALA  13  -7.141  -6.282   8.441
   97    HA   ALA  13           HA       ALA  13  -5.385  -6.384   6.315
   98    HB1  ALA  13           3HB      ALA  13  -6.887  -4.490   6.905
   99    HB2  ALA  13           1HB      ALA  13  -5.267  -4.017   6.402
  100    HB3  ALA  13           2HB      ALA  13  -5.695  -4.024   8.105
  101    H    ALA  14           H        ALA  14  -4.559  -5.265   9.581
  102    HA   ALA  14           HA       ALA  14  -1.959  -4.564   9.313
  103    HB1  ALA  14           3HB      ALA  14  -3.029  -6.184  11.614
  104    HB2  ALA  14           1HB      ALA  14  -3.241  -4.446  11.391
  105    HB3  ALA  14           2HB      ALA  14  -1.627  -5.114  11.636
  106    H    ARG  15           H        ARG  15  -3.082  -7.850   8.990
  107    HA   ARG  15           HA       ARG  15  -0.498  -9.028   9.441
  108    HE   ARG  15           HE       ARG  15   0.860 -13.440   8.780
  109    HB2  ARG  15           2HB      ARG  15  -2.919 -10.070   9.610
  110    HB3  ARG  15           1HB      ARG  15  -2.632 -10.436   7.918
  111    HG2  ARG  15           2HG      ARG  15  -1.310 -11.523  10.340
  112    HG3  ARG  15           1HG      ARG  15  -1.909 -12.353   8.906
  113    HD2  ARG  15           2HD      ARG  15  -0.019 -11.643   7.618
  114    HD3  ARG  15           1HD      ARG  15   0.519 -10.566   8.903
  115   HH11  ARG  15          1HH1      ARG  15   0.993 -10.564  10.758
  116   HH12  ARG  15          2HH1      ARG  15   2.051 -11.273  11.930
  117   HH21  ARG  15          1HH2      ARG  15   2.248 -14.369  10.324
  118   HH22  ARG  15          2HH2      ARG  15   2.764 -13.430  11.685
  119    H    TYR  16           H        TYR  16  -2.403  -8.242   6.540
  120    HA   TYR  16           HA       TYR  16  -0.525  -9.409   4.776
  121    HD1  TYR  16           1HD      TYR  16  -2.205 -10.802   4.684
  122    HD2  TYR  16           2HD      TYR  16  -4.625  -7.547   3.378
  123    HE1  TYR  16           1HE      TYR  16  -4.181 -12.240   4.770
  124    HE2  TYR  16           2HE      TYR  16  -6.609  -8.988   3.471
  125    HH   TYR  16           HH       TYR  16  -6.656 -12.058   3.385
  126    HB2  TYR  16           2HB      TYR  16  -2.406  -7.125   4.131
  127    HB3  TYR  16           1HB      TYR  16  -1.631  -8.205   2.983
  128    H    VAL  17           H        VAL  17  -0.831  -6.205   6.200
  129    HA   VAL  17           HA       VAL  17   1.223  -4.960   4.716
  130    HB   VAL  17           HB       VAL  17   0.038  -4.397   7.410
  131   HG11  VAL  17          1HG1      VAL  17   2.748  -3.625   6.590
  132   HG12  VAL  17          2HG1      VAL  17   1.991  -3.574   8.184
  133   HG13  VAL  17          3HG1      VAL  17   1.717  -2.270   7.036
  134   HG21  VAL  17          3HG2      VAL  17  -0.563  -2.321   6.397
  135   HG22  VAL  17          1HG2      VAL  17  -1.002  -3.630   5.298
  136   HG23  VAL  17          2HG2      VAL  17   0.443  -2.665   4.993
  137    H    ASN  18           H        ASN  18   1.265  -6.848   7.704
  138    HA   ASN  18           HA       ASN  18   4.089  -6.671   8.024
  139    HB2  ASN  18           2HB      ASN  18   2.185  -8.702   9.201
  140    HB3  ASN  18           1HB      ASN  18   3.809  -8.335   9.775
  141   HD21  ASN  18          1HD2      ASN  18   1.345  -8.207  11.242
  142   HD22  ASN  18          2HD2      ASN  18   1.158  -6.571  11.768
  143    H    ARG  19           H        ARG  19   1.931  -8.907   6.335
  144    HA   ARG  19           HA       ARG  19   4.020 -10.854   5.952
  145    HE   ARG  19           HE       ARG  19   2.516 -15.215   5.881
  146    HB2  ARG  19           2HB      ARG  19   1.306 -10.994   5.967
  147    HB3  ARG  19           1HB      ARG  19   1.636 -11.015   4.239
  148    HG2  ARG  19           2HG      ARG  19   2.133 -13.162   4.369
  149    HG3  ARG  19           1HG      ARG  19   3.464 -12.777   5.460
  150    HD2  ARG  19           2HD      ARG  19   2.128 -13.075   7.368
  151    HD3  ARG  19           1HD      ARG  19   0.638 -13.060   6.424
  152   HH11  ARG  19          1HH1      ARG  19  -0.410 -14.190   7.496
  153   HH12  ARG  19          2HH1      ARG  19  -0.995 -15.803   7.718
  154   HH21  ARG  19          1HH2      ARG  19   1.740 -17.331   6.176
  155   HH22  ARG  19          2HH2      ARG  19   0.223 -17.584   6.971
  156    H    LEU  20           H        LEU  20   2.938  -8.058   4.226
  157    HA   LEU  20           HA       LEU  20   3.762  -8.858   1.637
  158    HG   LEU  20           HG       LEU  20   1.268  -6.991   2.787
  159    HB2  LEU  20           2HB      LEU  20   3.438  -6.105   2.816
  160    HB3  LEU  20           1HB      LEU  20   3.700  -6.429   1.116
  161   HD11  LEU  20          1HD1      LEU  20   2.041  -5.216   0.579
  162   HD12  LEU  20          2HD1      LEU  20   0.794  -5.015   1.812
  163   HD13  LEU  20          3HD1      LEU  20   0.471  -5.993   0.381
  164   HD21  LEU  20          3HD2      LEU  20   0.355  -8.120   0.699
  165   HD22  LEU  20          1HD2      LEU  20   1.485  -9.061   1.668
  166   HD23  LEU  20          2HD2      LEU  20   2.027  -8.294   0.175
  167    H    CYS  21           H        CYS  21   5.373  -6.932   4.160
  168    HA   CYS  21           HA       CYS  21   7.688  -6.313   2.740
  169    HG   CYS  21           HG       CYS  21   8.062  -7.393   6.840
  170    HB2  CYS  21           2HB      CYS  21   8.778  -6.053   4.938
  171    HB3  CYS  21           1HB      CYS  21   7.181  -5.313   4.916
  172    H    LYS  22           H        LYS  22   6.859  -9.181   4.603
  173    HA   LYS  22           HA       LYS  22   9.410 -10.439   4.199
  174    HB2  LYS  22           2HB      LYS  22   6.779 -11.600   5.131
  175    HB3  LYS  22           1HB      LYS  22   8.334 -12.419   5.196
  176    HG2  LYS  22           2HG      LYS  22   8.946 -11.360   7.068
  177    HG3  LYS  22           1HG      LYS  22   8.328  -9.804   6.510
  178    HD2  LYS  22           2HD      LYS  22   7.014 -10.375   8.386
  179    HD3  LYS  22           1HD      LYS  22   6.008 -10.726   6.979
  180    HE2  LYS  22           2HE      LYS  22   5.754 -12.566   8.418
  181    HE3  LYS  22           1HE      LYS  22   6.843 -13.100   7.137
  182    HZ1  LYS  22           3HZ      LYS  22   7.377 -12.659   9.969
  183    HZ2  LYS  22           1HZ      LYS  22   8.612 -12.234   8.892
  184    HZ3  LYS  22           2HZ      LYS  22   8.017 -13.817   8.915
  185    H    HIS  23           H        HIS  23   6.505 -10.117   2.421
  186    HA   HIS  23           HA       HIS  23   6.887 -12.490   0.820
  187    HD1  HIS  23           1HD      HIS  23   5.370 -11.114  -2.269
  188    HD2  HIS  23           2HD      HIS  23   3.533 -13.752   0.362
  189    HE1  HIS  23           1HE      HIS  23   4.281 -12.858  -3.717
  190    HE2  HIS  23           2HE      HIS  23   3.254 -14.495  -2.099
  191    HB2  HIS  23           2HB      HIS  23   4.629 -11.503   1.429
  192    HB3  HIS  23           1HB      HIS  23   4.971 -10.230   0.263
  193    H    TRP  24           H        TRP  24   6.637  -9.010  -0.063
  194    HA   TRP  24           HA       TRP  24   8.025  -9.560  -2.545
  195    HD1  TRP  24           HD       TRP  24   4.441  -6.777  -1.659
  196    HE1  TRP  24           1HE      TRP  24   2.654  -7.903  -3.131
  197    HE3  TRP  24           3HE      TRP  24   7.475  -9.803  -4.448
  198    HZ2  TRP  24           2HZ      TRP  24   2.546  -9.820  -5.200
  199    HZ3  TRP  24           3HZ      TRP  24   6.450 -11.251  -6.153
  200    HH2  TRP  24           HH       TRP  24   4.036 -11.259  -6.519
  201    HB2  TRP  24           2HB      TRP  24   6.964  -6.996  -1.350
  202    HB3  TRP  24           1HB      TRP  24   7.709  -7.117  -2.941
  203    H    GLY  25           H        GLY  25   9.043  -8.869   0.622
  204    HA2  GLY  25           2HA      GLY  25  11.229  -7.143   0.058
  205    HA3  GLY  25           1HA      GLY  25  11.028  -8.116   1.503
  206    H    HIS  26           H        HIS  26  11.750  -8.561  -1.954
  207    HA   HIS  26           HA       HIS  26  13.725 -10.601  -1.178
  208    HD1  HIS  26           1HD      HIS  26  11.489 -13.359  -3.173
  209    HD2  HIS  26           2HD      HIS  26  15.442 -12.091  -2.986
  210    HE1  HIS  26           1HE      HIS  26  12.870 -15.460  -3.173
  211    HE2  HIS  26           2HE      HIS  26  15.261 -14.666  -3.143
  212    HB2  HIS  26           2HB      HIS  26  11.660 -10.904  -2.918
  213    HB3  HIS  26           1HB      HIS  26  12.936 -10.394  -4.019
  214    H    LYS  27           H        LYS  27  13.177  -7.625  -2.908
  215    HA   LYS  27           HA       LYS  27  16.046  -7.136  -2.997
  216    HB2  LYS  27           2HB      LYS  27  15.758  -8.293  -5.100
  217    HB3  LYS  27           1HB      LYS  27  14.349  -7.326  -5.499
  218    HG2  LYS  27           2HG      LYS  27  16.702  -5.680  -5.055
  219    HG3  LYS  27           1HG      LYS  27  16.950  -6.883  -6.321
  220    HD2  LYS  27           2HD      LYS  27  14.444  -5.257  -6.297
  221    HD3  LYS  27           1HD      LYS  27  15.938  -4.546  -6.905
  222    HE2  LYS  27           2HE      LYS  27  15.724  -7.119  -8.047
  223    HE3  LYS  27           1HE      LYS  27  14.142  -6.355  -8.201
  224    HZ1  LYS  27           3HZ      LYS  27  15.280  -4.414  -9.185
  225    HZ2  LYS  27           1HZ      LYS  27  15.454  -5.823 -10.108
  226    HZ3  LYS  27           2HZ      LYS  27  16.737  -5.273  -9.152
  227    H    PHE  28           H        PHE  28  13.677  -6.040  -1.666
  228    HA   PHE  28           HA       PHE  28  13.997  -3.263  -2.518
  229    HD1  PHE  28           1HD      PHE  28  12.124  -5.279  -4.748
  230    HD2  PHE  28           2HD      PHE  28  11.460  -1.326  -3.313
  231    HE1  PHE  28           1HE      PHE  28  11.894  -4.480  -7.064
  232    HE2  PHE  28           2HE      PHE  28  11.222  -0.527  -5.619
  233    HZ   PHE  28           HZ       PHE  28  11.441  -2.099  -7.503
  234    HB2  PHE  28           2HB      PHE  28  11.463  -4.816  -2.403
  235    HB3  PHE  28           1HB      PHE  28  11.416  -3.156  -1.819
  236    H    GLU  29           H        GLU  29  13.734  -1.730  -0.866
  237    HA   GLU  29           HA       GLU  29  14.340  -2.697   1.763
  238    HB2  GLU  29           2HB      GLU  29  14.039  -0.180   2.324
  239    HB3  GLU  29           1HB      GLU  29  15.391  -0.668   1.312
  240    HG2  GLU  29           2HG      GLU  29  12.913   0.023  -0.113
  241    HG3  GLU  29           1HG      GLU  29  13.719   1.348   0.728
  242    H    VAL  30           H        VAL  30  12.587  -3.914   2.443
  243    HA   VAL  30           HA       VAL  30  10.017  -2.520   2.682
  244    HB   VAL  30           HB       VAL  30   9.277  -4.945   3.386
  245   HG11  VAL  30          1HG1      VAL  30   9.783  -3.926   0.612
  246   HG12  VAL  30          2HG1      VAL  30   8.270  -3.994   1.516
  247   HG13  VAL  30          3HG1      VAL  30   8.992  -5.475   0.901
  248   HG21  VAL  30          3HG2      VAL  30  10.546  -6.717   2.698
  249   HG22  VAL  30          1HG2      VAL  30  11.814  -5.593   3.185
  250   HG23  VAL  30          2HG2      VAL  30  11.406  -5.776   1.478
  251    H    GLU  31           H        GLU  31   9.601  -1.600   4.581
  252    HA   GLU  31           HA       GLU  31  10.866  -2.656   6.999
  253    HB2  GLU  31           2HB      GLU  31  10.304  -0.054   6.091
  254    HB3  GLU  31           1HB      GLU  31   9.212  -0.327   7.442
  255    HG2  GLU  31           2HG      GLU  31  11.013  -0.765   8.920
  256    HG3  GLU  31           1HG      GLU  31  12.168  -0.841   7.590
  257    H    LEU  32           H        LEU  32   9.563  -2.962   8.943
  258    HA   LEU  32           HA       LEU  32   6.715  -3.464   8.419
  259    HG   LEU  32           HG       LEU  32   5.876  -6.081   8.474
  260    HB2  LEU  32           2HB      LEU  32   8.163  -5.545   8.189
  261    HB3  LEU  32           1HB      LEU  32   8.442  -5.430   9.912
  262   HD11  LEU  32          1HD1      LEU  32   6.929  -8.057   8.892
  263   HD12  LEU  32          2HD1      LEU  32   6.044  -7.862  10.406
  264   HD13  LEU  32          3HD1      LEU  32   7.756  -7.447  10.325
  265   HD21  LEU  32          3HD2      LEU  32   6.221  -5.128  11.313
  266   HD22  LEU  32          1HD2      LEU  32   4.838  -6.082  10.782
  267   HD23  LEU  32          2HD2      LEU  32   5.135  -4.494  10.077
  268    H    THR  33           H        THR  33   5.707  -2.129   9.770
  269    HA   THR  33           HA       THR  33   6.549  -2.158  12.614
  270    HB   THR  33           HB       THR  33   5.352   0.242  12.451
  271    HG1  THR  33           1HG      THR  33   6.597  -0.075   9.923
  272   HG21  THR  33          3HG2      THR  33   8.198  -0.501  12.012
  273   HG22  THR  33          1HG2      THR  33   7.443   0.338  13.368
  274   HG23  THR  33          2HG2      THR  33   7.705   1.183  11.841
  275    HA   PRO  34           HA       PRO  34   2.369  -3.351  13.343
  276    HB2  PRO  34           2HB      PRO  34   2.269  -1.827  15.823
  277    HB3  PRO  34           1HB      PRO  34   2.306  -3.572  15.581
  278    HG2  PRO  34           2HG      PRO  34   4.385  -2.197  16.613
  279    HG3  PRO  34           1HG      PRO  34   4.597  -3.671  15.660
  280    HD2  PRO  34           2HD      PRO  34   4.913  -0.806  14.823
  281    HD3  PRO  34           1HD      PRO  34   5.919  -2.217  14.424
  282    H    GLU  35           H        GLU  35   2.420  -1.303  11.599
  283    HA   GLU  35           HA       GLU  35  -0.032   0.059  12.114
  284    HB2  GLU  35           2HB      GLU  35   2.560   1.613  12.028
  285    HB3  GLU  35           1HB      GLU  35   0.979   2.350  11.789
  286    HG2  GLU  35           2HG      GLU  35   0.399   1.318  14.072
  287    HG3  GLU  35           1HG      GLU  35   2.142   1.133  14.259
  288    H    ARG  36           H        ARG  36   2.871  -0.278  10.097
  289    HA   ARG  36           HA       ARG  36   1.324  -0.603   7.748
  290    HE   ARG  36           HE       ARG  36   4.040   5.108   7.426
  291    HB2  ARG  36           2HB      ARG  36   2.389   1.446   6.599
  292    HB3  ARG  36           1HB      ARG  36   0.995   1.711   7.631
  293    HG2  ARG  36           2HG      ARG  36   2.618   2.249   9.486
  294    HG3  ARG  36           1HG      ARG  36   3.887   2.235   8.261
  295    HD2  ARG  36           2HD      ARG  36   2.169   3.872   7.052
  296    HD3  ARG  36           1HD      ARG  36   1.703   4.179   8.724
  297   HH11  ARG  36          1HH1      ARG  36   2.885   3.938  10.503
  298   HH12  ARG  36          2HH1      ARG  36   4.077   4.797  11.418
  299   HH21  ARG  36          1HH2      ARG  36   5.609   6.240   8.627
  300   HH22  ARG  36          2HH2      ARG  36   5.624   6.105  10.354
  301    H    GLY  37           H        GLY  37   2.673  -0.593   5.763
  302    HA2  GLY  37           2HA      GLY  37   5.350  -1.664   6.391
  303    HA3  GLY  37           1HA      GLY  37   4.361  -2.202   5.036
  304    H    PHE  38           H        PHE  38   7.120  -0.901   5.155
  305    HA   PHE  38           HA       PHE  38   6.522   1.382   3.377
  306    HD1  PHE  38           2HD      PHE  38   7.221   3.921   3.728
  307    HD2  PHE  38           1HD      PHE  38  10.827   1.685   4.124
  308    HE1  PHE  38           2HE      PHE  38   8.466   5.741   2.659
  309    HE2  PHE  38           1HE      PHE  38  12.071   3.501   3.033
  310    HZ   PHE  38           HZ       PHE  38  10.892   5.531   2.295
  311    HB2  PHE  38           2HB      PHE  38   7.586   2.040   5.493
  312    HB3  PHE  38           1HB      PHE  38   8.906   0.925   5.185
  313    H    ILE  39           H        ILE  39   6.863   0.835   1.336
  314    HA   ILE  39           HA       ILE  39   9.238  -0.830   0.728
  315    HB   ILE  39           HB       ILE  39   6.784  -0.985  -1.000
  316   HG12  ILE  39          2HG1      ILE  39   7.274  -2.465   1.582
  317   HG13  ILE  39          1HG1      ILE  39   5.784  -1.733   0.995
  318   HG21  ILE  39          1HG2      ILE  39   9.367  -1.975  -1.192
  319   HG22  ILE  39          2HG2      ILE  39   7.976  -2.472  -2.153
  320   HG23  ILE  39          3HG2      ILE  39   8.409  -3.369  -0.698
  321   HD11  ILE  39          3HD1      ILE  39   7.044  -4.215  -0.143
  322   HD12  ILE  39          1HD1      ILE  39   5.495  -3.511  -0.604
  323   HD13  ILE  39          2HD1      ILE  39   5.713  -4.181   1.011
  324    H    ASP  40           H        ASP  40  10.601   0.715  -0.115
  325    HA   ASP  40           HA       ASP  40   9.456   2.437  -2.210
  326    HB2  ASP  40           2HB      ASP  40  11.287   4.057  -1.634
  327    HB3  ASP  40           1HB      ASP  40  10.074   3.826  -0.377
  328    H    PHE  41           H        PHE  41  10.473   2.720  -4.073
  329    HA   PHE  41           HA       PHE  41  12.491   0.766  -4.819
  330    HD1  PHE  41           1HD      PHE  41  13.869   0.724  -6.620
  331    HD2  PHE  41           2HD      PHE  41   9.991   0.848  -8.370
  332    HE1  PHE  41           1HE      PHE  41  14.605  -0.854  -8.351
  333    HE2  PHE  41           2HE      PHE  41  10.723  -0.735 -10.105
  334    HZ   PHE  41           HZ       PHE  41  13.033  -1.587 -10.098
  335    HB2  PHE  41           2HB      PHE  41  10.355   1.681  -6.158
  336    HB3  PHE  41           1HB      PHE  41  11.528   2.864  -6.716
  337    H    GLY  42           H        GLY  42  12.450   3.831  -3.544
  338    HA2  GLY  42           2HA      GLY  42  14.860   4.566  -3.132
  339    HA3  GLY  42           1HA      GLY  42  14.932   4.668  -4.887
  340    H    ASP  43           H        ASP  43  14.010   6.406  -5.932
  341    HA   ASP  43           HA       ASP  43  13.607   8.773  -4.415
  342    HB2  ASP  43           2HB      ASP  43  14.410   8.542  -6.860
  343    HB3  ASP  43           1HB      ASP  43  12.702   8.416  -7.269
  344    H    SER  44           H        SER  44  11.537   6.303  -5.678
  345    HA   SER  44           HA       SER  44   9.130   7.768  -4.842
  346    HG   SER  44           HG       SER  44  10.234   6.775  -7.751
  347    HB2  SER  44           2HB      SER  44   8.418   5.348  -6.140
  348    HB3  SER  44           1HB      SER  44   8.281   6.988  -6.775
  349    H    ASN  45           H        ASN  45   7.387   6.251  -3.776
  350    HA   ASN  45           HA       ASN  45   8.542   4.017  -2.335
  351    HB2  ASN  45           2HB      ASN  45   7.276   6.069  -0.579
  352    HB3  ASN  45           1HB      ASN  45   8.502   4.870  -0.191
  353   HD21  ASN  45          1HD2      ASN  45  10.404   5.686   0.246
  354   HD22  ASN  45          2HD2      ASN  45  11.066   7.147  -0.396
  355    H    CYS  46           H        CYS  46   6.867   3.029  -0.803
  356    HA   CYS  46           HA       CYS  46   4.121   3.652  -1.485
  357    HG   CYS  46           HG       CYS  46   6.317   0.651  -3.366
  358    HB2  CYS  46           2HB      CYS  46   4.467   0.794  -1.787
  359    HB3  CYS  46           1HB      CYS  46   3.685   1.949  -2.858
  360    H    GLU  47           H        GLU  47   3.474   3.951   0.560
  361    HA   GLU  47           HA       GLU  47   4.186   1.977   2.596
  362    HB2  GLU  47           2HB      GLU  47   4.331   4.636   2.730
  363    HB3  GLU  47           1HB      GLU  47   2.660   4.461   3.243
  364    HG2  GLU  47           2HG      GLU  47   3.234   3.588   5.255
  365    HG3  GLU  47           1HG      GLU  47   4.668   2.774   4.629
  366    H    LEU  48           H        LEU  48   2.503   1.113   4.016
  367    HA   LEU  48           HA       LEU  48  -0.224   1.335   2.962
  368    HG   LEU  48           HG       LEU  48  -0.891  -1.980   3.879
  369    HB2  LEU  48           2HB      LEU  48   0.718  -0.573   1.781
  370    HB3  LEU  48           1HB      LEU  48   1.249  -1.293   3.286
  371   HD11  LEU  48          1HD1      LEU  48  -2.908  -1.158   2.479
  372   HD12  LEU  48          2HD1      LEU  48  -1.856   0.194   2.068
  373   HD13  LEU  48          3HD1      LEU  48  -2.262  -0.127   3.755
  374   HD21  LEU  48          3HD2      LEU  48  -0.451  -2.196   0.933
  375   HD22  LEU  48          1HD2      LEU  48  -1.914  -2.853   1.664
  376   HD23  LEU  48          2HD2      LEU  48  -0.333  -3.434   2.182
  377    H    LEU  49           H        LEU  49  -1.594   1.694   4.563
  378    HA   LEU  49           HA       LEU  49  -0.801   0.993   7.306
  379    HG   LEU  49           HG       LEU  49  -2.018   1.930   9.069
  380    HB2  LEU  49           2HB      LEU  49  -1.724   3.320   6.556
  381    HB3  LEU  49           1HB      LEU  49  -3.279   2.515   6.605
  382   HD11  LEU  49          1HD1      LEU  49  -2.176   4.810   9.191
  383   HD12  LEU  49          2HD1      LEU  49  -0.922   4.282   8.068
  384   HD13  LEU  49          3HD1      LEU  49  -0.900   3.724   9.742
  385   HD21  LEU  49          3HD2      LEU  49  -3.883   3.293   9.963
  386   HD22  LEU  49          1HD2      LEU  49  -4.399   2.106   8.764
  387   HD23  LEU  49          2HD2      LEU  49  -4.257   3.806   8.318
  388    H    ALA  50           H        ALA  50  -1.798  -0.616   8.427
  389    HA   ALA  50           HA       ALA  50  -4.308  -1.658   7.360
  390    HB1  ALA  50           3HB      ALA  50  -1.868  -3.368   7.752
  391    HB2  ALA  50           1HB      ALA  50  -2.551  -2.864   6.207
  392    HB3  ALA  50           2HB      ALA  50  -3.468  -3.921   7.265
  393    H    HIS  51           H        HIS  51  -5.670  -1.691   8.974
  394    HA   HIS  51           HA       HIS  51  -4.748  -2.576  11.592
  395    HD1  HIS  51           1HD      HIS  51  -7.754  -0.108  13.746
  396    HD2  HIS  51           2HD      HIS  51  -3.818  -1.358  13.263
  397    HE1  HIS  51           1HE      HIS  51  -6.689   0.134  16.008
  398    HE2  HIS  51           2HE      HIS  51  -4.334  -0.708  15.711
  399    HB2  HIS  51           2HB      HIS  51  -5.969  -0.180  10.998
  400    HB3  HIS  51           1HB      HIS  51  -7.335  -1.169  11.493
  401    HA   PRO  52           HA       PRO  52  -7.234  -6.184  11.736
  402    HB2  PRO  52           2HB      PRO  52  -8.975  -4.817  13.749
  403    HB3  PRO  52           1HB      PRO  52  -8.256  -6.433  13.790
  404    HG2  PRO  52           2HG      PRO  52  -7.162  -4.461  15.175
  405    HG3  PRO  52           1HG      PRO  52  -6.140  -5.622  14.310
  406    HD2  PRO  52           2HD      PRO  52  -6.800  -2.799  13.619
  407    HD3  PRO  52           1HD      PRO  52  -5.305  -3.705  13.333
  408    H    ASP  53           H        ASP  53  -8.925  -3.155  11.149
  409    HA   ASP  53           HA       ASP  53 -10.843  -4.694   9.577
  410    HB2  ASP  53           2HB      ASP  53 -11.821  -2.451  11.335
  411    HB3  ASP  53           1HB      ASP  53 -12.770  -3.659  10.476
  412    H    HIS  54           H        HIS  54  -8.668  -2.207   9.510
  413    HA   HIS  54           HA       HIS  54  -9.960  -1.254   7.097
  414    HD1  HIS  54           1HD      HIS  54 -10.246   0.316  11.155
  415    HD2  HIS  54           2HD      HIS  54  -7.099   1.784   8.873
  416    HE1  HIS  54           1HE      HIS  54  -8.625   1.303  12.803
  417    HE2  HIS  54           2HE      HIS  54  -6.678   2.087  11.408
  418    HB2  HIS  54           2HB      HIS  54  -9.560   1.133   7.617
  419    HB3  HIS  54           1HB      HIS  54 -10.751   0.381   8.661
  420    H    VAL  55           H        VAL  55  -8.523  -0.084   5.618
  421    HA   VAL  55           HA       VAL  55  -5.681  -0.369   6.216
  422    HB   VAL  55           HB       VAL  55  -6.776  -2.347   4.858
  423   HG11  VAL  55          1HG1      VAL  55  -7.000  -2.120   2.578
  424   HG12  VAL  55          2HG1      VAL  55  -5.981  -0.682   2.516
  425   HG13  VAL  55          3HG1      VAL  55  -7.623  -0.572   3.151
  426   HG21  VAL  55          3HG2      VAL  55  -4.398  -2.095   5.426
  427   HG22  VAL  55          1HG2      VAL  55  -4.181  -1.104   3.983
  428   HG23  VAL  55          2HG2      VAL  55  -4.645  -2.798   3.827
  429    H    LEU  56           H        LEU  56  -4.434   1.194   5.351
  430    HA   LEU  56           HA       LEU  56  -5.748   3.150   3.574
  431    HG   LEU  56           HG       LEU  56  -6.534   4.698   5.565
  432    HB2  LEU  56           2HB      LEU  56  -4.461   3.525   6.135
  433    HB3  LEU  56           1HB      LEU  56  -3.595   4.419   4.908
  434   HD11  LEU  56          1HD1      LEU  56  -6.005   6.711   6.648
  435   HD12  LEU  56          2HD1      LEU  56  -4.356   6.714   6.025
  436   HD13  LEU  56          3HD1      LEU  56  -4.835   5.537   7.249
  437   HD21  LEU  56          3HD2      LEU  56  -4.829   5.802   3.395
  438   HD22  LEU  56          1HD2      LEU  56  -5.979   6.895   4.162
  439   HD23  LEU  56          2HD2      LEU  56  -6.551   5.415   3.398
  440    H    MET  57           H        MET  57  -4.551   3.959   1.868
  441    HA   MET  57           HA       MET  57  -1.926   2.700   1.458
  442    HB2  MET  57           2HB      MET  57  -3.811   3.275  -0.805
  443    HB3  MET  57           1HB      MET  57  -2.416   2.203  -0.779
  444    HG2  MET  57           2HG      MET  57  -3.586   0.683   0.731
  445    HG3  MET  57           1HG      MET  57  -4.982   1.764   0.730
  446    HE1  MET  57           3HE      MET  57  -6.813   1.758  -0.872
  447    HE2  MET  57           1HE      MET  57  -6.841   0.138  -0.176
  448    HE3  MET  57           2HE      MET  57  -7.097   0.358  -1.907
  449    H    ILE  58           H        ILE  58  -0.386   4.227   1.506
  450    HA   ILE  58           HA       ILE  58  -0.959   6.790   0.185
  451    HB   ILE  58           HB       ILE  58   0.812   6.385   2.601
  452   HG12  ILE  58          2HG1      ILE  58  -2.036   6.654   2.453
  453   HG13  ILE  58          1HG1      ILE  58  -1.026   6.524   3.879
  454   HG21  ILE  58          1HG2      ILE  58  -0.105   8.908   1.240
  455   HG22  ILE  58          2HG2      ILE  58   1.501   8.188   1.100
  456   HG23  ILE  58          3HG2      ILE  58   0.945   8.804   2.655
  457   HD11  ILE  58          3HD1      ILE  58  -1.343   9.163   2.515
  458   HD12  ILE  58          1HD1      ILE  58  -0.948   8.805   4.196
  459   HD13  ILE  58          2HD1      ILE  58  -2.590   8.557   3.606
  460    H    LEU  59           H        LEU  59   0.582   7.525  -1.220
  461    HA   LEU  59           HA       LEU  59   3.041   5.920  -1.416
  462    HG   LEU  59           HG       LEU  59   1.316   7.031  -5.160
  463    HB2  LEU  59           2HB      LEU  59   2.964   5.908  -3.740
  464    HB3  LEU  59           1HB      LEU  59   1.317   5.569  -3.255
  465   HD11  LEU  59          1HD1      LEU  59   0.576   8.550  -2.681
  466   HD12  LEU  59          2HD1      LEU  59  -0.424   7.341  -3.486
  467   HD13  LEU  59          3HD1      LEU  59  -0.026   8.851  -4.308
  468   HD21  LEU  59          3HD2      LEU  59   3.622   8.096  -4.245
  469   HD22  LEU  59          1HD2      LEU  59   2.476   9.364  -3.820
  470   HD23  LEU  59          2HD2      LEU  59   2.611   8.825  -5.488
  471    H    ASN  60           H        ASN  60   4.941   6.939  -1.956
  472    HA   ASN  60           HA       ASN  60   4.829   9.890  -1.986
  473    HB2  ASN  60           2HB      ASN  60   6.012   8.373   0.022
  474    HB3  ASN  60           1HB      ASN  60   7.365   8.789  -1.028
  475   HD21  ASN  60          1HD2      ASN  60   6.855   9.673   1.661
  476   HD22  ASN  60          2HD2      ASN  60   6.736  11.394   1.604
  477    H    SER  61           H        SER  61   5.097  10.304  -4.101
  478    HA   SER  61           HA       SER  61   7.597   9.320  -5.307
  479    HG   SER  61           HG       SER  61   5.628   7.345  -5.052
  480    HB2  SER  61           2HB      SER  61   5.306   9.222  -7.152
  481    HB3  SER  61           1HB      SER  61   6.675   8.127  -6.991
  482    HA   PRO  62           HA       PRO  62   7.913  13.521  -6.715
  483    HB2  PRO  62           2HB      PRO  62   9.894  13.109  -8.518
  484    HB3  PRO  62           1HB      PRO  62  10.139  13.165  -6.772
  485    HG2  PRO  62           2HG      PRO  62   9.841  10.765  -8.542
  486    HG3  PRO  62           1HG      PRO  62  11.039  11.071  -7.268
  487    HD2  PRO  62           2HD      PRO  62   8.891   9.554  -6.816
  488    HD3  PRO  62           1HD      PRO  62   9.519  10.647  -5.571
  489    H    ASP  63           H        ASP  63   6.802  10.930  -8.670
  490    HA   ASP  63           HA       ASP  63   5.827  12.898 -10.594
  491    HB2  ASP  63           2HB      ASP  63   7.696  12.177 -11.807
  492    HB3  ASP  63           1HB      ASP  63   7.532  10.514 -11.261
  493    H    GLU  64           H        GLU  64   3.842  12.303 -11.622
  494    HA   GLU  64           HA       GLU  64   2.155  10.655 -10.045
  495    HB2  GLU  64           2HB      GLU  64   1.795  11.973 -12.708
  496    HB3  GLU  64           1HB      GLU  64   0.708  10.663 -12.282
  497    HG2  GLU  64           2HG      GLU  64  -0.463  12.394 -11.422
  498    HG3  GLU  64           1HG      GLU  64   0.525  11.986 -10.015
  499    H    ASP  65           H        ASP  65   3.874   9.871 -13.094
  500    HA   ASP  65           HA       ASP  65   2.799   7.391 -13.632
  501    HB2  ASP  65           2HB      ASP  65   4.639   8.585 -14.903
  502    HB3  ASP  65           1HB      ASP  65   5.759   7.986 -13.683
  503    H    SER  66           H        SER  66   5.546   8.132 -11.530
  504    HA   SER  66           HA       SER  66   5.836   5.574 -10.383
  505    HG   SER  66           HG       SER  66   8.265   7.972 -10.564
  506    HB2  SER  66           2HB      SER  66   6.567   8.336  -9.403
  507    HB3  SER  66           1HB      SER  66   6.978   6.870  -8.512
  508    H    LEU  67           H        LEU  67   4.387   8.516  -9.144
  509    HA   LEU  67           HA       LEU  67   3.241   7.841  -6.810
  510    HG   LEU  67           HG       LEU  67   1.000   9.563  -6.362
  511    HB2  LEU  67           2HB      LEU  67   3.077  10.052  -7.599
  512    HB3  LEU  67           1HB      LEU  67   2.291   9.564  -9.069
  513   HD11  LEU  67          1HD1      LEU  67   1.438  11.644  -8.309
  514   HD12  LEU  67          2HD1      LEU  67   0.885  11.749  -6.639
  515   HD13  LEU  67          3HD1      LEU  67  -0.267  11.413  -7.930
  516   HD21  LEU  67          3HD2      LEU  67   0.051   8.793  -9.074
  517   HD22  LEU  67          1HD2      LEU  67  -1.074   9.549  -7.948
  518   HD23  LEU  67          2HD2      LEU  67  -0.280   8.037  -7.515
  519    H    ALA  68           H        ALA  68   1.459   7.487  -9.900
  520    HA   ALA  68           HA       ALA  68  -0.645   6.017  -8.699
  521    HB1  ALA  68           3HB      ALA  68   0.223   6.540 -11.514
  522    HB2  ALA  68           1HB      ALA  68  -1.287   6.958 -10.705
  523    HB3  ALA  68           2HB      ALA  68  -0.985   5.294 -11.203
  524    H    HIS  69           H        HIS  69   2.408   5.099 -10.186
  525    HA   HIS  69           HA       HIS  69   1.988   2.363 -10.508
  526    HD1  HIS  69           1HD      HIS  69   3.173   0.477  -9.882
  527    HD2  HIS  69           2HD      HIS  69   6.454   2.191 -11.768
  528    HE1  HIS  69           1HE      HIS  69   4.579  -1.453 -10.672
  529    HE2  HIS  69           2HE      HIS  69   6.511  -0.391 -11.889
  530    HB2  HIS  69           2HB      HIS  69   4.003   3.729 -11.254
  531    HB3  HIS  69           1HB      HIS  69   4.597   3.582  -9.604
  532    H    MET  70           H        MET  70   2.835   4.255  -7.684
  533    HA   MET  70           HA       MET  70   3.225   1.945  -5.992
  534    HB2  MET  70           2HB      MET  70   2.729   4.635  -4.820
  535    HB3  MET  70           1HB      MET  70   3.883   3.415  -4.321
  536    HG2  MET  70           2HG      MET  70   4.248   4.938  -6.863
  537    HG3  MET  70           1HG      MET  70   4.750   5.594  -5.316
  538    HE1  MET  70           3HE      MET  70   4.935   2.634  -7.725
  539    HE2  MET  70           1HE      MET  70   6.644   2.197  -7.694
  540    HE3  MET  70           2HE      MET  70   6.144   3.754  -8.353
  541    H    GLN  71           H        GLN  71   0.776   4.596  -5.973
  542    HA   GLN  71           HA       GLN  71  -0.873   3.466  -4.068
  543    HB2  GLN  71           2HB      GLN  71  -2.761   4.743  -5.371
  544    HB3  GLN  71           1HB      GLN  71  -1.548   5.611  -4.452
  545    HG2  GLN  71           2HG      GLN  71  -0.859   6.677  -6.266
  546    HG3  GLN  71           1HG      GLN  71  -0.732   5.182  -7.190
  547   HE21  GLN  71          1HE2      GLN  71  -3.194   7.371  -5.883
  548   HE22  GLN  71          2HE2      GLN  71  -4.234   7.303  -7.262
  549    H    ASN  72           H        ASN  72  -0.597   2.641  -7.445
  550    HA   ASN  72           HA       ASN  72  -3.047   1.118  -7.462
  551    HB2  ASN  72           2HB      ASN  72  -1.745   2.265  -9.464
  552    HB3  ASN  72           1HB      ASN  72  -0.938   0.701  -9.530
  553   HD21  ASN  72          1HD2      ASN  72  -3.326   2.400 -10.861
  554   HD22  ASN  72          2HD2      ASN  72  -4.410   1.130 -11.308
  555    H    VAL  73           H        VAL  73   0.421   0.404  -7.273
  556    HA   VAL  73           HA       VAL  73   0.461  -2.319  -7.486
  557    HB   VAL  73           HB       VAL  73   2.063  -0.425  -5.804
  558   HG11  VAL  73          1HG1      VAL  73   2.014  -2.357  -4.395
  559   HG12  VAL  73          2HG1      VAL  73   3.574  -2.320  -5.217
  560   HG13  VAL  73          3HG1      VAL  73   2.316  -3.427  -5.764
  561   HG21  VAL  73          3HG2      VAL  73   3.300  -2.289  -7.722
  562   HG22  VAL  73          1HG2      VAL  73   3.599  -0.573  -7.449
  563   HG23  VAL  73          2HG2      VAL  73   2.209  -1.085  -8.406
  564    H    VAL  74           H        VAL  74  -0.388  -0.420  -4.613
  565    HA   VAL  74           HA       VAL  74  -0.788  -2.684  -2.929
  566    HB   VAL  74           HB       VAL  74  -1.860   0.124  -2.658
  567   HG11  VAL  74          1HG1      VAL  74  -3.191  -1.540  -1.393
  568   HG12  VAL  74          2HG1      VAL  74  -2.352  -0.389  -0.356
  569   HG13  VAL  74          3HG1      VAL  74  -1.723  -2.024  -0.546
  570   HG21  VAL  74          3HG2      VAL  74   0.063  -0.405  -0.694
  571   HG22  VAL  74          1HG2      VAL  74   0.221   0.659  -2.090
  572   HG23  VAL  74          2HG2      VAL  74   0.737  -1.024  -2.201
  573    H    ALA  75           H        ALA  75  -3.041  -0.612  -4.784
  574    HA   ALA  75           HA       ALA  75  -5.456  -1.658  -4.015
  575    HB1  ALA  75           3HB      ALA  75  -6.278  -1.102  -6.290
  576    HB2  ALA  75           1HB      ALA  75  -4.611  -0.825  -6.792
  577    HB3  ALA  75           2HB      ALA  75  -5.342   0.198  -5.554
  578    H    ASP  76           H        ASP  76  -2.962  -3.108  -5.914
  579    HA   ASP  76           HA       ASP  76  -4.573  -5.254  -6.947
  580    HB2  ASP  76           2HB      ASP  76  -2.289  -4.244  -7.817
  581    HB3  ASP  76           1HB      ASP  76  -1.599  -5.458  -6.746
  582    H    HIS  77           H        HIS  77  -2.302  -4.832  -4.265
  583    HA   HIS  77           HA       HIS  77  -2.195  -7.513  -3.444
  584    HD1  HIS  77           1HD      HIS  77  -0.592  -6.297  -4.756
  585    HD2  HIS  77           2HD      HIS  77   0.989  -4.567  -1.324
  586    HE1  HIS  77           1HE      HIS  77   1.671  -5.427  -5.423
  587    HE2  HIS  77           2HE      HIS  77   2.641  -4.456  -3.311
  588    HB2  HIS  77           2HB      HIS  77  -1.933  -5.098  -1.645
  589    HB3  HIS  77           1HB      HIS  77  -1.276  -6.702  -1.371
  590    H    LEU  78           H        LEU  78  -4.440  -4.910  -2.501
  591    HA   LEU  78           HA       LEU  78  -5.766  -6.346  -0.484
  592    HG   LEU  78           HG       LEU  78  -5.111  -3.132  -0.769
  593    HB2  LEU  78           2HB      LEU  78  -6.668  -4.079  -2.259
  594    HB3  LEU  78           1HB      LEU  78  -7.653  -4.727  -0.965
  595   HD11  LEU  78          1HD1      LEU  78  -7.777  -2.892   0.613
  596   HD12  LEU  78          2HD1      LEU  78  -7.290  -1.988  -0.820
  597   HD13  LEU  78          3HD1      LEU  78  -6.430  -1.758   0.701
  598   HD21  LEU  78          3HD2      LEU  78  -4.568  -4.824   0.745
  599   HD22  LEU  78          1HD2      LEU  78  -6.246  -5.052   1.239
  600   HD23  LEU  78          2HD2      LEU  78  -5.363  -3.615   1.751
  601    H    GLN  79           H        GLN  79  -5.966  -6.433  -3.945
  602    HA   GLN  79           HA       GLN  79  -8.522  -7.686  -4.119
  603    HB2  GLN  79           2HB      GLN  79  -6.311  -7.851  -6.163
  604    HB3  GLN  79           1HB      GLN  79  -8.040  -8.008  -6.437
  605    HG2  GLN  79           2HG      GLN  79  -7.639  -5.491  -5.252
  606    HG3  GLN  79           1HG      GLN  79  -6.403  -5.672  -6.493
  607   HE21  GLN  79          1HE2      GLN  79  -7.976  -3.750  -7.077
  608   HE22  GLN  79          2HE2      GLN  79  -9.190  -4.167  -8.233
  609    H    ARG  80           H        ARG  80  -5.205  -8.944  -4.496
  610    HA   ARG  80           HA       ARG  80  -5.802 -11.604  -4.867
  611    HE   ARG  80           HE       ARG  80  -0.527 -13.580  -2.889
  612    HB2  ARG  80           2HB      ARG  80  -3.578 -11.066  -5.202
  613    HB3  ARG  80           1HB      ARG  80  -3.471 -10.127  -3.721
  614    HG2  ARG  80           2HG      ARG  80  -3.011 -11.936  -2.438
  615    HG3  ARG  80           1HG      ARG  80  -3.907 -13.049  -3.473
  616    HD2  ARG  80           2HD      ARG  80  -2.137 -12.895  -5.159
  617    HD3  ARG  80           1HD      ARG  80  -1.244 -11.788  -4.119
  618   HH11  ARG  80          1HH1      ARG  80  -3.219 -14.580  -4.871
  619   HH12  ARG  80          2HH1      ARG  80  -3.040 -16.259  -4.488
  620   HH21  ARG  80          1HH2      ARG  80  -0.290 -15.789  -2.382
  621   HH22  ARG  80          2HH2      ARG  80  -1.377 -16.945  -3.074
  622    H    MET  81           H        MET  81  -5.632  -9.774  -1.855
  623    HA   MET  81           HA       MET  81  -5.997 -12.143  -0.245
  624    HB2  MET  81           2HB      MET  81  -6.046 -10.599   1.661
  625    HB3  MET  81           1HB      MET  81  -4.650 -10.350   0.632
  626    HG2  MET  81           2HG      MET  81  -5.366  -8.213   1.220
  627    HG3  MET  81           1HG      MET  81  -5.931  -8.444  -0.430
  628    HE1  MET  81           3HE      MET  81  -6.360  -6.848   2.326
  629    HE2  MET  81           1HE      MET  81  -7.848  -7.213   3.200
  630    HE3  MET  81           2HE      MET  81  -7.880  -6.107   1.826
  631    H    ALA  82           H        ALA  82  -8.061 -10.075  -1.952
  632    HA   ALA  82           HA       ALA  82 -10.371 -11.155  -0.472
  633    HB1  ALA  82           3HB      ALA  82  -9.844  -8.307  -1.233
  634    HB2  ALA  82           1HB      ALA  82 -10.403  -8.968   0.303
  635    HB3  ALA  82           2HB      ALA  82 -11.495  -8.904  -1.080
  636    H    ASN  83           H        ASN  83 -11.116 -12.605  -1.909
  637    HA   ASN  83           HA       ASN  83 -11.283 -11.872  -4.738
  638    HB2  ASN  83           2HB      ASN  83 -11.823 -14.540  -3.417
  639    HB3  ASN  83           1HB      ASN  83 -11.722 -14.234  -5.148
  640   HD21  ASN  83          1HD2      ASN  83 -10.128 -15.709  -2.881
  641   HD22  ASN  83          2HD2      ASN  83  -8.490 -15.379  -3.320
  642    H    SER  84           H        SER  84 -13.078 -10.848  -5.319
  643    HA   SER  84           HA       SER  84 -15.615 -11.987  -5.211
  644    HG   SER  84           HG       SER  84 -17.476 -10.777  -2.661
  645    HB2  SER  84           2HB      SER  84 -15.033 -11.083  -2.714
  646    HB3  SER  84           1HB      SER  84 -15.790  -9.650  -3.408
  647    H    GLU  85           H        GLU  85 -13.776  -8.985  -5.225
  648    HA   GLU  85           HA       GLU  85 -15.035  -8.175  -7.691
  649    HB2  GLU  85           2HB      GLU  85 -15.893  -6.062  -6.909
  650    HB3  GLU  85           1HB      GLU  85 -16.607  -7.347  -5.944
  651    HG2  GLU  85           2HG      GLU  85 -14.179  -6.384  -4.726
  652    HG3  GLU  85           1HG      GLU  85 -15.304  -5.059  -5.028
  653    H    SER  86           H        SER  86 -14.053  -6.081  -8.499
  654    HA   SER  86           HA       SER  86 -11.215  -6.224  -8.184
  655    HG   SER  86           HG       SER  86 -13.135  -6.368 -10.287
  656    HB2  SER  86           2HB      SER  86 -12.839  -4.089  -9.594
  657    HB3  SER  86           1HB      SER  86 -11.125  -4.434  -9.826
  658    H    LEU  87           H        LEU  87 -11.411  -5.904  -5.820
  659    HA   LEU  87           HA       LEU  87 -11.674  -4.560  -3.912
  660    HG   LEU  87           HG       LEU  87  -8.173  -4.653  -3.277
  661    HB2  LEU  87           2HB      LEU  87  -9.175  -4.344  -5.296
  662    HB3  LEU  87           1HB      LEU  87  -9.533  -2.814  -4.521
  663   HD11  LEU  87          1HD1      LEU  87  -8.528  -2.665  -2.157
  664   HD12  LEU  87          2HD1      LEU  87  -9.360  -3.820  -1.115
  665   HD13  LEU  87          3HD1      LEU  87 -10.284  -2.815  -2.232
  666   HD21  LEU  87          3HD2      LEU  87  -9.892  -6.421  -3.532
  667   HD22  LEU  87          1HD2      LEU  87 -10.971  -5.470  -2.510
  668   HD23  LEU  87          2HD2      LEU  87  -9.460  -6.096  -1.856
  669    H    GLU  88           H        GLU  88 -13.303  -3.177  -3.588
  670    HA   GLU  88           HA       GLU  88 -13.681  -0.844  -5.205
  671    HB2  GLU  88           2HB      GLU  88 -15.535  -1.985  -3.971
  672    HB3  GLU  88           1HB      GLU  88 -14.802  -1.461  -2.458
  673    HG2  GLU  88           2HG      GLU  88 -15.338   0.764  -2.819
  674    HG3  GLU  88           1HG      GLU  88 -15.544   0.535  -4.555
  675    H    ILE  89           H        ILE  89 -11.894   0.464  -5.168
  676    HA   ILE  89           HA       ILE  89 -11.203   1.591  -2.554
  677    HB   ILE  89           HB       ILE  89  -8.880   1.494  -2.910
  678   HG12  ILE  89          2HG1      ILE  89  -9.129   2.107  -5.440
  679   HG13  ILE  89          1HG1      ILE  89  -7.742   1.172  -4.914
  680   HG21  ILE  89          1HG2      ILE  89  -8.436  -0.906  -3.497
  681   HG22  ILE  89          2HG2      ILE  89 -10.157  -1.048  -3.850
  682   HG23  ILE  89          3HG2      ILE  89  -9.623  -0.629  -2.224
  683   HD11  ILE  89          3HD1      ILE  89  -8.797  -0.871  -5.671
  684   HD12  ILE  89          1HD1      ILE  89  -8.691   0.308  -6.980
  685   HD13  ILE  89          2HD1      ILE  89 -10.229   0.036  -6.163
  686    H    ALA  90           H        ALA  90 -11.229   3.818  -2.504
  687    HA   ALA  90           HA       ALA  90 -11.488   5.151  -5.105
  688    HB1  ALA  90           3HB      ALA  90 -12.498   6.972  -4.015
  689    HB2  ALA  90           1HB      ALA  90 -11.899   6.476  -2.434
  690    HB3  ALA  90           2HB      ALA  90 -13.179   5.550  -3.225
  691    H    TRP  91           H        TRP  91  -9.638   5.763  -5.934
  692    HA   TRP  91           HA       TRP  91  -7.429   6.516  -4.200
  693    HD1  TRP  91           HD       TRP  91  -9.560   7.002  -7.325
  694    HE1  TRP  91           1HE      TRP  91  -9.709   6.931  -9.890
  695    HE3  TRP  91           3HE      TRP  91  -4.942   5.065  -8.354
  696    HZ2  TRP  91           2HZ      TRP  91  -8.087   6.157 -12.065
  697    HZ3  TRP  91           3HZ      TRP  91  -4.319   4.689 -10.705
  698    HH2  TRP  91           HH       TRP  91  -5.861   5.223 -12.521
  699    HB2  TRP  91           2HB      TRP  91  -6.055   6.478  -6.225
  700    HB3  TRP  91           1HB      TRP  91  -6.950   4.978  -6.033
  701    H    GLN  92           H        GLN  92  -6.666   8.507  -3.925
  702    HA   GLN  92           HA       GLN  92  -8.190  10.706  -5.065
  703    HB2  GLN  92           2HB      GLN  92  -6.007  10.669  -2.973
  704    HB3  GLN  92           1HB      GLN  92  -6.886  12.106  -3.476
  705    HG2  GLN  92           2HG      GLN  92  -8.957  11.170  -2.653
  706    HG3  GLN  92           1HG      GLN  92  -8.135   9.669  -2.228
  707   HE21  GLN  92          1HE2      GLN  92  -9.294  10.430  -0.168
  708   HE22  GLN  92          2HE2      GLN  92  -8.333  11.356   0.930
  709    HA   PRO  93           HA       PRO  93  -5.497  12.048  -8.264
  710    HB2  PRO  93           2HB      PRO  93  -5.317  14.640  -6.813
  711    HB3  PRO  93           1HB      PRO  93  -5.709  14.328  -8.507
  712    HG2  PRO  93           2HG      PRO  93  -7.624  14.954  -6.762
  713    HG3  PRO  93           1HG      PRO  93  -7.903  13.747  -8.032
  714    HD2  PRO  93           2HD      PRO  93  -7.458  13.362  -5.115
  715    HD3  PRO  93           1HD      PRO  93  -8.433  12.404  -6.247
  716    H    ALA  94           H        ALA  94  -4.541  13.052  -4.996
  717    HA   ALA  94           HA       ALA  94  -2.524  12.507  -3.939
  718    HB1  ALA  94           3HB      ALA  94  -0.725  11.547  -4.986
  719    HB2  ALA  94           1HB      ALA  94  -0.973  12.461  -6.471
  720    HB3  ALA  94           2HB      ALA  94  -2.009  11.084  -6.106
  721    H    GLU  95           H        GLU  95  -3.703  15.047  -4.914
  722    HA   GLU  95           HA       GLU  95  -3.217  17.268  -4.912
  723    HB2  GLU  95           2HB      GLU  95  -1.678  16.149  -2.929
  724    HB3  GLU  95           1HB      GLU  95  -0.481  17.015  -3.883
  725    HG2  GLU  95           2HG      GLU  95  -2.048  19.020  -3.709
  726    HG3  GLU  95           1HG      GLU  95  -2.872  18.108  -2.446
  727    H    SER  96           H        SER  96  -0.940  18.734  -5.337
  728    HA   SER  96           HA       SER  96   0.672  17.784  -7.462
  729    HG   SER  96           HG       SER  96  -0.005  19.165 -10.192
  730    HB2  SER  96           2HB      SER  96  -1.824  18.327  -8.368
  731    HB3  SER  96           1HB      SER  96  -1.071  19.911  -8.551
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1   6.867  13.568  -5.056
    2    HB2  MET   1           2HB      MET   1   7.521  13.745  -2.757
    3    HB3  MET   1           1HB      MET   1   8.802  14.417  -3.761
    4    HG2  MET   1           2HG      MET   1   8.644  16.419  -2.802
    5    HG3  MET   1           1HG      MET   1   6.886  16.425  -2.892
    6    HE1  MET   1           3HE      MET   1   6.678  17.377   0.348
    7    HE2  MET   1           1HE      MET   1   7.650  17.922  -1.020
    8    HE3  MET   1           2HE      MET   1   8.437  17.394   0.468
    9    H    PHE   2           H        PHE   2   4.787  13.608  -5.623
   10    HA   PHE   2           HA       PHE   2   2.918  15.327  -4.160
   11    HD1  PHE   2           1HD      PHE   2   3.399  16.758  -6.586
   12    HD2  PHE   2           2HD      PHE   2   2.933  12.794  -8.070
   13    HE1  PHE   2           1HE      PHE   2   4.700  17.358  -8.584
   14    HE2  PHE   2           2HE      PHE   2   4.226  13.393 -10.072
   15    HZ   PHE   2           HZ       PHE   2   5.117  15.673 -10.332
   16    HB2  PHE   2           2HB      PHE   2   1.856  13.395  -6.137
   17    HB3  PHE   2           1HB      PHE   2   1.459  15.091  -5.905
   18    H    ARG   3           H        ARG   3   0.779  14.093  -3.470
   19    HA   ARG   3           HA       ARG   3   1.381  11.368  -2.678
   20    HE   ARG   3           HE       ARG   3   3.512  11.094   1.818
   21    HB2  ARG   3           2HB      ARG   3   1.852  13.457  -0.850
   22    HB3  ARG   3           1HB      ARG   3   0.372  12.667  -0.315
   23    HG2  ARG   3           2HG      ARG   3   1.706  11.204   0.685
   24    HG3  ARG   3           1HG      ARG   3   2.002  10.552  -0.913
   25    HD2  ARG   3           2HD      ARG   3   4.138  11.154  -0.810
   26    HD3  ARG   3           1HD      ARG   3   3.692  12.824  -0.469
   27   HH11  ARG   3          1HH1      ARG   3   5.635  13.111  -0.081
   28   HH12  ARG   3          2HH1      ARG   3   6.741  13.388   1.221
   29   HH21  ARG   3          1HH2      ARG   3   4.965  11.458   3.533
   30   HH22  ARG   3          2HH2      ARG   3   6.362  12.450   3.273
   31    H    SER   4           H        SER   4  -0.308  10.123  -2.865
   32    HA   SER   4           HA       SER   4  -3.024  11.247  -2.748
   33    HG   SER   4           HG       SER   4  -4.479   9.066  -4.378
   34    HB2  SER   4           2HB      SER   4  -3.012  10.505  -4.935
   35    HB3  SER   4           1HB      SER   4  -1.722   9.338  -4.638
   36    H    THR   5           H        THR   5  -4.678   9.596  -1.999
   37    HA   THR   5           HA       THR   5  -3.518   7.454  -0.413
   38    HB   THR   5           HB       THR   5  -4.545   8.105   1.662
   39    HG1  THR   5           1HG      THR   5  -6.397   9.096   1.041
   40   HG21  THR   5          3HG2      THR   5  -3.233   9.845   2.343
   41   HG22  THR   5          1HG2      THR   5  -3.427  10.738   0.838
   42   HG23  THR   5          2HG2      THR   5  -2.363   9.332   0.901
   43    H    SER   6           H        SER   6  -4.680   5.669  -0.405
   44    HA   SER   6           HA       SER   6  -7.479   5.840  -1.326
   45    HG   SER   6           HG       SER   6  -7.382   3.168  -3.293
   46    HB2  SER   6           2HB      SER   6  -5.864   4.594  -2.808
   47    HB3  SER   6           1HB      SER   6  -5.657   3.430  -1.500
   48    H    HIS   7           H        HIS   7  -9.053   5.167   0.011
   49    HA   HIS   7           HA       HIS   7  -8.255   3.708   2.452
   50    HD1  HIS   7           1HD      HIS   7  -9.801   6.806   4.965
   51    HD2  HIS   7           2HD      HIS   7 -10.152   2.719   4.301
   52    HE1  HIS   7           1HE      HIS   7 -10.076   5.775   7.242
   53    HE2  HIS   7           2HE      HIS   7 -10.376   3.312   6.806
   54    HB2  HIS   7           2HB      HIS   7  -9.219   6.121   2.586
   55    HB3  HIS   7           1HB      HIS   7 -10.763   5.347   2.260
   56    H    VAL   8           H        VAL   8  -9.170   1.770   2.864
   57    HA   VAL   8           HA       VAL   8 -11.664   1.039   1.502
   58    HB   VAL   8           HB       VAL   8  -9.438  -0.969   1.609
   59   HG11  VAL   8          1HG1      VAL   8 -10.646  -2.032  -0.170
   60   HG12  VAL   8          2HG1      VAL   8 -11.736  -0.654  -0.317
   61   HG13  VAL   8          3HG1      VAL   8 -11.774  -1.660   1.132
   62   HG21  VAL   8          3HG2      VAL   8  -9.894   0.845  -0.752
   63   HG22  VAL   8          1HG2      VAL   8  -8.639  -0.377  -0.550
   64   HG23  VAL   8          2HG2      VAL   8  -8.609   1.087   0.431
   65    H    ARG   9           H        ARG   9 -12.815  -0.729   2.524
   66    HA   ARG   9           HA       ARG   9 -12.060  -0.996   5.350
   67    HE   ARG   9           HE       ARG   9 -15.296   2.185   6.619
   68    HB2  ARG   9           2HB      ARG   9 -14.661  -1.058   3.922
   69    HB3  ARG   9           1HB      ARG   9 -14.495  -2.138   5.298
   70    HG2  ARG   9           2HG      ARG   9 -15.450  -0.111   6.078
   71    HG3  ARG   9           1HG      ARG   9 -13.785  -0.176   6.663
   72    HD2  ARG   9           2HD      ARG   9 -13.079   1.495   5.246
   73    HD3  ARG   9           1HD      ARG   9 -14.371   1.198   4.082
   74   HH11  ARG   9          1HH1      ARG   9 -14.086   3.074   3.468
   75   HH12  ARG   9          2HH1      ARG   9 -14.807   4.650   3.499
   76   HH21  ARG   9          1HH2      ARG   9 -16.245   4.256   6.660
   77   HH22  ARG   9          2HH2      ARG   9 -16.032   5.320   5.310
   78    H    THR  10           H        THR  10 -10.745  -2.684   5.654
   79    HA   THR  10           HA       THR  10 -11.575  -5.296   4.578
   80    HB   THR  10           HB       THR  10  -9.329  -3.906   3.748
   81    HG1  THR  10           1HG      THR  10 -10.267  -5.589   2.607
   82   HG21  THR  10          3HG2      THR  10  -7.411  -4.844   4.577
   83   HG22  THR  10          1HG2      THR  10  -8.262  -6.225   5.272
   84   HG23  THR  10          2HG2      THR  10  -8.381  -4.640   6.042
   85    H    GLU  11           H        GLU  11 -10.844  -7.165   5.846
   86    HA   GLU  11           HA       GLU  11 -10.510  -6.447   8.682
   87    HB2  GLU  11           2HB      GLU  11 -12.291  -8.204   7.400
   88    HB3  GLU  11           1HB      GLU  11 -11.161  -9.223   8.280
   89    HG2  GLU  11           2HG      GLU  11 -11.978  -7.001   9.900
   90    HG3  GLU  11           1HG      GLU  11 -13.385  -7.869   9.285
   91    H    SER  12           H        SER  12  -8.973  -7.522   9.996
   92    HA   SER  12           HA       SER  12  -6.936  -8.379  10.484
   93    HG   SER  12           HG       SER  12  -5.740 -10.908  10.060
   94    HB2  SER  12           2HB      SER  12  -7.850 -10.509  10.048
   95    HB3  SER  12           1HB      SER  12  -7.817 -10.261   8.301
   96    H    ALA  13           H        ALA  13  -7.201  -6.254   8.493
   97    HA   ALA  13           HA       ALA  13  -5.480  -6.381   6.332
   98    HB1  ALA  13           3HB      ALA  13  -6.956  -4.460   7.041
   99    HB2  ALA  13           1HB      ALA  13  -5.383  -4.041   6.368
  100    HB3  ALA  13           2HB      ALA  13  -5.636  -4.002   8.105
  101    H    ALA  14           H        ALA  14  -4.587  -5.300   9.591
  102    HA   ALA  14           HA       ALA  14  -1.993  -4.610   9.273
  103    HB1  ALA  14           3HB      ALA  14  -3.084  -6.209  11.577
  104    HB2  ALA  14           1HB      ALA  14  -3.172  -4.458  11.372
  105    HB3  ALA  14           2HB      ALA  14  -1.606  -5.244  11.591
  106    H    ARG  15           H        ARG  15  -3.122  -7.916   9.013
  107    HA   ARG  15           HA       ARG  15  -0.470  -9.031   9.293
  108    HE   ARG  15           HE       ARG  15   0.967 -13.403   8.656
  109    HB2  ARG  15           2HB      ARG  15  -2.797 -10.146   9.767
  110    HB3  ARG  15           1HB      ARG  15  -2.757 -10.515   8.053
  111    HG2  ARG  15           2HG      ARG  15  -1.174 -11.633  10.272
  112    HG3  ARG  15           1HG      ARG  15  -1.834 -12.408   8.837
  113    HD2  ARG  15           2HD      ARG  15  -0.029 -11.661   7.487
  114    HD3  ARG  15           1HD      ARG  15   0.522 -10.535   8.724
  115   HH11  ARG  15          1HH1      ARG  15   1.181 -10.434  10.487
  116   HH12  ARG  15          2HH1      ARG  15   2.363 -11.057  11.587
  117   HH21  ARG  15          1HH2      ARG  15   2.517 -14.217  10.107
  118   HH22  ARG  15          2HH2      ARG  15   3.120 -13.202  11.374
  119    H    TYR  16           H        TYR  16  -2.658  -8.274   6.630
  120    HA   TYR  16           HA       TYR  16  -1.014  -9.447   4.636
  121    HD1  TYR  16           2HD      TYR  16  -2.652 -10.825   4.869
  122    HD2  TYR  16           1HD      TYR  16  -5.237  -7.735   3.470
  123    HE1  TYR  16           2HE      TYR  16  -4.560 -12.337   5.057
  124    HE2  TYR  16           1HE      TYR  16  -7.151  -9.255   3.666
  125    HH   TYR  16           HH       TYR  16  -7.603 -11.650   3.704
  126    HB2  TYR  16           2HB      TYR  16  -3.003  -7.188   4.309
  127    HB3  TYR  16           1HB      TYR  16  -2.317  -8.151   3.010
  128    H    VAL  17           H        VAL  17  -0.887  -6.427   6.347
  129    HA   VAL  17           HA       VAL  17   0.927  -5.164   4.507
  130    HB   VAL  17           HB       VAL  17  -0.051  -4.462   7.250
  131   HG11  VAL  17          1HG1      VAL  17   2.601  -3.764   6.216
  132   HG12  VAL  17          2HG1      VAL  17   1.943  -3.591   7.846
  133   HG13  VAL  17          3HG1      VAL  17   1.607  -2.373   6.626
  134   HG21  VAL  17          3HG2      VAL  17  -0.699  -2.425   6.191
  135   HG22  VAL  17          1HG2      VAL  17  -1.241  -3.780   5.196
  136   HG23  VAL  17          2HG2      VAL  17   0.189  -2.857   4.731
  137    H    ASN  18           H        ASN  18   1.226  -6.859   7.613
  138    HA   ASN  18           HA       ASN  18   4.045  -6.648   7.737
  139    HB2  ASN  18           2HB      ASN  18   2.314  -8.741   9.059
  140    HB3  ASN  18           1HB      ASN  18   3.919  -8.220   9.560
  141   HD21  ASN  18          1HD2      ASN  18   1.948  -8.202  11.379
  142   HD22  ASN  18          2HD2      ASN  18   1.472  -6.583  11.751
  143    H    ARG  19           H        ARG  19   1.878  -8.900   6.151
  144    HA   ARG  19           HA       ARG  19   3.880 -10.914   5.764
  145    HE   ARG  19           HE       ARG  19  -0.354 -12.587   5.203
  146    HB2  ARG  19           2HB      ARG  19   1.178 -10.930   5.676
  147    HB3  ARG  19           1HB      ARG  19   1.545 -10.855   3.957
  148    HG2  ARG  19           2HG      ARG  19   1.899 -13.033   3.964
  149    HG3  ARG  19           1HG      ARG  19   3.252 -12.790   5.068
  150    HD2  ARG  19           2HD      ARG  19   1.734 -14.382   6.032
  151    HD3  ARG  19           1HD      ARG  19   1.675 -12.886   6.961
  152   HH11  ARG  19          1HH1      ARG  19   0.513 -15.143   7.417
  153   HH12  ARG  19          2HH1      ARG  19  -1.124 -15.648   7.670
  154   HH21  ARG  19          1HH2      ARG  19  -2.507 -13.250   5.536
  155   HH22  ARG  19          2HH2      ARG  19  -2.839 -14.574   6.603
  156    H    LEU  20           H        LEU  20   3.098  -7.993   4.149
  157    HA   LEU  20           HA       LEU  20   3.949  -8.723   1.540
  158    HG   LEU  20           HG       LEU  20   1.572  -6.752   2.741
  159    HB2  LEU  20           2HB      LEU  20   3.791  -6.011   2.836
  160    HB3  LEU  20           1HB      LEU  20   4.059  -6.286   1.127
  161   HD11  LEU  20          1HD1      LEU  20   2.280  -4.568   1.488
  162   HD12  LEU  20          2HD1      LEU  20   0.617  -5.148   1.382
  163   HD13  LEU  20          3HD1      LEU  20   1.745  -5.451   0.059
  164   HD21  LEU  20          3HD2      LEU  20   0.605  -7.702   0.592
  165   HD22  LEU  20          1HD2      LEU  20   1.678  -8.770   1.495
  166   HD23  LEU  20          2HD2      LEU  20   2.265  -7.939   0.053
  167    H    CYS  21           H        CYS  21   5.595  -7.030   4.202
  168    HA   CYS  21           HA       CYS  21   7.986  -6.496   2.874
  169    HG   CYS  21           HG       CYS  21   6.528  -7.682   6.382
  170    HB2  CYS  21           2HB      CYS  21   9.023  -6.347   5.088
  171    HB3  CYS  21           1HB      CYS  21   7.440  -5.576   5.103
  172    H    LYS  22           H        LYS  22   6.875  -9.390   4.503
  173    HA   LYS  22           HA       LYS  22   9.377 -10.776   4.138
  174    HB2  LYS  22           2HB      LYS  22   6.676 -11.848   4.960
  175    HB3  LYS  22           1HB      LYS  22   8.208 -12.701   5.083
  176    HG2  LYS  22           2HG      LYS  22   8.724 -11.716   7.015
  177    HG3  LYS  22           1HG      LYS  22   8.251 -10.119   6.432
  178    HD2  LYS  22           2HD      LYS  22   6.797 -10.626   8.232
  179    HD3  LYS  22           1HD      LYS  22   5.852 -10.850   6.757
  180    HE2  LYS  22           2HE      LYS  22   5.344 -12.706   8.092
  181    HE3  LYS  22           1HE      LYS  22   6.499 -13.299   6.898
  182    HZ1  LYS  22           3HZ      LYS  22   7.125 -12.537   9.700
  183    HZ2  LYS  22           1HZ      LYS  22   8.256 -13.061   8.556
  184    HZ3  LYS  22           2HZ      LYS  22   7.045 -14.113   9.093
  185    H    HIS  23           H        HIS  23   6.510 -10.233   2.329
  186    HA   HIS  23           HA       HIS  23   6.807 -12.565   0.650
  187    HD1  HIS  23           1HD      HIS  23   5.737 -11.183  -2.355
  188    HD2  HIS  23           2HD      HIS  23   3.093 -13.388  -0.030
  189    HE1  HIS  23           1HE      HIS  23   4.532 -12.698  -3.961
  190    HE2  HIS  23           2HE      HIS  23   2.878 -13.963  -2.543
  191    HB2  HIS  23           2HB      HIS  23   4.580 -11.553   1.258
  192    HB3  HIS  23           1HB      HIS  23   4.984 -10.204   0.201
  193    H    TRP  24           H        TRP  24   6.777  -9.032  -0.045
  194    HA   TRP  24           HA       TRP  24   8.224  -9.592  -2.520
  195    HD1  TRP  24           HD       TRP  24   4.468  -7.324  -1.571
  196    HE1  TRP  24           1HE      TRP  24   2.814  -8.403  -3.222
  197    HE3  TRP  24           3HE      TRP  24   7.813  -9.371  -4.851
  198    HZ2  TRP  24           2HZ      TRP  24   2.915  -9.921  -5.600
  199    HZ3  TRP  24           3HZ      TRP  24   6.952 -10.620  -6.787
  200    HH2  TRP  24           HH       TRP  24   4.553 -10.890  -7.153
  201    HB2  TRP  24           2HB      TRP  24   7.000  -7.057  -1.428
  202    HB3  TRP  24           1HB      TRP  24   7.830  -7.172  -2.977
  203    H    GLY  25           H        GLY  25   9.035  -8.768   0.686
  204    HA2  GLY  25           2HA      GLY  25  11.204  -6.996   0.155
  205    HA3  GLY  25           1HA      GLY  25  10.939  -7.890   1.639
  206    H    HIS  26           H        HIS  26  11.799  -8.632  -1.741
  207    HA   HIS  26           HA       HIS  26  13.839 -10.481  -0.705
  208    HD1  HIS  26           1HD      HIS  26  13.874 -12.452  -0.375
  209    HD2  HIS  26           2HD      HIS  26  10.711 -12.978  -3.018
  210    HE1  HIS  26           1HE      HIS  26  12.761 -14.594   0.327
  211    HE2  HIS  26           2HE      HIS  26  10.900 -14.935  -1.338
  212    HB2  HIS  26           2HB      HIS  26  12.038 -10.563  -3.069
  213    HB3  HIS  26           1HB      HIS  26  13.658 -11.219  -3.277
  214    H    LYS  27           H        LYS  27  13.208  -7.733  -2.736
  215    HA   LYS  27           HA       LYS  27  16.080  -7.231  -2.934
  216    HB2  LYS  27           2HB      LYS  27  15.672  -8.453  -4.980
  217    HB3  LYS  27           1HB      LYS  27  14.249  -7.488  -5.335
  218    HG2  LYS  27           2HG      LYS  27  16.636  -5.851  -5.067
  219    HG3  LYS  27           1HG      LYS  27  16.802  -7.090  -6.312
  220    HD2  LYS  27           2HD      LYS  27  14.304  -5.461  -6.199
  221    HD3  LYS  27           1HD      LYS  27  15.768  -4.750  -6.881
  222    HE2  LYS  27           2HE      LYS  27  15.407  -7.394  -7.923
  223    HE3  LYS  27           1HE      LYS  27  13.922  -6.468  -8.137
  224    HZ1  LYS  27           3HZ      LYS  27  16.607  -5.506  -8.959
  225    HZ2  LYS  27           1HZ      LYS  27  15.116  -4.784  -9.303
  226    HZ3  LYS  27           2HZ      LYS  27  15.517  -6.270 -10.002
  227    H    PHE  28           H        PHE  28  13.763  -6.096  -1.530
  228    HA   PHE  28           HA       PHE  28  14.054  -3.344  -2.456
  229    HD1  PHE  28           2HD      PHE  28  12.017  -5.456  -4.535
  230    HD2  PHE  28           1HD      PHE  28  11.575  -1.422  -3.246
  231    HE1  PHE  28           2HE      PHE  28  11.702  -4.748  -6.869
  232    HE2  PHE  28           1HE      PHE  28  11.250  -0.714  -5.570
  233    HZ   PHE  28           HZ       PHE  28  11.316  -2.371  -7.391
  234    HB2  PHE  28           2HB      PHE  28  11.522  -4.883  -2.192
  235    HB3  PHE  28           1HB      PHE  28  11.509  -3.201  -1.673
  236    H    GLU  29           H        GLU  29  13.825  -1.772  -0.835
  237    HA   GLU  29           HA       GLU  29  14.508  -2.700   1.806
  238    HB2  GLU  29           2HB      GLU  29  14.314  -0.162   2.300
  239    HB3  GLU  29           1HB      GLU  29  15.620  -0.720   1.263
  240    HG2  GLU  29           2HG      GLU  29  13.117   0.024  -0.095
  241    HG3  GLU  29           1HG      GLU  29  14.005   1.335   0.679
  242    H    VAL  30           H        VAL  30  12.664  -3.851   2.490
  243    HA   VAL  30           HA       VAL  30  10.255  -2.221   2.835
  244    HB   VAL  30           HB       VAL  30   9.144  -4.500   3.282
  245   HG11  VAL  30          1HG1      VAL  30   8.833  -3.087   1.256
  246   HG12  VAL  30          2HG1      VAL  30   8.669  -4.814   0.959
  247   HG13  VAL  30          3HG1      VAL  30  10.147  -3.977   0.490
  248   HG21  VAL  30          3HG2      VAL  30  11.356  -5.603   1.603
  249   HG22  VAL  30          1HG2      VAL  30  10.173  -6.450   2.606
  250   HG23  VAL  30          2HG2      VAL  30  11.510  -5.577   3.361
  251    H    GLU  31           H        GLU  31   9.658  -1.585   4.783
  252    HA   GLU  31           HA       GLU  31  10.940  -2.807   7.120
  253    HB2  GLU  31           2HB      GLU  31  10.359  -0.123   6.398
  254    HB3  GLU  31           1HB      GLU  31   9.357  -0.512   7.790
  255    HG2  GLU  31           2HG      GLU  31  11.140  -0.764   9.183
  256    HG3  GLU  31           1HG      GLU  31  12.226  -1.260   7.885
  257    H    LEU  32           H        LEU  32   9.605  -3.234   9.027
  258    HA   LEU  32           HA       LEU  32   6.760  -3.641   8.410
  259    HG   LEU  32           HG       LEU  32   5.887  -6.262   8.290
  260    HB2  LEU  32           2HB      LEU  32   8.176  -5.726   8.101
  261    HB3  LEU  32           1HB      LEU  32   8.413  -5.716   9.836
  262   HD11  LEU  32          1HD1      LEU  32   7.829  -7.793   9.746
  263   HD12  LEU  32          2HD1      LEU  32   6.469  -8.344   8.766
  264   HD13  LEU  32          3HD1      LEU  32   6.234  -7.979  10.475
  265   HD21  LEU  32          3HD2      LEU  32   4.754  -6.334  10.550
  266   HD22  LEU  32          1HD2      LEU  32   5.105  -4.723   9.923
  267   HD23  LEU  32          2HD2      LEU  32   6.128  -5.426  11.177
  268    H    THR  33           H        THR  33   5.745  -2.369   9.781
  269    HA   THR  33           HA       THR  33   6.457  -2.560  12.655
  270    HB   THR  33           HB       THR  33   5.364  -0.116  12.580
  271    HG1  THR  33           1HG      THR  33   6.667  -0.340  10.072
  272   HG21  THR  33          3HG2      THR  33   8.237  -0.684  11.899
  273   HG22  THR  33          1HG2      THR  33   7.545  -0.500  13.511
  274   HG23  THR  33          2HG2      THR  33   7.606   0.880  12.413
  275    HA   PRO  34           HA       PRO  34   2.165  -3.446  13.143
  276    HB2  PRO  34           2HB      PRO  34   1.550  -2.393  15.536
  277    HB3  PRO  34           1HB      PRO  34   2.645  -3.765  15.359
  278    HG2  PRO  34           2HG      PRO  34   3.280  -0.889  15.834
  279    HG3  PRO  34           1HG      PRO  34   4.044  -2.334  16.518
  280    HD2  PRO  34           2HD      PRO  34   5.059  -0.870  14.407
  281    HD3  PRO  34           1HD      PRO  34   5.452  -2.569  14.738
  282    H    GLU  35           H        GLU  35   2.458  -1.362  11.422
  283    HA   GLU  35           HA       GLU  35   0.011   0.091  11.830
  284    HB2  GLU  35           2HB      GLU  35   2.637   1.578  11.589
  285    HB3  GLU  35           1HB      GLU  35   1.047   2.318  11.488
  286    HG2  GLU  35           2HG      GLU  35   2.132   0.858  13.884
  287    HG3  GLU  35           1HG      GLU  35   2.110   2.607  13.678
  288    H    ARG  36           H        ARG  36   2.889  -0.442   9.786
  289    HA   ARG  36           HA       ARG  36   1.294  -0.842   7.498
  290    HE   ARG  36           HE       ARG  36   4.642   4.157   7.791
  291    HB2  ARG  36           2HB      ARG  36   1.999   1.086   6.164
  292    HB3  ARG  36           1HB      ARG  36   1.082   1.596   7.571
  293    HG2  ARG  36           2HG      ARG  36   3.635   1.664   8.520
  294    HG3  ARG  36           1HG      ARG  36   3.860   2.129   6.834
  295    HD2  ARG  36           2HD      ARG  36   2.040   3.824   7.160
  296    HD3  ARG  36           1HD      ARG  36   2.081   3.440   8.880
  297   HH11  ARG  36          1HH1      ARG  36   1.687   5.369   9.196
  298   HH12  ARG  36          2HH1      ARG  36   2.409   6.840   9.756
  299   HH21  ARG  36          1HH2      ARG  36   5.594   6.092   8.527
  300   HH22  ARG  36          2HH2      ARG  36   4.627   7.250   9.375
  301    H    GLY  37           H        GLY  37   2.580  -0.932   5.476
  302    HA2  GLY  37           2HA      GLY  37   5.226  -2.100   6.058
  303    HA3  GLY  37           1HA      GLY  37   4.198  -2.559   4.707
  304    H    PHE  38           H        PHE  38   6.971  -0.894   5.330
  305    HA   PHE  38           HA       PHE  38   6.461   1.235   3.376
  306    HD1  PHE  38           2HD      PHE  38   7.157   3.723   3.735
  307    HD2  PHE  38           1HD      PHE  38  10.763   1.521   4.288
  308    HE1  PHE  38           2HE      PHE  38   8.431   5.559   2.727
  309    HE2  PHE  38           1HE      PHE  38  12.039   3.353   3.264
  310    HZ   PHE  38           HZ       PHE  38  10.874   5.374   2.475
  311    HB2  PHE  38           2HB      PHE  38   7.485   1.837   5.531
  312    HB3  PHE  38           1HB      PHE  38   8.804   0.718   5.225
  313    H    ILE  39           H        ILE  39   6.917   0.806   1.333
  314    HA   ILE  39           HA       ILE  39   9.263  -0.908   0.758
  315    HB   ILE  39           HB       ILE  39   6.900  -0.940  -1.093
  316   HG12  ILE  39          2HG1      ILE  39   7.181  -2.520   1.466
  317   HG13  ILE  39          1HG1      ILE  39   5.762  -1.701   0.832
  318   HG21  ILE  39          1HG2      ILE  39   8.206  -2.315  -2.241
  319   HG22  ILE  39          2HG2      ILE  39   8.314  -3.413  -0.867
  320   HG23  ILE  39          3HG2      ILE  39   9.474  -2.099  -1.038
  321   HD11  ILE  39          3HD1      ILE  39   5.601  -4.151   0.760
  322   HD12  ILE  39          1HD1      ILE  39   6.964  -4.186  -0.357
  323   HD13  ILE  39          2HD1      ILE  39   5.455  -3.403  -0.829
  324    H    ASP  40           H        ASP  40  10.695   0.647   0.044
  325    HA   ASP  40           HA       ASP  40   9.655   2.522  -1.969
  326    HB2  ASP  40           2HB      ASP  40  11.747   3.886  -1.313
  327    HB3  ASP  40           1HB      ASP  40  10.360   3.883  -0.234
  328    H    PHE  41           H        PHE  41  10.570   2.778  -3.855
  329    HA   PHE  41           HA       PHE  41  12.543   0.810  -4.724
  330    HD1  PHE  41           1HD      PHE  41  13.775   0.759  -6.641
  331    HD2  PHE  41           2HD      PHE  41   9.743   0.766  -8.004
  332    HE1  PHE  41           1HE      PHE  41  14.363  -0.885  -8.371
  333    HE2  PHE  41           2HE      PHE  41  10.325  -0.882  -9.737
  334    HZ   PHE  41           HZ       PHE  41  12.637  -1.708  -9.922
  335    HB2  PHE  41           2HB      PHE  41  10.306   1.732  -5.902
  336    HB3  PHE  41           1HB      PHE  41  11.456   2.868  -6.582
  337    H    GLY  42           H        GLY  42  12.725   3.710  -3.304
  338    HA2  GLY  42           2HA      GLY  42  14.914   4.739  -3.037
  339    HA3  GLY  42           1HA      GLY  42  15.190   4.460  -4.753
  340    H    ASP  43           H        ASP  43  13.905   5.695  -6.284
  341    HA   ASP  43           HA       ASP  43  13.356   8.391  -5.292
  342    HB2  ASP  43           2HB      ASP  43  13.142   8.911  -7.772
  343    HB3  ASP  43           1HB      ASP  43  14.737   8.381  -7.244
  344    H    SER  44           H        SER  44  11.579   6.709  -4.328
  345    HA   SER  44           HA       SER  44   9.088   7.652  -4.778
  346    HG   SER  44           HG       SER  44  10.496   4.827  -6.388
  347    HB2  SER  44           2HB      SER  44   8.222   5.504  -6.151
  348    HB3  SER  44           1HB      SER  44   8.750   6.980  -6.963
  349    H    ASN  45           H        ASN  45   7.413   6.289  -3.643
  350    HA   ASN  45           HA       ASN  45   8.455   3.911  -2.339
  351    HB2  ASN  45           2HB      ASN  45   7.285   5.859  -0.433
  352    HB3  ASN  45           1HB      ASN  45   8.567   4.679  -0.190
  353   HD21  ASN  45          1HD2      ASN  45  10.308   5.701   0.466
  354   HD22  ASN  45          2HD2      ASN  45  10.951   7.155  -0.208
  355    H    CYS  46           H        CYS  46   6.757   2.980  -0.792
  356    HA   CYS  46           HA       CYS  46   4.030   3.717  -1.417
  357    HG   CYS  46           HG       CYS  46   2.489   0.785  -2.934
  358    HB2  CYS  46           2HB      CYS  46   5.010   2.106  -3.228
  359    HB3  CYS  46           1HB      CYS  46   4.750   0.873  -1.998
  360    H    GLU  47           H        GLU  47   3.433   3.920   0.657
  361    HA   GLU  47           HA       GLU  47   4.117   1.831   2.579
  362    HB2  GLU  47           2HB      GLU  47   4.252   4.472   2.852
  363    HB3  GLU  47           1HB      GLU  47   2.571   4.279   3.322
  364    HG2  GLU  47           2HG      GLU  47   3.103   3.222   5.279
  365    HG3  GLU  47           1HG      GLU  47   4.618   2.569   4.653
  366    H    LEU  48           H        LEU  48   2.443   0.877   3.927
  367    HA   LEU  48           HA       LEU  48  -0.281   1.126   2.861
  368    HG   LEU  48           HG       LEU  48  -1.059  -2.082   3.706
  369    HB2  LEU  48           2HB      LEU  48   0.714  -0.764   1.665
  370    HB3  LEU  48           1HB      LEU  48   1.166  -1.517   3.181
  371   HD11  LEU  48          1HD1      LEU  48  -2.403  -0.261   3.332
  372   HD12  LEU  48          2HD1      LEU  48  -2.901  -1.325   2.018
  373   HD13  LEU  48          3HD1      LEU  48  -1.784   0.001   1.700
  374   HD21  LEU  48          3HD2      LEU  48  -1.875  -2.998   1.351
  375   HD22  LEU  48          1HD2      LEU  48  -0.525  -3.714   2.228
  376   HD23  LEU  48          2HD2      LEU  48  -0.220  -2.584   0.910
  377    H    LEU  49           H        LEU  49  -1.458   1.741   4.537
  378    HA   LEU  49           HA       LEU  49  -0.749   0.882   7.241
  379    HG   LEU  49           HG       LEU  49  -2.141   1.708   8.995
  380    HB2  LEU  49           2HB      LEU  49  -1.568   3.247   6.588
  381    HB3  LEU  49           1HB      LEU  49  -3.162   2.517   6.536
  382   HD11  LEU  49          1HD1      LEU  49  -0.492   3.133   9.473
  383   HD12  LEU  49          2HD1      LEU  49  -1.777   4.315   9.718
  384   HD13  LEU  49          3HD1      LEU  49  -0.932   4.238   8.172
  385   HD21  LEU  49          3HD2      LEU  49  -3.779   3.404   9.873
  386   HD22  LEU  49          1HD2      LEU  49  -4.427   2.276   8.682
  387   HD23  LEU  49          2HD2      LEU  49  -4.022   3.926   8.206
  388    H    ALA  50           H        ALA  50  -1.769  -0.703   8.351
  389    HA   ALA  50           HA       ALA  50  -4.327  -1.662   7.320
  390    HB1  ALA  50           3HB      ALA  50  -2.696  -2.945   6.128
  391    HB2  ALA  50           1HB      ALA  50  -3.537  -3.968   7.279
  392    HB3  ALA  50           2HB      ALA  50  -1.907  -3.409   7.636
  393    H    HIS  51           H        HIS  51  -5.667  -1.652   8.935
  394    HA   HIS  51           HA       HIS  51  -4.757  -2.528  11.562
  395    HD1  HIS  51           1HD      HIS  51  -7.758   0.027  13.644
  396    HD2  HIS  51           2HD      HIS  51  -3.840  -1.307  13.246
  397    HE1  HIS  51           1HE      HIS  51  -6.725   0.280  15.923
  398    HE2  HIS  51           2HE      HIS  51  -4.381  -0.609  15.676
  399    HB2  HIS  51           2HB      HIS  51  -5.929  -0.122  10.933
  400    HB3  HIS  51           1HB      HIS  51  -7.324  -1.073  11.416
  401    HA   PRO  52           HA       PRO  52  -7.324  -6.085  11.742
  402    HB2  PRO  52           2HB      PRO  52  -9.060  -4.662  13.717
  403    HB3  PRO  52           1HB      PRO  52  -8.366  -6.288  13.789
  404    HG2  PRO  52           2HG      PRO  52  -7.255  -4.318  15.159
  405    HG3  PRO  52           1HG      PRO  52  -6.240  -5.498  14.313
  406    HD2  PRO  52           2HD      PRO  52  -6.874  -2.678  13.580
  407    HD3  PRO  52           1HD      PRO  52  -5.378  -3.592  13.330
  408    H    ASP  53           H        ASP  53  -8.948  -3.034  11.094
  409    HA   ASP  53           HA       ASP  53 -10.877  -4.552   9.516
  410    HB2  ASP  53           2HB      ASP  53 -11.835  -2.290  11.262
  411    HB3  ASP  53           1HB      ASP  53 -12.798  -3.476  10.387
  412    H    HIS  54           H        HIS  54  -8.648  -2.138   9.424
  413    HA   HIS  54           HA       HIS  54  -9.915  -1.146   7.015
  414    HD1  HIS  54           1HD      HIS  54  -7.261   1.987   8.620
  415    HD2  HIS  54           2HD      HIS  54  -9.914   0.222  11.285
  416    HE1  HIS  54           1HE      HIS  54  -6.362   2.511  10.908
  417    HE2  HIS  54           2HE      HIS  54  -8.070   1.568  12.499
  418    HB2  HIS  54           2HB      HIS  54  -9.458   1.228   7.543
  419    HB3  HIS  54           1HB      HIS  54 -10.670   0.500   8.582
  420    H    VAL  55           H        VAL  55  -8.444  -0.002   5.541
  421    HA   VAL  55           HA       VAL  55  -5.611  -0.345   6.149
  422    HB   VAL  55           HB       VAL  55  -6.739  -2.319   4.819
  423   HG11  VAL  55          1HG1      VAL  55  -7.005  -2.124   2.556
  424   HG12  VAL  55          2HG1      VAL  55  -5.897  -0.757   2.433
  425   HG13  VAL  55          3HG1      VAL  55  -7.521  -0.521   3.079
  426   HG21  VAL  55          3HG2      VAL  55  -4.118  -1.153   3.918
  427   HG22  VAL  55          1HG2      VAL  55  -4.622  -2.839   3.804
  428   HG23  VAL  55          2HG2      VAL  55  -4.356  -2.105   5.384
  429    H    LEU  56           H        LEU  56  -4.321   1.174   5.246
  430    HA   LEU  56           HA       LEU  56  -5.591   3.138   3.450
  431    HG   LEU  56           HG       LEU  56  -6.377   4.727   5.391
  432    HB2  LEU  56           2HB      LEU  56  -4.342   3.514   6.024
  433    HB3  LEU  56           1HB      LEU  56  -3.430   4.378   4.808
  434   HD11  LEU  56          1HD1      LEU  56  -4.664   5.525   7.110
  435   HD12  LEU  56          2HD1      LEU  56  -5.852   6.692   6.527
  436   HD13  LEU  56          3HD1      LEU  56  -4.204   6.726   5.901
  437   HD21  LEU  56          3HD2      LEU  56  -5.772   6.902   4.009
  438   HD22  LEU  56          1HD2      LEU  56  -6.291   5.419   3.211
  439   HD23  LEU  56          2HD2      LEU  56  -4.576   5.825   3.292
  440    H    MET  57           H        MET  57  -4.356   3.950   1.767
  441    HA   MET  57           HA       MET  57  -1.736   2.677   1.380
  442    HB2  MET  57           2HB      MET  57  -3.626   3.186  -0.896
  443    HB3  MET  57           1HB      MET  57  -2.221   2.128  -0.850
  444    HG2  MET  57           2HG      MET  57  -3.381   0.639   0.708
  445    HG3  MET  57           1HG      MET  57  -4.792   1.697   0.653
  446    HE1  MET  57           3HE      MET  57  -6.444   1.489  -2.370
  447    HE2  MET  57           1HE      MET  57  -6.424   1.731  -0.623
  448    HE3  MET  57           2HE      MET  57  -6.927   0.179  -1.293
  449    H    ILE  58           H        ILE  58  -0.201   4.220   1.380
  450    HA   ILE  58           HA       ILE  58  -0.810   6.750   0.009
  451    HB   ILE  58           HB       ILE  58   1.004   6.415   2.404
  452   HG12  ILE  58          2HG1      ILE  58  -1.862   6.711   2.269
  453   HG13  ILE  58          1HG1      ILE  58  -0.842   6.506   3.678
  454   HG21  ILE  58          1HG2      ILE  58   1.659   8.197   0.868
  455   HG22  ILE  58          2HG2      ILE  58   1.095   8.843   2.409
  456   HG23  ILE  58          3HG2      ILE  58   0.043   8.896   0.993
  457   HD11  ILE  58          3HD1      ILE  58  -0.649   8.797   4.025
  458   HD12  ILE  58          1HD1      ILE  58  -2.333   8.575   3.551
  459   HD13  ILE  58          2HD1      ILE  58  -1.160   9.189   2.383
  460    H    LEU  59           H        LEU  59   0.692   7.488  -1.416
  461    HA   LEU  59           HA       LEU  59   3.163   5.906  -1.679
  462    HG   LEU  59           HG       LEU  59   1.392   7.168  -5.355
  463    HB2  LEU  59           2HB      LEU  59   3.043   5.956  -3.998
  464    HB3  LEU  59           1HB      LEU  59   1.393   5.642  -3.508
  465   HD11  LEU  59          1HD1      LEU  59  -0.281   7.489  -3.602
  466   HD12  LEU  59          2HD1      LEU  59   0.128   8.993  -4.430
  467   HD13  LEU  59          3HD1      LEU  59   0.782   8.663  -2.827
  468   HD21  LEU  59          3HD2      LEU  59   2.667   9.420  -3.993
  469   HD22  LEU  59          1HD2      LEU  59   2.777   8.893  -5.667
  470   HD23  LEU  59          2HD2      LEU  59   3.761   8.112  -4.435
  471    H    ASN  60           H        ASN  60   5.061   6.970  -2.114
  472    HA   ASN  60           HA       ASN  60   4.931   9.916  -2.098
  473    HB2  ASN  60           2HB      ASN  60   7.257   8.375  -0.957
  474    HB3  ASN  60           1HB      ASN  60   6.826  10.063  -0.697
  475   HD21  ASN  60          1HD2      ASN  60   5.548   6.793  -0.188
  476   HD22  ASN  60          2HD2      ASN  60   4.840   7.126   1.352
  477    H    SER  61           H        SER  61   5.258  10.365  -4.211
  478    HA   SER  61           HA       SER  61   7.816   9.488  -5.344
  479    HG   SER  61           HG       SER  61   5.878   7.230  -5.221
  480    HB2  SER  61           2HB      SER  61   5.674   9.133  -7.304
  481    HB3  SER  61           1HB      SER  61   7.037   8.088  -6.922
  482    HA   PRO  62           HA       PRO  62   7.909  13.639  -6.888
  483    HB2  PRO  62           2HB      PRO  62   9.883  13.268  -8.716
  484    HB3  PRO  62           1HB      PRO  62  10.148  13.413  -6.978
  485    HG2  PRO  62           2HG      PRO  62   9.947  10.925  -8.643
  486    HG3  PRO  62           1HG      PRO  62  11.148  11.346  -7.404
  487    HD2  PRO  62           2HD      PRO  62   9.108   9.739  -6.838
  488    HD3  PRO  62           1HD      PRO  62   9.666  10.943  -5.662
  489    H    ASP  63           H        ASP  63   6.999  10.944  -8.859
  490    HA   ASP  63           HA       ASP  63   5.981  12.867 -10.833
  491    HB2  ASP  63           2HB      ASP  63   6.474  11.221 -12.638
  492    HB3  ASP  63           1HB      ASP  63   7.923  11.849 -11.857
  493    H    GLU  64           H        GLU  64   3.974  12.288 -11.828
  494    HA   GLU  64           HA       GLU  64   2.261  10.769 -10.132
  495    HB2  GLU  64           2HB      GLU  64   1.656  12.617 -11.949
  496    HB3  GLU  64           1HB      GLU  64   1.452  11.202 -12.982
  497    HG2  GLU  64           2HG      GLU  64   0.141  10.439 -10.748
  498    HG3  GLU  64           1HG      GLU  64  -0.166  12.172 -10.744
  499    H    ASP  65           H        ASP  65   3.830   9.905 -13.257
  500    HA   ASP  65           HA       ASP  65   2.673   7.438 -13.696
  501    HB2  ASP  65           2HB      ASP  65   4.429   8.563 -15.125
  502    HB3  ASP  65           1HB      ASP  65   5.629   8.023 -13.951
  503    H    SER  66           H        SER  66   5.566   8.172 -11.781
  504    HA   SER  66           HA       SER  66   5.910   5.626 -10.626
  505    HG   SER  66           HG       SER  66   8.081   5.969  -9.042
  506    HB2  SER  66           2HB      SER  66   7.628   7.432 -10.556
  507    HB3  SER  66           1HB      SER  66   6.603   8.318  -9.423
  508    H    LEU  67           H        LEU  67   4.500   8.560  -9.347
  509    HA   LEU  67           HA       LEU  67   3.473   7.889  -6.954
  510    HG   LEU  67           HG       LEU  67   1.131   9.499  -6.480
  511    HB2  LEU  67           2HB      LEU  67   3.222  10.098  -7.675
  512    HB3  LEU  67           1HB      LEU  67   2.458   9.634  -9.166
  513   HD11  LEU  67          1HD1      LEU  67   1.539  11.687  -8.347
  514   HD12  LEU  67          2HD1      LEU  67   1.080  11.715  -6.645
  515   HD13  LEU  67          3HD1      LEU  67  -0.142  11.437  -7.885
  516   HD21  LEU  67          3HD2      LEU  67   0.245   8.883  -9.249
  517   HD22  LEU  67          1HD2      LEU  67  -0.911   9.590  -8.122
  518   HD23  LEU  67          2HD2      LEU  67  -0.136   8.054  -7.739
  519    H    ALA  68           H        ALA  68   1.553   7.531  -9.957
  520    HA   ALA  68           HA       ALA  68  -0.501   6.056  -8.692
  521    HB1  ALA  68           3HB      ALA  68  -0.712   7.278 -10.870
  522    HB2  ALA  68           1HB      ALA  68  -1.350   5.634 -10.894
  523    HB3  ALA  68           2HB      ALA  68   0.215   5.983 -11.627
  524    H    HIS  69           H        HIS  69   2.519   5.150 -10.234
  525    HA   HIS  69           HA       HIS  69   2.119   2.425 -10.604
  526    HD1  HIS  69           1HD      HIS  69   3.248   0.519 -10.203
  527    HD2  HIS  69           2HD      HIS  69   6.524   2.362 -11.975
  528    HE1  HIS  69           1HE      HIS  69   4.588  -1.342 -11.235
  529    HE2  HIS  69           2HE      HIS  69   6.609  -0.211 -12.228
  530    HB2  HIS  69           2HB      HIS  69   4.155   3.895 -11.222
  531    HB3  HIS  69           1HB      HIS  69   4.732   3.527  -9.600
  532    H    MET  70           H        MET  70   2.933   4.250  -7.724
  533    HA   MET  70           HA       MET  70   3.293   1.887  -6.101
  534    HB2  MET  70           2HB      MET  70   2.823   4.319  -4.580
  535    HB3  MET  70           1HB      MET  70   4.220   3.264  -4.578
  536    HG2  MET  70           2HG      MET  70   3.716   5.419  -6.616
  537    HG3  MET  70           1HG      MET  70   4.735   5.588  -5.191
  538    HE1  MET  70           3HE      MET  70   7.583   3.239  -5.659
  539    HE2  MET  70           1HE      MET  70   6.193   2.154  -5.708
  540    HE3  MET  70           2HE      MET  70   6.202   3.526  -4.599
  541    H    GLN  71           H        GLN  71   0.871   4.563  -6.000
  542    HA   GLN  71           HA       GLN  71  -0.794   3.415  -4.130
  543    HB2  GLN  71           2HB      GLN  71  -2.673   4.701  -5.421
  544    HB3  GLN  71           1HB      GLN  71  -1.444   5.572  -4.526
  545    HG2  GLN  71           2HG      GLN  71  -0.792   6.624  -6.359
  546    HG3  GLN  71           1HG      GLN  71  -0.636   5.113  -7.253
  547   HE21  GLN  71          1HE2      GLN  71  -2.757   4.156  -7.968
  548   HE22  GLN  71          2HE2      GLN  71  -3.937   5.256  -8.590
  549    H    ASN  72           H        ASN  72  -0.450   2.572  -7.482
  550    HA   ASN  72           HA       ASN  72  -2.904   1.050  -7.553
  551    HB2  ASN  72           2HB      ASN  72  -1.557   2.207  -9.526
  552    HB3  ASN  72           1HB      ASN  72  -0.760   0.639  -9.583
  553   HD21  ASN  72          1HD2      ASN  72  -2.501   1.912 -11.533
  554   HD22  ASN  72          2HD2      ASN  72  -3.822   0.827 -11.780
  555    H    VAL  73           H        VAL  73   0.574   0.333  -7.412
  556    HA   VAL  73           HA       VAL  73   0.610  -2.386  -7.582
  557    HB   VAL  73           HB       VAL  73   2.235  -0.491  -5.916
  558   HG11  VAL  73          1HG1      VAL  73   2.159  -3.435  -5.678
  559   HG12  VAL  73          2HG1      VAL  73   2.637  -2.209  -4.503
  560   HG13  VAL  73          3HG1      VAL  73   3.755  -2.691  -5.778
  561   HG21  VAL  73          3HG2      VAL  73   2.319  -1.072  -8.540
  562   HG22  VAL  73          1HG2      VAL  73   3.440  -2.284  -7.921
  563   HG23  VAL  73          2HG2      VAL  73   3.728  -0.574  -7.604
  564    H    VAL  74           H        VAL  74  -0.268  -0.454  -4.751
  565    HA   VAL  74           HA       VAL  74  -0.600  -2.711  -3.029
  566    HB   VAL  74           HB       VAL  74  -1.655   0.102  -2.736
  567   HG11  VAL  74          1HG1      VAL  74  -2.893  -1.646  -1.418
  568   HG12  VAL  74          2HG1      VAL  74  -2.134  -0.378  -0.457
  569   HG13  VAL  74          3HG1      VAL  74  -1.384  -1.968  -0.566
  570   HG21  VAL  74          3HG2      VAL  74   0.412   0.675  -2.162
  571   HG22  VAL  74          1HG2      VAL  74   0.968  -0.973  -2.455
  572   HG23  VAL  74          2HG2      VAL  74   0.377  -0.511  -0.860
  573    H    ALA  75           H        ALA  75  -2.901  -0.630  -4.826
  574    HA   ALA  75           HA       ALA  75  -5.289  -1.708  -3.996
  575    HB1  ALA  75           3HB      ALA  75  -6.171  -1.109  -6.247
  576    HB2  ALA  75           1HB      ALA  75  -4.518  -0.765  -6.756
  577    HB3  ALA  75           2HB      ALA  75  -5.263   0.187  -5.471
  578    H    ASP  76           H        ASP  76  -2.832  -3.111  -5.963
  579    HA   ASP  76           HA       ASP  76  -4.457  -5.207  -7.064
  580    HB2  ASP  76           2HB      ASP  76  -2.060  -4.161  -7.766
  581    HB3  ASP  76           1HB      ASP  76  -1.530  -5.602  -6.903
  582    H    HIS  77           H        HIS  77  -2.206  -4.886  -4.359
  583    HA   HIS  77           HA       HIS  77  -2.155  -7.612  -3.635
  584    HD1  HIS  77           1HD      HIS  77   0.942  -4.733  -1.637
  585    HD2  HIS  77           2HD      HIS  77  -0.018  -7.569  -4.519
  586    HE1  HIS  77           1HE      HIS  77   3.043  -5.072  -2.972
  587    HE2  HIS  77           2HE      HIS  77   2.417  -6.734  -4.759
  588    HB2  HIS  77           2HB      HIS  77  -1.644  -5.150  -1.970
  589    HB3  HIS  77           1HB      HIS  77  -1.371  -6.771  -1.404
  590    H    LEU  78           H        LEU  78  -4.249  -4.956  -2.519
  591    HA   LEU  78           HA       LEU  78  -5.591  -6.387  -0.524
  592    HG   LEU  78           HG       LEU  78  -4.840  -3.191  -0.777
  593    HB2  LEU  78           2HB      LEU  78  -6.462  -4.064  -2.237
  594    HB3  LEU  78           1HB      LEU  78  -7.437  -4.698  -0.929
  595   HD11  LEU  78          1HD1      LEU  78  -7.414  -2.881   0.751
  596   HD12  LEU  78          2HD1      LEU  78  -7.050  -2.032  -0.751
  597   HD13  LEU  78          3HD1      LEU  78  -6.057  -1.757   0.680
  598   HD21  LEU  78          3HD2      LEU  78  -5.959  -5.127   1.218
  599   HD22  LEU  78          1HD2      LEU  78  -5.068  -3.705   1.753
  600   HD23  LEU  78          2HD2      LEU  78  -4.288  -4.892   0.710
  601    H    GLN  79           H        GLN  79  -5.815  -6.574  -3.954
  602    HA   GLN  79           HA       GLN  79  -8.471  -7.572  -4.124
  603    HB2  GLN  79           2HB      GLN  79  -6.238  -8.074  -6.087
  604    HB3  GLN  79           1HB      GLN  79  -7.967  -8.097  -6.403
  605    HG2  GLN  79           2HG      GLN  79  -7.378  -5.558  -5.352
  606    HG3  GLN  79           1HG      GLN  79  -6.133  -5.918  -6.543
  607   HE21  GLN  79          1HE2      GLN  79  -7.857  -3.867  -6.978
  608   HE22  GLN  79          2HE2      GLN  79  -8.944  -4.266  -8.261
  609    H    ARG  80           H        ARG  80  -5.371  -9.289  -4.585
  610    HA   ARG  80           HA       ARG  80  -6.492 -11.844  -4.622
  611    HE   ARG  80           HE       ARG  80  -3.615 -11.871  -1.841
  612    HB2  ARG  80           2HB      ARG  80  -4.106 -12.564  -3.932
  613    HB3  ARG  80           1HB      ARG  80  -4.354 -11.779  -5.484
  614    HG2  ARG  80           2HG      ARG  80  -2.956 -10.159  -4.954
  615    HG3  ARG  80           1HG      ARG  80  -3.831  -9.813  -3.461
  616    HD2  ARG  80           2HD      ARG  80  -1.766 -11.985  -3.807
  617    HD3  ARG  80           1HD      ARG  80  -1.466 -10.412  -3.071
  618   HH11  ARG  80          1HH1      ARG  80  -0.163 -11.364  -1.890
  619   HH12  ARG  80          2HH1      ARG  80   0.066 -11.905  -0.261
  620   HH21  ARG  80          1HH2      ARG  80  -3.316 -12.584   0.301
  621   HH22  ARG  80          2HH2      ARG  80  -1.724 -12.597   0.983
  622    H    MET  81           H        MET  81  -5.687  -9.816  -1.899
  623    HA   MET  81           HA       MET  81  -5.661 -11.993  -0.030
  624    HB2  MET  81           2HB      MET  81  -5.529 -10.307   1.711
  625    HB3  MET  81           1HB      MET  81  -4.387  -9.961   0.429
  626    HG2  MET  81           2HG      MET  81  -5.349  -7.915   1.158
  627    HG3  MET  81           1HG      MET  81  -5.958  -8.265  -0.453
  628    HE1  MET  81           3HE      MET  81  -7.401  -6.202   0.353
  629    HE2  MET  81           1HE      MET  81  -7.411  -6.229   2.116
  630    HE3  MET  81           2HE      MET  81  -8.923  -6.385   1.222
  631    H    ALA  82           H        ALA  82  -8.125 -10.160  -1.531
  632    HA   ALA  82           HA       ALA  82 -10.073 -11.032   0.512
  633    HB1  ALA  82           3HB      ALA  82 -10.275  -8.842  -1.555
  634    HB2  ALA  82           1HB      ALA  82 -10.138  -8.653   0.194
  635    HB3  ALA  82           2HB      ALA  82 -11.598  -9.352  -0.506
  636    H    ASN  83           H        ASN  83  -9.742 -10.680  -3.025
  637    HA   ASN  83           HA       ASN  83 -10.549 -11.912  -4.757
  638    HB2  ASN  83           2HB      ASN  83 -10.824 -14.061  -2.643
  639    HB3  ASN  83           1HB      ASN  83 -10.929 -14.325  -4.381
  640   HD21  ASN  83          1HD2      ASN  83  -9.065 -15.382  -2.365
  641   HD22  ASN  83          2HD2      ASN  83  -7.486 -14.976  -2.938
  642    H    SER  84           H        SER  84 -12.392 -10.879  -5.326
  643    HA   SER  84           HA       SER  84 -14.856 -12.129  -5.109
  644    HG   SER  84           HG       SER  84 -16.030 -12.428  -3.308
  645    HB2  SER  84           2HB      SER  84 -14.293 -10.939  -2.689
  646    HB3  SER  84           1HB      SER  84 -15.259  -9.707  -3.499
  647    H    GLU  85           H        GLU  85 -13.177  -9.051  -5.337
  648    HA   GLU  85           HA       GLU  85 -14.415  -8.471  -7.863
  649    HB2  GLU  85           2HB      GLU  85 -15.465  -6.384  -7.240
  650    HB3  GLU  85           1HB      GLU  85 -16.136  -7.676  -6.255
  651    HG2  GLU  85           2HG      GLU  85 -14.819  -7.003  -4.368
  652    HG3  GLU  85           1HG      GLU  85 -13.952  -5.816  -5.341
  653    H    SER  86           H        SER  86 -13.612  -6.237  -8.662
  654    HA   SER  86           HA       SER  86 -10.776  -6.197  -8.322
  655    HG   SER  86           HG       SER  86 -10.104  -4.392 -10.712
  656    HB2  SER  86           2HB      SER  86 -11.769  -5.633 -10.484
  657    HB3  SER  86           1HB      SER  86 -12.612  -4.263  -9.761
  658    H    LEU  87           H        LEU  87 -11.018  -5.932  -5.953
  659    HA   LEU  87           HA       LEU  87 -11.430  -4.607  -4.037
  660    HG   LEU  87           HG       LEU  87  -7.981  -4.710  -3.239
  661    HB2  LEU  87           2HB      LEU  87  -8.864  -4.348  -5.287
  662    HB3  LEU  87           1HB      LEU  87  -9.288  -2.815  -4.553
  663   HD11  LEU  87          1HD1      LEU  87  -9.106  -3.699  -1.137
  664   HD12  LEU  87          2HD1      LEU  87  -9.977  -2.693  -2.295
  665   HD13  LEU  87          3HD1      LEU  87  -8.215  -2.640  -2.230
  666   HD21  LEU  87          3HD2      LEU  87  -9.847  -6.348  -3.451
  667   HD22  LEU  87          1HD2      LEU  87 -10.839  -5.275  -2.463
  668   HD23  LEU  87          2HD2      LEU  87  -9.383  -6.000  -1.788
  669    H    GLU  88           H        GLU  88 -13.079  -3.241  -3.752
  670    HA   GLU  88           HA       GLU  88 -13.446  -0.920  -5.385
  671    HB2  GLU  88           2HB      GLU  88 -15.310  -2.089  -4.184
  672    HB3  GLU  88           1HB      GLU  88 -14.628  -1.527  -2.663
  673    HG2  GLU  88           2HG      GLU  88 -15.532   0.494  -2.878
  674    HG3  GLU  88           1HG      GLU  88 -15.058   0.624  -4.571
  675    H    ILE  89           H        ILE  89 -11.680   0.412  -5.312
  676    HA   ILE  89           HA       ILE  89 -11.083   1.585  -2.696
  677    HB   ILE  89           HB       ILE  89  -8.747   1.490  -2.964
  678   HG12  ILE  89          2HG1      ILE  89  -8.906   2.046  -5.516
  679   HG13  ILE  89          1HG1      ILE  89  -7.534   1.135  -4.915
  680   HG21  ILE  89          1HG2      ILE  89  -8.273  -0.915  -3.469
  681   HG22  ILE  89          2HG2      ILE  89  -9.972  -1.076  -3.908
  682   HG23  ILE  89          3HG2      ILE  89  -9.525  -0.621  -2.266
  683   HD11  ILE  89          3HD1      ILE  89  -8.574  -0.939  -5.652
  684   HD12  ILE  89          1HD1      ILE  89  -8.373   0.199  -6.985
  685   HD13  ILE  89          2HD1      ILE  89  -9.962  -0.028  -6.254
  686    H    ALA  90           H        ALA  90 -11.118   3.811  -2.698
  687    HA   ALA  90           HA       ALA  90 -11.294   5.086  -5.334
  688    HB1  ALA  90           3HB      ALA  90 -11.809   6.464  -2.709
  689    HB2  ALA  90           1HB      ALA  90 -13.053   5.511  -3.525
  690    HB3  ALA  90           2HB      ALA  90 -12.356   6.921  -4.320
  691    H    TRP  91           H        TRP  91  -9.422   5.706  -6.115
  692    HA   TRP  91           HA       TRP  91  -7.273   6.505  -4.324
  693    HD1  TRP  91           HD       TRP  91  -8.020   7.793  -8.322
  694    HE1  TRP  91           1HE      TRP  91  -9.031   6.588 -10.358
  695    HE3  TRP  91           3HE      TRP  91  -6.939   2.964  -7.029
  696    HZ2  TRP  91           2HZ      TRP  91  -9.330   3.944 -11.294
  697    HZ3  TRP  91           3HZ      TRP  91  -7.622   1.156  -8.553
  698    HH2  TRP  91           HH       TRP  91  -8.793   1.638 -10.640
  699    HB2  TRP  91           2HB      TRP  91  -5.986   6.686  -6.548
  700    HB3  TRP  91           1HB      TRP  91  -6.459   5.084  -5.998
  701    H    GLN  92           H        GLN  92  -6.544   8.520  -4.055
  702    HA   GLN  92           HA       GLN  92  -8.110  10.676  -5.221
  703    HB2  GLN  92           2HB      GLN  92  -5.960  10.672  -3.095
  704    HB3  GLN  92           1HB      GLN  92  -6.820  12.109  -3.630
  705    HG2  GLN  92           2HG      GLN  92  -8.930  11.118  -2.883
  706    HG3  GLN  92           1HG      GLN  92  -8.053   9.693  -2.327
  707   HE21  GLN  92          1HE2      GLN  92  -9.344  10.547  -0.376
  708   HE22  GLN  92          2HE2      GLN  92  -8.468  11.585   0.693
  709    HA   PRO  93           HA       PRO  93  -5.444  12.069  -8.423
  710    HB2  PRO  93           2HB      PRO  93  -5.329  14.659  -6.960
  711    HB3  PRO  93           1HB      PRO  93  -5.692  14.347  -8.660
  712    HG2  PRO  93           2HG      PRO  93  -7.642  14.921  -6.932
  713    HG3  PRO  93           1HG      PRO  93  -7.879  13.724  -8.218
  714    HD2  PRO  93           2HD      PRO  93  -7.491  13.316  -5.301
  715    HD3  PRO  93           1HD      PRO  93  -8.399  12.337  -6.469
  716    H    ALA  94           H        ALA  94  -4.520  13.083  -5.149
  717    HA   ALA  94           HA       ALA  94  -2.498  12.554  -4.090
  718    HB1  ALA  94           3HB      ALA  94  -0.660  11.671  -5.144
  719    HB2  ALA  94           1HB      ALA  94  -0.939  12.589  -6.622
  720    HB3  ALA  94           2HB      ALA  94  -1.931  11.177  -6.266
  721    H    GLU  95           H        GLU  95  -3.507  14.949  -4.053
  722    HA   GLU  95           HA       GLU  95  -1.190  16.680  -4.214
  723    HB2  GLU  95           2HB      GLU  95  -2.786  16.714  -6.390
  724    HB3  GLU  95           1HB      GLU  95  -3.614  17.904  -5.394
  725    HG2  GLU  95           2HG      GLU  95  -0.963  18.625  -5.182
  726    HG3  GLU  95           1HG      GLU  95  -1.119  18.107  -6.860
  727    H    SER  96           H        SER  96  -1.105  17.869  -2.430
  728    HA   SER  96           HA       SER  96  -1.688  18.906  -0.492
  729    HG   SER  96           HG       SER  96  -3.670  21.316  -0.312
  730    HB2  SER  96           2HB      SER  96  -3.548  19.770  -2.448
  731    HB3  SER  96           1HB      SER  96  -4.459  19.493  -0.964
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1   7.043  13.258  -5.235
    2    HB2  MET   1           2HB      MET   1   7.602  12.901  -2.916
    3    HB3  MET   1           1HB      MET   1   8.975  13.628  -3.745
    4    HG2  MET   1           2HG      MET   1   7.309  15.673  -2.610
    5    HG3  MET   1           1HG      MET   1   7.733  14.482  -1.385
    6    HE1  MET   1           3HE      MET   1   9.880  16.568  -4.365
    7    HE2  MET   1           1HE      MET   1  10.176  17.775  -3.115
    8    HE3  MET   1           2HE      MET   1   8.525  17.287  -3.495
    9    H    PHE   2           H        PHE   2   4.974  13.523  -5.785
   10    HA   PHE   2           HA       PHE   2   3.175  15.180  -4.221
   11    HD1  PHE   2           1HD      PHE   2   3.697  16.605  -6.519
   12    HD2  PHE   2           2HD      PHE   2   3.045  12.759  -8.231
   13    HE1  PHE   2           1HE      PHE   2   4.999  17.267  -8.499
   14    HE2  PHE   2           2HE      PHE   2   4.342  13.418 -10.210
   15    HZ   PHE   2           HZ       PHE   2   5.324  15.672 -10.347
   16    HB2  PHE   2           2HB      PHE   2   2.087  13.251  -6.209
   17    HB3  PHE   2           1HB      PHE   2   1.662  14.935  -5.940
   18    H    ARG   3           H        ARG   3   1.003  14.016  -3.483
   19    HA   ARG   3           HA       ARG   3   1.553  11.283  -2.662
   20    HE   ARG   3           HE       ARG   3   4.504  12.318   1.709
   21    HB2  ARG   3           2HB      ARG   3   2.088  13.382  -0.874
   22    HB3  ARG   3           1HB      ARG   3   0.581  12.659  -0.322
   23    HG2  ARG   3           2HG      ARG   3   1.851  11.160   0.700
   24    HG3  ARG   3           1HG      ARG   3   2.140  10.478  -0.885
   25    HD2  ARG   3           2HD      ARG   3   4.289  11.023  -0.783
   26    HD3  ARG   3           1HD      ARG   3   3.892  12.705  -0.442
   27   HH11  ARG   3          1HH1      ARG   3   3.518   9.275   0.313
   28   HH12  ARG   3          2HH1      ARG   3   3.887   8.360   1.735
   29   HH21  ARG   3          1HH2      ARG   3   4.990  11.115   3.581
   30   HH22  ARG   3          2HH2      ARG   3   4.722   9.403   3.591
   31    H    SER   4           H        SER   4  -0.159  10.068  -2.850
   32    HA   SER   4           HA       SER   4  -2.853  11.241  -2.699
   33    HG   SER   4           HG       SER   4  -4.349   9.085  -4.541
   34    HB2  SER   4           2HB      SER   4  -2.842  10.493  -4.893
   35    HB3  SER   4           1HB      SER   4  -1.632   9.249  -4.568
   36    H    THR   5           H        THR   5  -4.528   9.603  -1.948
   37    HA   THR   5           HA       THR   5  -3.389   7.458  -0.354
   38    HB   THR   5           HB       THR   5  -4.417   8.132   1.720
   39    HG1  THR   5           1HG      THR   5  -5.435  10.317   0.237
   40   HG21  THR   5          3HG2      THR   5  -3.203  10.713   0.846
   41   HG22  THR   5          1HG2      THR   5  -2.200   9.272   1.009
   42   HG23  THR   5          2HG2      THR   5  -3.094   9.884   2.396
   43    H    SER   6           H        SER   6  -4.563   5.683  -0.368
   44    HA   SER   6           HA       SER   6  -7.363   5.890  -1.277
   45    HG   SER   6           HG       SER   6  -7.391   3.409  -3.298
   46    HB2  SER   6           2HB      SER   6  -5.765   4.628  -2.764
   47    HB3  SER   6           1HB      SER   6  -5.577   3.455  -1.461
   48    H    HIS   7           H        HIS   7  -8.959   5.167   0.013
   49    HA   HIS   7           HA       HIS   7  -8.184   3.746   2.485
   50    HD1  HIS   7           1HD      HIS   7 -11.402   3.028   3.389
   51    HD2  HIS   7           2HD      HIS   7  -9.555   6.100   5.489
   52    HE1  HIS   7           1HE      HIS   7 -12.017   2.660   5.796
   53    HE2  HIS   7           2HE      HIS   7 -10.831   4.489   7.057
   54    HB2  HIS   7           2HB      HIS   7  -9.100   6.028   2.842
   55    HB3  HIS   7           1HB      HIS   7 -10.593   5.529   2.061
   56    H    VAL   8           H        VAL   8  -9.074   1.797   2.915
   57    HA   VAL   8           HA       VAL   8 -11.488   0.974   1.463
   58    HB   VAL   8           HB       VAL   8  -9.203  -0.957   1.696
   59   HG11  VAL   8          1HG1      VAL   8 -11.449  -0.766  -0.305
   60   HG12  VAL   8          2HG1      VAL   8 -11.488  -1.751   1.158
   61   HG13  VAL   8          3HG1      VAL   8 -10.309  -2.097  -0.106
   62   HG21  VAL   8          3HG2      VAL   8  -8.342  -0.382  -0.440
   63   HG22  VAL   8          1HG2      VAL   8  -8.415   1.109   0.499
   64   HG23  VAL   8          2HG2      VAL   8  -9.640   0.777  -0.725
   65    H    ARG   9           H        ARG   9 -12.636  -0.807   2.464
   66    HA   ARG   9           HA       ARG   9 -11.962  -1.054   5.314
   67    HE   ARG   9           HE       ARG   9 -15.303   0.771   3.589
   68    HB2  ARG   9           2HB      ARG   9 -14.519  -1.077   3.829
   69    HB3  ARG   9           1HB      ARG   9 -14.397  -2.236   5.144
   70    HG2  ARG   9           2HG      ARG   9 -15.379  -0.248   5.999
   71    HG3  ARG   9           1HG      ARG   9 -13.742  -0.369   6.648
   72    HD2  ARG   9           2HD      ARG   9 -14.153   1.904   5.971
   73    HD3  ARG   9           1HD      ARG   9 -12.973   1.180   4.879
   74   HH11  ARG   9          1HH1      ARG   9 -13.859   3.615   5.006
   75   HH12  ARG   9          2HH1      ARG   9 -14.605   4.704   3.885
   76   HH21  ARG   9          1HH2      ARG   9 -16.284   2.203   2.115
   77   HH22  ARG   9          2HH2      ARG   9 -15.982   3.903   2.245
   78    H    THR  10           H        THR  10 -10.631  -2.734   5.626
   79    HA   THR  10           HA       THR  10 -11.423  -5.336   4.505
   80    HB   THR  10           HB       THR  10  -9.143  -3.890   3.782
   81    HG1  THR  10           1HG      THR  10  -9.723  -6.650   3.496
   82   HG21  THR  10          3HG2      THR  10  -8.279  -4.924   6.039
   83   HG22  THR  10          1HG2      THR  10  -7.270  -4.881   4.588
   84   HG23  THR  10          2HG2      THR  10  -8.110  -6.367   5.033
   85    H    GLU  11           H        GLU  11 -10.690  -7.218   5.734
   86    HA   GLU  11           HA       GLU  11 -10.376  -6.565   8.587
   87    HB2  GLU  11           2HB      GLU  11 -12.146  -8.306   7.252
   88    HB3  GLU  11           1HB      GLU  11 -11.023  -9.331   8.139
   89    HG2  GLU  11           2HG      GLU  11 -11.837  -7.155   9.797
   90    HG3  GLU  11           1HG      GLU  11 -13.261  -7.943   9.118
   91    H    SER  12           H        SER  12  -8.824  -7.642   9.868
   92    HA   SER  12           HA       SER  12  -6.804  -8.546  10.343
   93    HG   SER  12           HG       SER  12  -5.496 -10.917   8.254
   94    HB2  SER  12           2HB      SER  12  -7.824 -10.631   9.699
   95    HB3  SER  12           1HB      SER  12  -7.505 -10.311   7.992
   96    H    ALA  13           H        ALA  13  -7.082  -6.351   8.359
   97    HA   ALA  13           HA       ALA  13  -5.293  -6.423   6.259
   98    HB1  ALA  13           3HB      ALA  13  -5.218  -4.079   6.334
   99    HB2  ALA  13           1HB      ALA  13  -5.536  -4.070   8.060
  100    HB3  ALA  13           2HB      ALA  13  -6.810  -4.527   6.942
  101    H    ALA  14           H        ALA  14  -4.496  -5.313   9.533
  102    HA   ALA  14           HA       ALA  14  -1.876  -4.674   9.302
  103    HB1  ALA  14           3HB      ALA  14  -3.231  -4.531  11.352
  104    HB2  ALA  14           1HB      ALA  14  -1.603  -5.154  11.629
  105    HB3  ALA  14           2HB      ALA  14  -2.977  -6.259  11.608
  106    H    ARG  15           H        ARG  15  -3.059  -7.940   8.979
  107    HA   ARG  15           HA       ARG  15  -0.549  -9.193   9.528
  108    HE   ARG  15           HE       ARG  15  -1.450 -13.286   6.477
  109    HB2  ARG  15           2HB      ARG  15  -2.947 -10.174   9.643
  110    HB3  ARG  15           1HB      ARG  15  -2.754 -10.436   7.918
  111    HG2  ARG  15           2HG      ARG  15  -0.855 -11.476  10.000
  112    HG3  ARG  15           1HG      ARG  15  -2.207 -12.396   9.347
  113    HD2  ARG  15           2HD      ARG  15  -0.637 -11.296   7.212
  114    HD3  ARG  15           1HD      ARG  15   0.398 -12.191   8.318
  115   HH11  ARG  15          1HH1      ARG  15  -0.202 -13.750   9.704
  116   HH12  ARG  15          2HH1      ARG  15  -0.505 -15.455   9.710
  117   HH21  ARG  15          1HH2      ARG  15  -1.849 -15.528   6.485
  118   HH22  ARG  15          2HH2      ARG  15  -1.439 -16.464   7.883
  119    H    TYR  16           H        TYR  16  -2.269  -8.299   6.541
  120    HA   TYR  16           HA       TYR  16  -0.286  -9.433   4.859
  121    HD1  TYR  16           2HD      TYR  16  -1.945 -10.849   4.631
  122    HD2  TYR  16           1HD      TYR  16  -4.359  -7.569   3.386
  123    HE1  TYR  16           2HE      TYR  16  -3.916 -12.298   4.648
  124    HE2  TYR  16           1HE      TYR  16  -6.337  -9.020   3.406
  125    HH   TYR  16           HH       TYR  16  -6.897 -11.373   3.269
  126    HB2  TYR  16           2HB      TYR  16  -2.150  -7.158   4.144
  127    HB3  TYR  16           1HB      TYR  16  -1.328  -8.243   3.033
  128    H    VAL  17           H        VAL  17  -0.709  -6.258   6.326
  129    HA   VAL  17           HA       VAL  17   1.438  -5.005   4.956
  130    HB   VAL  17           HB       VAL  17   0.012  -4.403   7.518
  131   HG11  VAL  17          1HG1      VAL  17   2.014  -3.857   8.476
  132   HG12  VAL  17          2HG1      VAL  17   1.709  -2.370   7.586
  133   HG13  VAL  17          3HG1      VAL  17   2.805  -3.579   6.923
  134   HG21  VAL  17          3HG2      VAL  17   0.725  -2.817   5.066
  135   HG22  VAL  17          1HG2      VAL  17  -0.197  -2.199   6.435
  136   HG23  VAL  17          2HG2      VAL  17  -0.847  -3.514   5.453
  137    H    ASN  18           H        ASN  18   1.221  -7.063   7.765
  138    HA   ASN  18           HA       ASN  18   3.974  -6.820   8.474
  139    HB2  ASN  18           2HB      ASN  18   1.666  -8.464   9.397
  140    HB3  ASN  18           1HB      ASN  18   3.290  -9.006   9.808
  141   HD21  ASN  18          1HD2      ASN  18   1.812  -5.791   9.582
  142   HD22  ASN  18          2HD2      ASN  18   2.206  -5.310  11.193
  143    H    ARG  19           H        ARG  19   2.077  -9.197   6.595
  144    HA   ARG  19           HA       ARG  19   4.410 -10.893   6.330
  145    HE   ARG  19           HE       ARG  19   2.033 -15.514   7.415
  146    HB2  ARG  19           2HB      ARG  19   1.653 -11.289   6.180
  147    HB3  ARG  19           1HB      ARG  19   2.237 -11.570   4.545
  148    HG2  ARG  19           2HG      ARG  19   2.816 -13.611   5.176
  149    HG3  ARG  19           1HG      ARG  19   4.048 -12.883   6.206
  150    HD2  ARG  19           2HD      ARG  19   2.482 -12.772   8.051
  151    HD3  ARG  19           1HD      ARG  19   1.204 -13.427   7.027
  152   HH11  ARG  19          1HH1      ARG  19   4.530 -13.187   8.141
  153   HH12  ARG  19          2HH1      ARG  19   5.629 -14.373   8.764
  154   HH21  ARG  19          1HH2      ARG  19   3.475 -17.075   8.234
  155   HH22  ARG  19          2HH2      ARG  19   5.030 -16.580   8.816
  156    H    LEU  20           H        LEU  20   2.704  -8.581   4.281
  157    HA   LEU  20           HA       LEU  20   3.764  -9.283   1.826
  158    HG   LEU  20           HG       LEU  20   1.036  -7.919   2.840
  159    HB2  LEU  20           2HB      LEU  20   2.992  -6.587   2.895
  160    HB3  LEU  20           1HB      LEU  20   3.356  -6.895   1.210
  161   HD11  LEU  20          1HD1      LEU  20  -0.157  -6.912   0.803
  162   HD12  LEU  20          2HD1      LEU  20   1.393  -6.151   0.439
  163   HD13  LEU  20          3HD1      LEU  20   0.571  -5.795   1.961
  164   HD21  LEU  20          3HD2      LEU  20   1.615  -9.848   1.621
  165   HD22  LEU  20          1HD2      LEU  20   2.043  -8.923   0.179
  166   HD23  LEU  20          2HD2      LEU  20   0.357  -9.067   0.668
  167    H    CYS  21           H        CYS  21   5.072  -6.962   4.194
  168    HA   CYS  21           HA       CYS  21   7.221  -6.051   2.713
  169    HG   CYS  21           HG       CYS  21   5.702  -6.446   6.411
  170    HB2  CYS  21           2HB      CYS  21   8.346  -5.748   5.003
  171    HB3  CYS  21           1HB      CYS  21   6.806  -4.937   4.745
  172    H    LYS  22           H        LYS  22   6.946  -8.994   4.618
  173    HA   LYS  22           HA       LYS  22   9.693  -9.746   4.226
  174    HB2  LYS  22           2HB      LYS  22   7.338 -11.390   5.163
  175    HB3  LYS  22           1HB      LYS  22   9.024 -11.879   5.249
  176    HG2  LYS  22           2HG      LYS  22   9.378 -10.726   7.125
  177    HG3  LYS  22           1HG      LYS  22   8.517  -9.307   6.528
  178    HD2  LYS  22           2HD      LYS  22   7.295 -10.086   8.405
  179    HD3  LYS  22           1HD      LYS  22   6.373 -10.573   6.981
  180    HE2  LYS  22           2HE      LYS  22   6.377 -12.454   8.380
  181    HE3  LYS  22           1HE      LYS  22   7.587 -12.794   7.142
  182    HZ1  LYS  22           3HZ      LYS  22   7.928 -12.328   9.993
  183    HZ2  LYS  22           1HZ      LYS  22   9.108 -11.652   8.986
  184    HZ3  LYS  22           2HZ      LYS  22   8.812 -13.317   8.945
  185    H    HIS  23           H        HIS  23   6.783 -10.024   2.445
  186    HA   HIS  23           HA       HIS  23   7.633 -12.308   0.892
  187    HD1  HIS  23           1HD      HIS  23   5.896 -12.264   3.271
  188    HD2  HIS  23           2HD      HIS  23   3.800 -13.692  -0.020
  189    HE1  HIS  23           1HE      HIS  23   4.615 -14.261   4.104
  190    HE2  HIS  23           2HE      HIS  23   3.411 -15.152   2.079
  191    HB2  HIS  23           2HB      HIS  23   5.207 -10.553   0.863
  192    HB3  HIS  23           1HB      HIS  23   5.528 -11.655  -0.467
  193    H    TRP  24           H        TRP  24   6.693  -8.955  -0.070
  194    HA   TRP  24           HA       TRP  24   7.969  -9.285  -2.608
  195    HD1  TRP  24           HD       TRP  24   4.373  -7.004  -1.052
  196    HE1  TRP  24           1HE      TRP  24   2.502  -8.061  -2.468
  197    HE3  TRP  24           3HE      TRP  24   7.228  -9.104  -4.737
  198    HZ2  TRP  24           2HZ      TRP  24   2.267  -9.582  -4.835
  199    HZ3  TRP  24           3HZ      TRP  24   6.103 -10.343  -6.539
  200    HH2  TRP  24           HH       TRP  24   3.673 -10.577  -6.586
  201    HB2  TRP  24           2HB      TRP  24   6.909  -6.830  -1.203
  202    HB3  TRP  24           1HB      TRP  24   7.497  -6.848  -2.863
  203    H    GLY  25           H        GLY  25   9.186  -8.571   0.498
  204    HA2  GLY  25           2HA      GLY  25  11.294  -6.802  -0.215
  205    HA3  GLY  25           1HA      GLY  25  11.204  -7.780   1.239
  206    H    HIS  26           H        HIS  26  11.868  -8.064  -2.240
  207    HA   HIS  26           HA       HIS  26  13.769 -10.218  -1.594
  208    HD1  HIS  26           1HD      HIS  26  11.286 -12.294  -4.783
  209    HD2  HIS  26           2HD      HIS  26  13.595 -12.195  -1.330
  210    HE1  HIS  26           1HE      HIS  26  11.168 -14.618  -3.829
  211    HE2  HIS  26           2HE      HIS  26  12.647 -14.557  -1.790
  212    HB2  HIS  26           2HB      HIS  26  11.834  -9.848  -3.752
  213    HB3  HIS  26           1HB      HIS  26  13.440 -10.259  -4.342
  214    H    LYS  27           H        LYS  27  13.352  -7.130  -3.182
  215    HA   LYS  27           HA       LYS  27  16.259  -6.822  -3.273
  216    HB2  LYS  27           2HB      LYS  27  15.829  -7.730  -5.451
  217    HB3  LYS  27           1HB      LYS  27  14.459  -6.662  -5.695
  218    HG2  LYS  27           2HG      LYS  27  17.032  -5.304  -5.244
  219    HG3  LYS  27           1HG      LYS  27  16.921  -6.256  -6.725
  220    HD2  LYS  27           2HD      LYS  27  14.639  -4.479  -6.072
  221    HD3  LYS  27           1HD      LYS  27  16.139  -3.709  -6.587
  222    HE2  LYS  27           2HE      LYS  27  14.419  -5.659  -8.093
  223    HE3  LYS  27           1HE      LYS  27  14.890  -4.025  -8.554
  224    HZ1  LYS  27           3HZ      LYS  27  16.340  -5.203  -9.813
  225    HZ2  LYS  27           1HZ      LYS  27  16.398  -6.520  -8.751
  226    HZ3  LYS  27           2HZ      LYS  27  17.273  -5.114  -8.405
  227    H    PHE  28           H        PHE  28  13.674  -5.620  -2.002
  228    HA   PHE  28           HA       PHE  28  14.515  -2.856  -2.407
  229    HD1  PHE  28           2HD      PHE  28  13.370  -1.029  -4.169
  230    HD2  PHE  28           1HD      PHE  28  11.741  -4.934  -4.613
  231    HE1  PHE  28           2HE      PHE  28  13.575  -0.832  -6.614
  232    HE2  PHE  28           1HE      PHE  28  11.943  -4.746  -7.058
  233    HZ   PHE  28           HZ       PHE  28  12.861  -2.693  -8.061
  234    HB2  PHE  28           2HB      PHE  28  11.671  -3.853  -2.515
  235    HB3  PHE  28           1HB      PHE  28  12.107  -2.153  -2.348
  236    H    GLU  29           H        GLU  29  13.684  -1.384  -0.713
  237    HA   GLU  29           HA       GLU  29  14.173  -2.596   1.849
  238    HB2  GLU  29           2HB      GLU  29  14.098  -0.370   2.748
  239    HB3  GLU  29           1HB      GLU  29  14.992  -0.322   1.236
  240    HG2  GLU  29           2HG      GLU  29  12.893   0.441   0.119
  241    HG3  GLU  29           1HG      GLU  29  12.168   0.588   1.722
  242    H    VAL  30           H        VAL  30  12.678  -3.613   2.975
  243    HA   VAL  30           HA       VAL  30   9.917  -2.602   2.847
  244    HB   VAL  30           HB       VAL  30   9.553  -5.187   3.611
  245   HG11  VAL  30          1HG1      VAL  30   9.579  -4.034   0.829
  246   HG12  VAL  30          2HG1      VAL  30   8.206  -4.184   1.929
  247   HG13  VAL  30          3HG1      VAL  30   8.929  -5.626   1.219
  248   HG21  VAL  30          3HG2      VAL  30  10.944  -6.687   2.545
  249   HG22  VAL  30          1HG2      VAL  30  12.081  -5.460   3.101
  250   HG23  VAL  30          2HG2      VAL  30  11.563  -5.477   1.414
  251    H    GLU  31           H        GLU  31   9.468  -1.625   4.716
  252    HA   GLU  31           HA       GLU  31  10.714  -2.559   7.183
  253    HB2  GLU  31           2HB      GLU  31  10.137  -0.032   6.211
  254    HB3  GLU  31           1HB      GLU  31   8.875  -0.298   7.408
  255    HG2  GLU  31           2HG      GLU  31  10.364  -0.414   9.155
  256    HG3  GLU  31           1HG      GLU  31  11.711  -0.876   8.116
  257    H    LEU  32           H        LEU  32   9.421  -2.879   9.115
  258    HA   LEU  32           HA       LEU  32   6.596  -3.476   8.643
  259    HG   LEU  32           HG       LEU  32   5.735  -6.038   8.771
  260    HB2  LEU  32           2HB      LEU  32   8.020  -5.538   8.294
  261    HB3  LEU  32           1HB      LEU  32   8.431  -5.450   9.994
  262   HD11  LEU  32          1HD1      LEU  32   7.785  -7.539  10.325
  263   HD12  LEU  32          2HD1      LEU  32   6.840  -8.039   8.923
  264   HD13  LEU  32          3HD1      LEU  32   6.084  -7.965  10.516
  265   HD21  LEU  32          3HD2      LEU  32   5.197  -4.568  10.550
  266   HD22  LEU  32          1HD2      LEU  32   6.414  -5.284  11.607
  267   HD23  LEU  32          2HD2      LEU  32   4.970  -6.199  11.181
  268    H    THR  33           H        THR  33   5.619  -2.195  10.057
  269    HA   THR  33           HA       THR  33   6.504  -2.329  12.884
  270    HB   THR  33           HB       THR  33   5.637   0.081  13.029
  271    HG1  THR  33           1HG      THR  33   4.703   0.596  11.195
  272   HG21  THR  33          3HG2      THR  33   8.129  -0.469  11.442
  273   HG22  THR  33          1HG2      THR  33   7.994  -0.286  13.190
  274   HG23  THR  33          2HG2      THR  33   7.704   1.097  12.134
  275    HA   PRO  34           HA       PRO  34   2.268  -3.318  13.612
  276    HB2  PRO  34           2HB      PRO  34   1.824  -2.268  16.067
  277    HB3  PRO  34           1HB      PRO  34   2.817  -3.699  15.794
  278    HG2  PRO  34           2HG      PRO  34   3.657  -0.882  16.298
  279    HG3  PRO  34           1HG      PRO  34   4.375  -2.388  16.891
  280    HD2  PRO  34           2HD      PRO  34   5.371  -0.932  14.787
  281    HD3  PRO  34           1HD      PRO  34   5.626  -2.676  14.996
  282    H    GLU  35           H        GLU  35   2.417  -1.257  11.900
  283    HA   GLU  35           HA       GLU  35   0.017   0.190  12.430
  284    HB2  GLU  35           2HB      GLU  35   2.631   1.707  12.239
  285    HB3  GLU  35           1HB      GLU  35   1.034   2.443  12.166
  286    HG2  GLU  35           2HG      GLU  35   0.616   1.446  14.446
  287    HG3  GLU  35           1HG      GLU  35   2.337   1.062  14.488
  288    H    ARG  36           H        ARG  36   2.896  -0.205  10.353
  289    HA   ARG  36           HA       ARG  36   1.305  -0.571   8.060
  290    HE   ARG  36           HE       ARG  36   0.494   4.802   8.348
  291    HB2  ARG  36           2HB      ARG  36   2.481   1.526   6.911
  292    HB3  ARG  36           1HB      ARG  36   0.909   1.647   7.673
  293    HG2  ARG  36           2HG      ARG  36   3.143   2.090   9.503
  294    HG3  ARG  36           1HG      ARG  36   3.056   3.253   8.180
  295    HD2  ARG  36           2HD      ARG  36   0.455   2.734   9.348
  296    HD3  ARG  36           1HD      ARG  36   1.611   3.313  10.546
  297   HH11  ARG  36          1HH1      ARG  36   3.124   4.578  10.631
  298   HH12  ARG  36          2HH1      ARG  36   3.513   6.263  10.537
  299   HH21  ARG  36          1HH2      ARG  36   1.005   7.017   8.222
  300   HH22  ARG  36          2HH2      ARG  36   2.311   7.647   9.170
  301    H    GLY  37           H        GLY  37   2.574  -0.529   6.030
  302    HA2  GLY  37           2HA      GLY  37   5.246  -1.652   6.564
  303    HA3  GLY  37           1HA      GLY  37   4.236  -2.064   5.178
  304    H    PHE  38           H        PHE  38   6.936  -1.135   5.000
  305    HA   PHE  38           HA       PHE  38   6.485   1.357   3.488
  306    HD1  PHE  38           1HD      PHE  38   8.342   3.098   2.711
  307    HD2  PHE  38           2HD      PHE  38   7.556   3.143   6.902
  308    HE1  PHE  38           1HE      PHE  38   8.107   5.545   2.651
  309    HE2  PHE  38           2HE      PHE  38   7.315   5.586   6.833
  310    HZ   PHE  38           HZ       PHE  38   7.591   6.790   4.705
  311    HB2  PHE  38           2HB      PHE  38   7.932   1.139   5.884
  312    HB3  PHE  38           1HB      PHE  38   9.151   1.217   4.620
  313    H    ILE  39           H        ILE  39   6.870   0.854   1.420
  314    HA   ILE  39           HA       ILE  39   9.236  -0.838   0.877
  315    HB   ILE  39           HB       ILE  39   6.848  -0.924  -0.934
  316   HG12  ILE  39          2HG1      ILE  39   7.305  -2.476   1.603
  317   HG13  ILE  39          1HG1      ILE  39   5.818  -1.744   1.014
  318   HG21  ILE  39          1HG2      ILE  39   8.008  -2.453  -2.080
  319   HG22  ILE  39          2HG2      ILE  39   8.567  -3.265  -0.618
  320   HG23  ILE  39          3HG2      ILE  39   9.405  -1.828  -1.204
  321   HD11  ILE  39          3HD1      ILE  39   5.591  -3.476  -0.655
  322   HD12  ILE  39          1HD1      ILE  39   5.762  -4.187   0.950
  323   HD13  ILE  39          2HD1      ILE  39   7.130  -4.182  -0.161
  324    H    ASP  40           H        ASP  40  10.710   0.563   0.032
  325    HA   ASP  40           HA       ASP  40   9.732   2.602  -1.836
  326    HB2  ASP  40           2HB      ASP  40  11.194   4.016  -0.914
  327    HB3  ASP  40           1HB      ASP  40  11.617   2.782   0.259
  328    H    PHE  41           H        PHE  41  10.401   2.734  -3.891
  329    HA   PHE  41           HA       PHE  41  11.898   0.422  -4.905
  330    HD1  PHE  41           1HD      PHE  41  10.917  -1.162  -6.974
  331    HD2  PHE  41           2HD      PHE  41   7.959   1.306  -5.170
  332    HE1  PHE  41           1HE      PHE  41   9.410  -3.099  -6.809
  333    HE2  PHE  41           2HE      PHE  41   6.446  -0.627  -4.999
  334    HZ   PHE  41           HZ       PHE  41   7.171  -2.833  -5.819
  335    HB2  PHE  41           2HB      PHE  41   9.863   2.276  -6.118
  336    HB3  PHE  41           1HB      PHE  41  10.940   1.352  -7.155
  337    H    GLY  42           H        GLY  42  12.661   3.386  -3.906
  338    HA2  GLY  42           2HA      GLY  42  15.005   4.032  -4.399
  339    HA3  GLY  42           1HA      GLY  42  14.595   3.839  -6.097
  340    H    ASP  43           H        ASP  43  13.441   5.442  -7.156
  341    HA   ASP  43           HA       ASP  43  13.450   8.035  -5.822
  342    HB2  ASP  43           2HB      ASP  43  13.011   8.948  -8.071
  343    HB3  ASP  43           1HB      ASP  43  14.421   7.893  -8.069
  344    H    SER  44           H        SER  44  11.629   6.543  -4.632
  345    HA   SER  44           HA       SER  44   9.259   7.940  -4.723
  346    HG   SER  44           HG       SER  44   8.607   4.422  -6.246
  347    HB2  SER  44           2HB      SER  44   8.011   7.078  -6.386
  348    HB3  SER  44           1HB      SER  44   9.434   6.225  -6.939
  349    H    ASN  45           H        ASN  45   7.357   6.046  -3.886
  350    HA   ASN  45           HA       ASN  45   8.523   4.124  -2.134
  351    HB2  ASN  45           2HB      ASN  45   8.147   6.851  -1.149
  352    HB3  ASN  45           1HB      ASN  45   7.320   5.651  -0.162
  353   HD21  ASN  45          1HD2      ASN  45  10.304   7.041  -1.028
  354   HD22  ASN  45          2HD2      ASN  45  11.315   6.064  -0.022
  355    H    CYS  46           H        CYS  46   6.850   3.168  -0.616
  356    HA   CYS  46           HA       CYS  46   4.101   3.778  -1.204
  357    HG   CYS  46           HG       CYS  46   2.653   0.953  -3.061
  358    HB2  CYS  46           2HB      CYS  46   5.111   2.133  -3.016
  359    HB3  CYS  46           1HB      CYS  46   4.807   0.940  -1.758
  360    H    GLU  47           H        GLU  47   3.583   3.995   0.880
  361    HA   GLU  47           HA       GLU  47   4.404   1.985   2.829
  362    HB2  GLU  47           2HB      GLU  47   4.394   4.632   3.021
  363    HB3  GLU  47           1HB      GLU  47   2.732   4.366   3.526
  364    HG2  GLU  47           2HG      GLU  47   3.410   3.165   5.438
  365    HG3  GLU  47           1HG      GLU  47   5.060   2.983   4.834
  366    H    LEU  48           H        LEU  48   2.756   0.947   4.214
  367    HA   LEU  48           HA       LEU  48   0.054   1.032   3.053
  368    HG   LEU  48           HG       LEU  48  -0.653  -2.371   3.734
  369    HB2  LEU  48           2HB      LEU  48   1.356  -0.920   2.140
  370    HB3  LEU  48           1HB      LEU  48   1.459  -1.554   3.768
  371   HD11  LEU  48          1HD1      LEU  48  -1.507  -0.115   1.923
  372   HD12  LEU  48          2HD1      LEU  48  -1.792  -0.231   3.662
  373   HD13  LEU  48          3HD1      LEU  48  -2.561  -1.372   2.564
  374   HD21  LEU  48          3HD2      LEU  48  -1.353  -3.019   1.415
  375   HD22  LEU  48          1HD2      LEU  48   0.301  -3.443   1.857
  376   HD23  LEU  48          2HD2      LEU  48  -0.006  -2.051   0.817
  377    H    LEU  49           H        LEU  49  -1.367   1.531   4.555
  378    HA   LEU  49           HA       LEU  49  -0.745   0.944   7.365
  379    HG   LEU  49           HG       LEU  49  -1.471   2.376   8.981
  380    HB2  LEU  49           2HB      LEU  49  -1.618   3.255   6.399
  381    HB3  LEU  49           1HB      LEU  49  -3.173   2.467   6.557
  382   HD11  LEU  49          1HD1      LEU  49  -1.363   4.733   7.719
  383   HD12  LEU  49          2HD1      LEU  49  -1.422   4.579   9.476
  384   HD13  LEU  49          3HD1      LEU  49  -2.895   4.932   8.571
  385   HD21  LEU  49          3HD2      LEU  49  -4.351   3.131   8.498
  386   HD22  LEU  49          1HD2      LEU  49  -3.594   2.788  10.054
  387   HD23  LEU  49          2HD2      LEU  49  -3.777   1.503   8.857
  388    H    ALA  50           H        ALA  50  -1.725  -0.685   8.426
  389    HA   ALA  50           HA       ALA  50  -4.243  -1.697   7.341
  390    HB1  ALA  50           3HB      ALA  50  -3.431  -3.943   7.175
  391    HB2  ALA  50           1HB      ALA  50  -1.849  -3.458   7.776
  392    HB3  ALA  50           2HB      ALA  50  -2.420  -2.878   6.212
  393    H    HIS  51           H        HIS  51  -5.619  -1.748   8.951
  394    HA   HIS  51           HA       HIS  51  -4.719  -2.691  11.561
  395    HD1  HIS  51           1HD      HIS  51  -7.758  -0.112  13.656
  396    HD2  HIS  51           2HD      HIS  51  -3.942  -1.737  13.384
  397    HE1  HIS  51           1HE      HIS  51  -6.819  -0.018  15.985
  398    HE2  HIS  51           2HE      HIS  51  -4.544  -1.086  15.812
  399    HB2  HIS  51           2HB      HIS  51  -5.882  -0.274  11.032
  400    HB3  HIS  51           1HB      HIS  51  -7.296  -1.242  11.416
  401    HA   PRO  52           HA       PRO  52  -7.269  -6.273  11.558
  402    HB2  PRO  52           2HB      PRO  52  -9.035  -4.965  13.584
  403    HB3  PRO  52           1HB      PRO  52  -8.313  -6.579  13.589
  404    HG2  PRO  52           2HG      PRO  52  -7.250  -4.651  15.054
  405    HG3  PRO  52           1HG      PRO  52  -6.207  -5.779  14.171
  406    HD2  PRO  52           2HD      PRO  52  -6.883  -2.941  13.545
  407    HD3  PRO  52           1HD      PRO  52  -5.366  -3.817  13.283
  408    H    ASP  53           H        ASP  53  -8.905  -3.203  11.050
  409    HA   ASP  53           HA       ASP  53 -10.840  -4.658   9.417
  410    HB2  ASP  53           2HB      ASP  53 -11.744  -4.064  11.756
  411    HB3  ASP  53           1HB      ASP  53 -11.792  -2.407  11.165
  412    H    HIS  54           H        HIS  54  -8.575  -2.273   9.374
  413    HA   HIS  54           HA       HIS  54  -9.834  -1.210   6.992
  414    HD1  HIS  54           1HD      HIS  54  -7.170   1.888   8.624
  415    HD2  HIS  54           2HD      HIS  54  -9.783   0.081  11.299
  416    HE1  HIS  54           1HE      HIS  54  -6.240   2.381  10.906
  417    HE2  HIS  54           2HE      HIS  54  -7.931   1.423  12.507
  418    HB2  HIS  54           2HB      HIS  54  -9.380   1.148   7.569
  419    HB3  HIS  54           1HB      HIS  54 -10.577   0.400   8.609
  420    H    VAL  55           H        VAL  55  -8.360  -0.035   5.546
  421    HA   VAL  55           HA       VAL  55  -5.530  -0.383   6.140
  422    HB   VAL  55           HB       VAL  55  -6.635  -2.369   4.817
  423   HG11  VAL  55          1HG1      VAL  55  -6.904  -2.181   2.548
  424   HG12  VAL  55          2HG1      VAL  55  -5.839  -0.781   2.430
  425   HG13  VAL  55          3HG1      VAL  55  -7.465  -0.597   3.083
  426   HG21  VAL  55          3HG2      VAL  55  -4.039  -1.167   3.890
  427   HG22  VAL  55          1HG2      VAL  55  -4.516  -2.862   3.794
  428   HG23  VAL  55          2HG2      VAL  55  -4.248  -2.110   5.366
  429    H    LEU  56           H        LEU  56  -4.252   1.142   5.245
  430    HA   LEU  56           HA       LEU  56  -5.508   3.085   3.417
  431    HG   LEU  56           HG       LEU  56  -6.330   4.698   5.320
  432    HB2  LEU  56           2HB      LEU  56  -4.309   3.486   6.010
  433    HB3  LEU  56           1HB      LEU  56  -3.371   4.340   4.807
  434   HD11  LEU  56          1HD1      LEU  56  -5.800   6.716   6.412
  435   HD12  LEU  56          2HD1      LEU  56  -4.114   6.641   5.904
  436   HD13  LEU  56          3HD1      LEU  56  -4.726   5.497   7.100
  437   HD21  LEU  56          3HD2      LEU  56  -5.722   6.856   3.944
  438   HD22  LEU  56          1HD2      LEU  56  -6.159   5.358   3.125
  439   HD23  LEU  56          2HD2      LEU  56  -4.463   5.818   3.282
  440    H    MET  57           H        MET  57  -4.221   3.920   1.767
  441    HA   MET  57           HA       MET  57  -1.593   2.650   1.434
  442    HB2  MET  57           2HB      MET  57  -3.415   3.154  -0.894
  443    HB3  MET  57           1HB      MET  57  -2.033   2.071  -0.792
  444    HG2  MET  57           2HG      MET  57  -3.269   0.585   0.686
  445    HG3  MET  57           1HG      MET  57  -4.646   1.690   0.651
  446    HE1  MET  57           3HE      MET  57  -6.730  -0.160  -1.595
  447    HE2  MET  57           1HE      MET  57  -6.535   1.592  -1.625
  448    HE3  MET  57           2HE      MET  57  -6.431   0.719  -0.096
  449    H    ILE  58           H        ILE  58  -0.072   4.219   1.454
  450    HA   ILE  58           HA       ILE  58  -0.696   6.745   0.079
  451    HB   ILE  58           HB       ILE  58   1.121   6.402   2.472
  452   HG12  ILE  58          2HG1      ILE  58  -1.744   6.719   2.329
  453   HG13  ILE  58          1HG1      ILE  58  -0.729   6.498   3.741
  454   HG21  ILE  58          1HG2      ILE  58   0.175   8.888   1.059
  455   HG22  ILE  58          2HG2      ILE  58   1.790   8.182   0.943
  456   HG23  ILE  58          3HG2      ILE  58   1.220   8.832   2.480
  457   HD11  ILE  58          3HD1      ILE  58  -2.211   8.588   3.592
  458   HD12  ILE  58          1HD1      ILE  58  -0.994   9.193   2.466
  459   HD13  ILE  58          2HD1      ILE  58  -0.539   8.776   4.118
  460    H    LEU  59           H        LEU  59   0.815   7.510  -1.347
  461    HA   LEU  59           HA       LEU  59   3.300   5.953  -1.591
  462    HG   LEU  59           HG       LEU  59   1.468   7.013  -5.298
  463    HB2  LEU  59           2HB      LEU  59   3.161   5.905  -3.914
  464    HB3  LEU  59           1HB      LEU  59   1.529   5.563  -3.386
  465   HD11  LEU  59          1HD1      LEU  59  -0.229   7.313  -3.580
  466   HD12  LEU  59          2HD1      LEU  59   0.133   8.824  -4.415
  467   HD13  LEU  59          3HD1      LEU  59   0.781   8.531  -2.803
  468   HD21  LEU  59          3HD2      LEU  59   3.789   8.108  -4.426
  469   HD22  LEU  59          1HD2      LEU  59   2.632   9.366  -4.004
  470   HD23  LEU  59          2HD2      LEU  59   2.753   8.809  -5.665
  471    H    ASN  60           H        ASN  60   5.172   7.017  -2.130
  472    HA   ASN  60           HA       ASN  60   5.014   9.963  -2.193
  473    HB2  ASN  60           2HB      ASN  60   6.218   8.504  -0.172
  474    HB3  ASN  60           1HB      ASN  60   7.567   8.857  -1.248
  475   HD21  ASN  60          1HD2      ASN  60   6.590  11.350  -2.200
  476   HD22  ASN  60          2HD2      ASN  60   6.710  12.482  -0.902
  477    H    SER  61           H        SER  61   5.264  10.359  -4.318
  478    HA   SER  61           HA       SER  61   7.742   9.336  -5.557
  479    HG   SER  61           HG       SER  61   5.848   7.093  -5.626
  480    HB2  SER  61           2HB      SER  61   5.355   9.299  -7.305
  481    HB3  SER  61           1HB      SER  61   6.741   8.217  -7.275
  482    HA   PRO  62           HA       PRO  62   8.083  13.507  -7.057
  483    HB2  PRO  62           2HB      PRO  62  10.066  13.087  -8.824
  484    HB3  PRO  62           1HB      PRO  62  10.309  13.087  -7.076
  485    HG2  PRO  62           2HG      PRO  62   9.937  10.740  -8.908
  486    HG3  PRO  62           1HG      PRO  62  11.174  10.991  -7.659
  487    HD2  PRO  62           2HD      PRO  62   8.999   9.515  -7.191
  488    HD3  PRO  62           1HD      PRO  62   9.692  10.555  -5.934
  489    H    ASP  63           H        ASP  63   6.908  10.885  -8.906
  490    HA   ASP  63           HA       ASP  63   5.978  12.796 -10.912
  491    HB2  ASP  63           2HB      ASP  63   6.513  11.217 -12.754
  492    HB3  ASP  63           1HB      ASP  63   7.951  11.825 -11.938
  493    H    GLU  64           H        GLU  64   3.952  12.226 -11.869
  494    HA   GLU  64           HA       GLU  64   2.267  10.639 -10.223
  495    HB2  GLU  64           2HB      GLU  64   1.877  11.911 -12.904
  496    HB3  GLU  64           1HB      GLU  64   0.784  10.620 -12.439
  497    HG2  GLU  64           2HG      GLU  64  -0.349  12.395 -11.603
  498    HG3  GLU  64           1HG      GLU  64   0.632  11.970 -10.195
  499    H    ASP  65           H        ASP  65   3.911   9.776 -13.299
  500    HA   ASP  65           HA       ASP  65   2.812   7.294 -13.762
  501    HB2  ASP  65           2HB      ASP  65   4.629   8.438 -15.100
  502    HB3  ASP  65           1HB      ASP  65   5.773   7.880 -13.880
  503    H    SER  66           H        SER  66   5.609   8.053 -11.718
  504    HA   SER  66           HA       SER  66   5.891   5.506 -10.535
  505    HG   SER  66           HG       SER  66   6.655   6.243  -7.978
  506    HB2  SER  66           2HB      SER  66   7.628   7.289 -10.422
  507    HB3  SER  66           1HB      SER  66   6.577   8.202  -9.337
  508    H    LEU  67           H        LEU  67   4.473   8.470  -9.330
  509    HA   LEU  67           HA       LEU  67   3.350   7.835  -6.972
  510    HG   LEU  67           HG       LEU  67   1.172   9.616  -6.502
  511    HB2  LEU  67           2HB      LEU  67   3.214  10.037  -7.805
  512    HB3  LEU  67           1HB      LEU  67   2.380   9.532  -9.245
  513   HD11  LEU  67          1HD1      LEU  67   1.569  11.634  -8.519
  514   HD12  LEU  67          2HD1      LEU  67   1.056  11.792  -6.840
  515   HD13  LEU  67          3HD1      LEU  67  -0.129  11.428  -8.093
  516   HD21  LEU  67          3HD2      LEU  67   0.118   8.789  -9.160
  517   HD22  LEU  67          1HD2      LEU  67  -0.957   9.558  -7.994
  518   HD23  LEU  67          2HD2      LEU  67  -0.141   8.054  -7.576
  519    H    ALA  68           H        ALA  68   1.521   7.481 -10.031
  520    HA   ALA  68           HA       ALA  68  -0.585   6.048  -8.786
  521    HB1  ALA  68           3HB      ALA  68  -1.216   7.058 -10.778
  522    HB2  ALA  68           1HB      ALA  68  -1.050   5.369 -11.257
  523    HB3  ALA  68           2HB      ALA  68   0.231   6.521 -11.633
  524    H    HIS  69           H        HIS  69   2.379   5.074 -10.426
  525    HA   HIS  69           HA       HIS  69   1.903   2.357 -10.741
  526    HD1  HIS  69           1HD      HIS  69   3.019   0.446 -10.183
  527    HD2  HIS  69           2HD      HIS  69   6.517   2.072 -11.726
  528    HE1  HIS  69           1HE      HIS  69   4.476  -1.521 -10.759
  529    HE2  HIS  69           2HE      HIS  69   6.553  -0.514 -11.771
  530    HB2  HIS  69           2HB      HIS  69   3.914   3.597 -11.575
  531    HB3  HIS  69           1HB      HIS  69   4.537   3.601  -9.929
  532    H    MET  70           H        MET  70   2.903   4.191  -7.922
  533    HA   MET  70           HA       MET  70   3.277   1.861  -6.268
  534    HB2  MET  70           2HB      MET  70   3.047   4.758  -5.448
  535    HB3  MET  70           1HB      MET  70   3.713   3.455  -4.477
  536    HG2  MET  70           2HG      MET  70   4.854   4.605  -6.997
  537    HG3  MET  70           1HG      MET  70   5.499   4.738  -5.365
  538    HE1  MET  70           3HE      MET  70   6.306   3.883  -8.276
  539    HE2  MET  70           1HE      MET  70   6.458   2.154  -8.587
  540    HE3  MET  70           2HE      MET  70   7.758   3.021  -7.769
  541    H    GLN  71           H        GLN  71   0.894   4.568  -6.131
  542    HA   GLN  71           HA       GLN  71  -0.698   3.475  -4.161
  543    HB2  GLN  71           2HB      GLN  71  -2.622   4.760  -5.410
  544    HB3  GLN  71           1HB      GLN  71  -1.369   5.624  -4.543
  545    HG2  GLN  71           2HG      GLN  71  -0.724   6.659  -6.390
  546    HG3  GLN  71           1HG      GLN  71  -0.656   5.153  -7.304
  547   HE21  GLN  71          1HE2      GLN  71  -2.243   4.691  -8.711
  548   HE22  GLN  71          2HE2      GLN  71  -3.640   5.674  -8.973
  549    H    ASN  72           H        ASN  72  -0.525   2.601  -7.520
  550    HA   ASN  72           HA       ASN  72  -2.987   1.093  -7.454
  551    HB2  ASN  72           2HB      ASN  72  -1.711   2.232  -9.498
  552    HB3  ASN  72           1HB      ASN  72  -0.975   0.635  -9.598
  553   HD21  ASN  72          1HD2      ASN  72  -4.089   2.286  -9.438
  554   HD22  ASN  72          2HD2      ASN  72  -4.952   1.127 -10.385
  555    H    VAL  73           H        VAL  73   0.490   0.358  -7.428
  556    HA   VAL  73           HA       VAL  73   0.528  -2.353  -7.636
  557    HB   VAL  73           HB       VAL  73   2.169  -0.486  -5.955
  558   HG11  VAL  73          1HG1      VAL  73   2.167  -2.481  -4.623
  559   HG12  VAL  73          2HG1      VAL  73   3.709  -2.380  -5.472
  560   HG13  VAL  73          3HG1      VAL  73   2.459  -3.486  -6.043
  561   HG21  VAL  73          3HG2      VAL  73   2.238  -1.052  -8.583
  562   HG22  VAL  73          1HG2      VAL  73   3.361  -2.268  -7.975
  563   HG23  VAL  73          2HG2      VAL  73   3.652  -0.560  -7.651
  564    H    VAL  74           H        VAL  74  -0.153  -0.508  -4.677
  565    HA   VAL  74           HA       VAL  74  -0.545  -2.795  -3.035
  566    HB   VAL  74           HB       VAL  74  -1.548   0.029  -2.675
  567   HG11  VAL  74          1HG1      VAL  74  -1.379  -2.137  -0.585
  568   HG12  VAL  74          2HG1      VAL  74  -2.866  -1.659  -1.401
  569   HG13  VAL  74          3HG1      VAL  74  -2.009  -0.504  -0.382
  570   HG21  VAL  74          3HG2      VAL  74   0.557   0.513  -2.144
  571   HG22  VAL  74          1HG2      VAL  74   1.040  -1.172  -2.339
  572   HG23  VAL  74          2HG2      VAL  74   0.432  -0.602  -0.786
  573    H    ALA  75           H        ALA  75  -2.799  -0.659  -4.795
  574    HA   ALA  75           HA       ALA  75  -5.217  -1.691  -3.969
  575    HB1  ALA  75           3HB      ALA  75  -4.451  -0.746  -6.732
  576    HB2  ALA  75           1HB      ALA  75  -5.114   0.235  -5.424
  577    HB3  ALA  75           2HB      ALA  75  -6.103  -1.013  -6.179
  578    H    ASP  76           H        ASP  76  -2.788  -3.117  -5.950
  579    HA   ASP  76           HA       ASP  76  -4.464  -5.164  -7.078
  580    HB2  ASP  76           2HB      ASP  76  -2.072  -4.149  -7.811
  581    HB3  ASP  76           1HB      ASP  76  -1.536  -5.590  -6.952
  582    H    HIS  77           H        HIS  77  -2.189  -4.919  -4.386
  583    HA   HIS  77           HA       HIS  77  -2.171  -7.661  -3.711
  584    HD1  HIS  77           1HD      HIS  77   0.979  -4.856  -1.682
  585    HD2  HIS  77           2HD      HIS  77  -0.037  -7.627  -4.610
  586    HE1  HIS  77           1HE      HIS  77   3.066  -5.195  -3.040
  587    HE2  HIS  77           2HE      HIS  77   2.404  -6.809  -4.857
  588    HB2  HIS  77           2HB      HIS  77  -1.615  -5.235  -2.004
  589    HB3  HIS  77           1HB      HIS  77  -1.359  -6.871  -1.472
  590    H    LEU  78           H        LEU  78  -4.218  -4.986  -2.527
  591    HA   LEU  78           HA       LEU  78  -5.575  -6.426  -0.558
  592    HG   LEU  78           HG       LEU  78  -4.821  -3.238  -0.773
  593    HB2  LEU  78           2HB      LEU  78  -6.430  -4.092  -2.266
  594    HB3  LEU  78           1HB      LEU  78  -7.423  -4.735  -0.975
  595   HD11  LEU  78          1HD1      LEU  78  -7.013  -2.056  -0.783
  596   HD12  LEU  78          2HD1      LEU  78  -6.054  -1.806   0.675
  597   HD13  LEU  78          3HD1      LEU  78  -7.425  -2.916   0.701
  598   HD21  LEU  78          3HD2      LEU  78  -5.131  -3.767   1.756
  599   HD22  LEU  78          1HD2      LEU  78  -4.297  -4.928   0.722
  600   HD23  LEU  78          2HD2      LEU  78  -5.981  -5.195   1.170
  601    H    GLN  79           H        GLN  79  -5.838  -6.466  -4.009
  602    HA   GLN  79           HA       GLN  79  -8.445  -7.604  -4.163
  603    HB2  GLN  79           2HB      GLN  79  -6.277  -7.881  -6.237
  604    HB3  GLN  79           1HB      GLN  79  -8.016  -7.922  -6.484
  605    HG2  GLN  79           2HG      GLN  79  -7.425  -5.445  -5.287
  606    HG3  GLN  79           1HG      GLN  79  -6.233  -5.699  -6.559
  607   HE21  GLN  79          1HE2      GLN  79  -7.799  -3.656  -6.976
  608   HE22  GLN  79          2HE2      GLN  79  -9.023  -3.988  -8.150
  609    H    ARG  80           H        ARG  80  -5.182  -9.010  -4.391
  610    HA   ARG  80           HA       ARG  80  -5.932 -11.657  -4.842
  611    HE   ARG  80           HE       ARG  80  -4.010 -13.258  -6.956
  612    HB2  ARG  80           2HB      ARG  80  -3.542 -10.584  -3.331
  613    HB3  ARG  80           1HB      ARG  80  -3.721 -12.251  -3.862
  614    HG2  ARG  80           2HG      ARG  80  -4.172 -10.593  -6.096
  615    HG3  ARG  80           1HG      ARG  80  -2.710 -10.017  -5.295
  616    HD2  ARG  80           2HD      ARG  80  -2.227 -11.719  -7.001
  617    HD3  ARG  80           1HD      ARG  80  -1.752 -12.242  -5.388
  618   HH11  ARG  80          1HH1      ARG  80  -2.018 -13.452  -4.087
  619   HH12  ARG  80          2HH1      ARG  80  -2.600 -15.021  -3.645
  620   HH21  ARG  80          1HH2      ARG  80  -4.769 -15.316  -6.366
  621   HH22  ARG  80          2HH2      ARG  80  -4.159 -16.077  -4.935
  622    H    MET  81           H        MET  81  -5.634  -9.822  -1.892
  623    HA   MET  81           HA       MET  81  -6.179 -12.106  -0.206
  624    HB2  MET  81           2HB      MET  81  -6.110 -10.513   1.648
  625    HB3  MET  81           1HB      MET  81  -4.711 -10.366   0.602
  626    HG2  MET  81           2HG      MET  81  -5.287  -8.178   1.119
  627    HG3  MET  81           1HG      MET  81  -5.927  -8.426  -0.501
  628    HE1  MET  81           3HE      MET  81  -7.675  -7.239   3.291
  629    HE2  MET  81           1HE      MET  81  -7.580  -6.013   2.026
  630    HE3  MET  81           2HE      MET  81  -6.148  -6.951   2.455
  631    H    ALA  82           H        ALA  82  -8.087 -10.017  -2.029
  632    HA   ALA  82           HA       ALA  82 -10.463 -10.747  -0.433
  633    HB1  ALA  82           3HB      ALA  82 -10.151  -8.413  -0.081
  634    HB2  ALA  82           1HB      ALA  82 -11.483  -8.593  -1.224
  635    HB3  ALA  82           2HB      ALA  82  -9.882  -8.124  -1.799
  636    H    ASN  83           H        ASN  83 -11.407 -12.311  -1.591
  637    HA   ASN  83           HA       ASN  83 -11.538 -12.044  -4.510
  638    HB2  ASN  83           2HB      ASN  83 -10.803 -14.195  -3.062
  639    HB3  ASN  83           1HB      ASN  83 -12.530 -14.509  -3.197
  640   HD21  ASN  83          1HD2      ASN  83 -11.129 -16.348  -4.321
  641   HD22  ASN  83          2HD2      ASN  83 -11.053 -16.194  -6.040
  642    H    SER  84           H        SER  84 -13.261 -10.823  -5.032
  643    HA   SER  84           HA       SER  84 -15.847 -11.832  -4.934
  644    HG   SER  84           HG       SER  84 -14.569  -9.171  -2.838
  645    HB2  SER  84           2HB      SER  84 -16.704  -9.886  -3.329
  646    HB3  SER  84           1HB      SER  84 -16.237 -11.465  -2.698
  647    H    GLU  85           H        GLU  85 -13.860  -8.927  -4.934
  648    HA   GLU  85           HA       GLU  85 -15.100  -8.041  -7.388
  649    HB2  GLU  85           2HB      GLU  85 -15.825  -5.892  -6.597
  650    HB3  GLU  85           1HB      GLU  85 -16.574  -7.121  -5.588
  651    HG2  GLU  85           2HG      GLU  85 -14.078  -6.325  -4.432
  652    HG3  GLU  85           1HG      GLU  85 -15.058  -4.900  -4.779
  653    H    SER  86           H        SER  86 -13.976  -6.106  -8.286
  654    HA   SER  86           HA       SER  86 -11.150  -6.387  -7.947
  655    HG   SER  86           HG       SER  86 -13.847  -4.690  -9.704
  656    HB2  SER  86           2HB      SER  86 -11.027  -4.516  -9.606
  657    HB3  SER  86           1HB      SER  86 -12.023  -5.867 -10.148
  658    H    LEU  87           H        LEU  87 -11.329  -5.929  -5.603
  659    HA   LEU  87           HA       LEU  87 -11.474  -4.498  -3.765
  660    HG   LEU  87           HG       LEU  87  -7.964  -4.642  -3.243
  661    HB2  LEU  87           2HB      LEU  87  -9.023  -4.398  -5.234
  662    HB3  LEU  87           1HB      LEU  87  -9.325  -2.820  -4.534
  663   HD11  LEU  87          1HD1      LEU  87  -9.953  -2.658  -2.220
  664   HD12  LEU  87          2HD1      LEU  87  -8.191  -2.563  -2.254
  665   HD13  LEU  87          3HD1      LEU  87  -8.995  -3.619  -1.093
  666   HD21  LEU  87          3HD2      LEU  87  -9.775  -6.339  -3.312
  667   HD22  LEU  87          1HD2      LEU  87 -10.755  -5.277  -2.301
  668   HD23  LEU  87          2HD2      LEU  87  -9.244  -5.935  -1.682
  669    H    GLU  88           H        GLU  88 -13.062  -3.074  -3.441
  670    HA   GLU  88           HA       GLU  88 -13.448  -0.798  -5.146
  671    HB2  GLU  88           2HB      GLU  88 -15.302  -1.858  -3.856
  672    HB3  GLU  88           1HB      GLU  88 -14.531  -1.329  -2.367
  673    HG2  GLU  88           2HG      GLU  88 -15.313   0.753  -2.558
  674    HG3  GLU  88           1HG      GLU  88 -14.986   0.822  -4.289
  675    H    ILE  89           H        ILE  89 -11.635   0.489  -5.175
  676    HA   ILE  89           HA       ILE  89 -10.857   1.633  -2.590
  677    HB   ILE  89           HB       ILE  89  -8.546   1.571  -3.087
  678   HG12  ILE  89          2HG1      ILE  89  -9.032   2.035  -5.655
  679   HG13  ILE  89          1HG1      ILE  89  -7.538   1.282  -5.135
  680   HG21  ILE  89          1HG2      ILE  89  -8.224  -0.905  -3.771
  681   HG22  ILE  89          2HG2      ILE  89  -9.982  -0.967  -3.678
  682   HG23  ILE  89          3HG2      ILE  89  -9.039  -0.506  -2.262
  683   HD11  ILE  89          3HD1      ILE  89  -8.433   0.150  -7.065
  684   HD12  ILE  89          1HD1      ILE  89  -9.954  -0.138  -6.221
  685   HD13  ILE  89          2HD1      ILE  89  -8.472  -0.918  -5.661
  686    H    ALA  90           H        ALA  90 -10.895   3.853  -2.517
  687    HA   ALA  90           HA       ALA  90 -11.223   5.218  -5.096
  688    HB1  ALA  90           3HB      ALA  90 -12.881   5.582  -3.181
  689    HB2  ALA  90           1HB      ALA  90 -12.222   7.021  -3.959
  690    HB3  ALA  90           2HB      ALA  90 -11.592   6.501  -2.396
  691    H    TRP  91           H        TRP  91  -9.386   5.849  -5.951
  692    HA   TRP  91           HA       TRP  91  -7.145   6.591  -4.244
  693    HD1  TRP  91           HD       TRP  91  -8.799   4.613  -7.755
  694    HE1  TRP  91           1HE      TRP  91  -9.309   5.530 -10.104
  695    HE3  TRP  91           3HE      TRP  91  -5.585   8.590  -7.791
  696    HZ2  TRP  91           2HZ      TRP  91  -8.462   7.658 -11.755
  697    HZ3  TRP  91           3HZ      TRP  91  -5.497  10.016  -9.794
  698    HH2  TRP  91           HH       TRP  91  -6.906   9.558 -11.734
  699    HB2  TRP  91           2HB      TRP  91  -5.821   6.561  -6.312
  700    HB3  TRP  91           1HB      TRP  91  -6.705   5.054  -6.095
  701    H    GLN  92           H        GLN  92  -6.421   8.599  -3.966
  702    HA   GLN  92           HA       GLN  92  -7.959  10.775  -5.133
  703    HB2  GLN  92           2HB      GLN  92  -5.806  10.738  -3.011
  704    HB3  GLN  92           1HB      GLN  92  -6.628  12.195  -3.557
  705    HG2  GLN  92           2HG      GLN  92  -8.747  11.331  -2.770
  706    HG3  GLN  92           1HG      GLN  92  -7.976   9.818  -2.294
  707   HE21  GLN  92          1HE2      GLN  92  -9.460  11.652  -0.643
  708   HE22  GLN  92          2HE2      GLN  92  -8.386  12.188   0.599
  709    HA   PRO  93           HA       PRO  93  -5.286  12.104  -8.356
  710    HB2  PRO  93           2HB      PRO  93  -5.108  14.692  -6.895
  711    HB3  PRO  93           1HB      PRO  93  -5.483  14.388  -8.595
  712    HG2  PRO  93           2HG      PRO  93  -7.416  15.002  -6.862
  713    HG3  PRO  93           1HG      PRO  93  -7.681  13.811  -8.148
  714    HD2  PRO  93           2HD      PRO  93  -7.300  13.396  -5.231
  715    HD3  PRO  93           1HD      PRO  93  -8.223  12.432  -6.401
  716    H    ALA  94           H        ALA  94  -4.320  13.097  -5.089
  717    HA   ALA  94           HA       ALA  94  -2.298  12.536  -4.047
  718    HB1  ALA  94           3HB      ALA  94  -0.482  11.628  -5.119
  719    HB2  ALA  94           1HB      ALA  94  -0.762  12.551  -6.594
  720    HB3  ALA  94           2HB      ALA  94  -1.770  11.153  -6.229
  721    H    GLU  95           H        GLU  95  -3.487  15.053  -4.667
  722    HA   GLU  95           HA       GLU  95  -1.073  16.725  -4.612
  723    HB2  GLU  95           2HB      GLU  95  -3.565  17.178  -6.247
  724    HB3  GLU  95           1HB      GLU  95  -2.450  18.480  -5.853
  725    HG2  GLU  95           2HG      GLU  95  -0.757  16.601  -6.847
  726    HG3  GLU  95           1HG      GLU  95  -2.209  16.316  -7.804
  727    H    SER  96           H        SER  96  -1.181  18.554  -3.305
  728    HA   SER  96           HA       SER  96  -3.626  18.900  -1.716
  729    HG   SER  96           HG       SER  96  -2.861  17.215   0.498
  730    HB2  SER  96           2HB      SER  96  -0.814  18.639  -0.628
  731    HB3  SER  96           1HB      SER  96  -2.192  19.200   0.319